A0A3Q0KE94_SCHMA Loading...

Putative alpha-actinin

AlphaFold DB , UniProt , Accession A0A3Q0KE94, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 899 aa.

						>A0A3Q0KE94_SCHMA|A0A3Q0KE94
MEYGYTVYPDEYFPSVQEEEEEEWDRQAYLDPMWEIQQKKTFTAWCNSYLRKVKCSIENIEEDFTDGLKLIQLLETLSEEPLPKPDRGKMRFHKLANVNKALDYIESKGVQLVSIGAEEIVDGNIKMTLGMIWTIILRFCIQDITVEEMSAKEGLLLWCQRKTAPYKNVNVQNFHMSWKDGLAFCALIHRHRPDLIDYSKLSKDNPIQNLNYAFDVAEKHLDIPRMLDAEDMVNTVRPDERSVMTYVSAYYHAFAGAQKAESAANRITKVLKSNQNNEKLMREYEQLASDLLAWIEQQIPFLKDRTTDGTISGARSKLDHYRGYRGFEKPPRLDEKTLLENTYNTLQTRLRLANRPSFLPTEGHMIEDIDSAWRQLENYEKGFEDWLVAEIKRLEQIEYLAKKFRLKCLTHEAWADGKANSLSLEDYEGASLSTLRALAQKHASFEGDLGAHQNRVERIVAIAEELNQLNYDEVQSVNERTQNIVEQWDNLGRLSEIRKHKIQGILDLLNQIDQLHLSIAKRIAPFNNWLEQVHEDLQDMFIVNKVEDVMSLINGHENFKKTLPAAQKELNDIITEAEQVKKLIQSHNLSSELLKNPYTMIDCSTLQSRWDAMYSLISGRDDALHQELVKQQENDKVNTQFAQLANRFGPYLEHNLETVHSIVTNQKLSLEDQLQRLNKVEEDLEGWKPTITELEKLHQKQQGFLITHNPHTRYTMETLRVGWEQLKTNIKRGQNEIENRITANDYRGVTEQQIEECRRCFNHFDKHRTRRLDPLDFRACLVSLGFTIPNSSQGEADFMRIMKTVDPHCTGYVTFDAFMQFMSQQTMGADTVEQMVNSFRTLAGDTPYITTEQLKRELEPELADYCINRMKAYNGPGVANGGALDYTSFAASLYGESEL
					

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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	42	Very low	43	Very low	223 Å²	223	165.4 Å²	165.4	100%	1.099	83%	0.829	S	S	*	*				0	61.1	0	-57.2	-162	-102.8	0	0	108.9
2	E	40.4	Very low	43.2	Very low	174 Å²	174	168.3 Å²	168.3	81%	0.813	83%	0.825	S	S	*	*			cis	51.9	109.9	42.7	-64.6	170.6	138.4	0	0	113
3	Y	47.8	Very low	43.7	Very low	239 Å²	239	168.2 Å²	168.2	94%	0.937	82%	0.818	S	S	*	*				-160.2	127.3	122.4	-88.7	-67.4	0	0	0	107.1
4	G	38.2	Very low	43.8	Very low	69 Å²	69	161 Å²	161	71%	0.711	79%	0.791	S	S	*	*			trans	-108.5	170.4	179.5	0	0	0	0	0	112.5
5	Y	45	Very low	44.4	Very low	222 Å²	222	153.7 Å²	153.7	87%	0.871	76%	0.762	S	S	*	*			trans	-138.1	108.3	171.6	-93.6	-85.7	0	0	0	111.9
6	T	43.8	Very low	45.3	Very low	107 Å²	107	150.4 Å²	150.4	66%	0.656	75%	0.753	S	S	*	*			trans	32.5	117	139.9	54.2	0	0	0	0	120.4
7	V	39.9	Very low	45.8	Very low	144 Å²	144	149.6 Å²	149.6	87%	0.873	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-81.9	137.8	152	176.3	0	0	0	0	108.6
8	Y	45	Very low	46.5	Very low	203 Å²	203	145.8 Å²	145.8	80%	0.796	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-85.2	142.2	170.6	-75.2	-92.5	0	0	0	110.3
9	P	45.2	Very low	47.1	Very low	113 Å²	113	144.4 Å²	144.4	73%	0.734	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-77.4	143.1	166.6	5.5	11.5	0	0	0	110.3	E11	P9-E11 PolarHBondContact O-N 3.17Å
10	D	42.1	Very low	47.8	Very low	163 Å²	163	142 Å²	142	87%	0.872	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-66.1	128	170	-70.5	-52.8	0	0	0	110.6	Y12	D10-Y12 PolarHBondContact O-N 3.44Å
11	E	43.3	Very low	48.4	Very low	162 Å²	162	139.5 Å²	139.5	76%	0.757	69%	0.69	S	S	*	*			trans	-76.3	107.8	171.6	-70.7	-177.8	154.9	0	0	109.5	P9 F13	P9-E11 PolarHBondContact O-N 3.17Å; E11-F13 HydrophobicContact CB-CD2 4.46Å; E11-F13 HydrophobicContact CB-CE2 4.08Å; E11-F13 PolarHBondContact O-N 3.19Å
12	Y	45.1	Very low	49.2	Very low	200 Å²	200	134.3 Å²	134.3	78%	0.784	66%	0.663	S	S	*	*			trans	-77.1	101.4	176	-150.4	-88.7	0	0	0	109.3	D10	D10-Y12 PolarHBondContact O-N 3.44Å
13	F	49.5	Very low	50.2	Low	167 Å²	167	131.5 Å²	131.5	73%	0.732	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-81	122	168.6	-77.1	-92.4	0	0	0	108.9	E11	E11-F13 HydrophobicContact CB-CD2 4.46Å; E11-F13 HydrophobicContact CB-CE2 4.08Å; E11-F13 PolarHBondContact O-N 3.19Å
14	P	46.2	Very low	50.8	Low	68 Å²	68	122.9 Å²	122.9	44%	0.442	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-60.1	146.3	172.9	-16.4	28.8	0	0	0	110.5	E18 E19	P14-E18 HydrophobicContact CB-CB 4.11Å; P14-E19 HydrophobicContact CB-CG 4.26Å
15	S	52.2	Low	51.9	Low	51 Å²	51	123.4 Å²	123.4	36%	0.357	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-71.6	156.4	169.4	66.2	0	0	0	0	110.9	Q17 E18 E19	S15-Q17 PolarHBondContact O-N 3.35Å; S15-E18 WeakPolarHBondContact CB-OE2 3.26Å; S15-E18 PolarHBondContact N-OE2 3.08Å; S15-E18 PolarHBondContact O-N 2.98Å; S15-E18 WeakPolarHBondContact OG-CG 3.46Å; S15-E18 PolarHBondContact OG-N 3.03Å; S15-E18 PolarHBondContact OG-OE2 2.96Å; S15-E19 PolarHBondContact O-N 3.01Å
16	V	58.2	Low	52.6	Low	101 Å²	101	120.2 Å²	120.2	61%	0.612	59%	0.589	S	S	*	*	H	α-helix	trans	-56	-28.2	176.6	-180	0	0	0	0	112	E20	V16-E20 WeakPolarHBondContact O-CG 3.31Å; V16-E20 PolarHBondContact O-N 3.34Å
17	Q	54.8	Low	53.2	Low	138 Å²	138	119.2 Å²	119.2	65%	0.645	58%	0.577	S	S	*	*	H	α-helix	trans	-71.8	-37.7	175.3	-64.4	-173.9	-61.3	0	0	112.5	S15 E20 E21	S15-Q17 PolarHBondContact O-N 3.35Å; Q17-E20 PolarHBondContact O-N 3.47Å; Q17-E21 WeakPolarHBondContact O-CB 3.26Å; Q17-E21 WeakPolarHBondContact O-CG 3.39Å; Q17-E21 PolarHBondContact O-N 3.35Å
18	E	58.4	Low	53.9	Low	80 Å²	80	114 Å²	114	37%	0.374	55%	0.549	S	S	.	.	H	α-helix	trans	-69.5	-36.1	174.8	-71.2	161.3	133.6	0	0	111.4	P14 S15 E21 E22	P14-E18 HydrophobicContact CB-CB 4.11Å; S15-E18 WeakPolarHBondContact CB-OE2 3.26Å; S15-E18 PolarHBondContact N-OE2 3.08Å; S15-E18 PolarHBondContact O-N 2.98Å; S15-E18 WeakPolarHBondContact OG-CG 3.46Å; S15-E18 PolarHBondContact OG-N 3.03Å; S15-E18 PolarHBondContact OG-OE2 2.96Å; E18-E21 PolarHBondContact O-N 2.89Å; E18-E22 WeakPolarHBondContact O-CB 3.33Å; E18-E22 PolarHBondContact O-N 3.49Å
19	E	56.9	Low	54.4	Low	119 Å²	119	114.5 Å²	114.5	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-65.4	-42.8	172.5	-66.7	-169.4	150.6	0	0	112.2	P14 S15 E23	P14-E19 HydrophobicContact CB-CG 4.26Å; S15-E19 PolarHBondContact O-N 3.01Å; E19-E23 WeakPolarHBondContact O-CB 3.28Å; E19-E23 PolarHBondContact O-N 3.19Å
20	E	61.8	Low	55	Low	97 Å²	97	116.4 Å²	116.4	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-40.3	174.2	-76.9	-176	173.4	0	0	112.1	V16 Q17 E23 W24	V16-E20 WeakPolarHBondContact O-CG 3.31Å; V16-E20 PolarHBondContact O-N 3.34Å; Q17-E20 PolarHBondContact O-N 3.47Å; E20-E23 PolarHBondContact O-N 2.93Å; E20-W24 HydrophobicContact CB-CZ2 4.5Å; E20-W24 WeakPolarHBondContact O-CB 3.41Å; E20-W24 VanDerWaalsContact O-CG 3.22Å; E20-W24 PolarHBondContact O-N 3.07Å
21	E	59.9	Low	55.9	Low	90 Å²	90	111.1 Å²	111.1	42%	0.421	53%	0.526	S	S	.	.	H	α-helix	trans	-66.1	-42.6	175.8	-76.6	-172	166.1	0	0	112.2	Q17 E18 E23 W24 D25	Q17-E21 WeakPolarHBondContact O-CB 3.26Å; Q17-E21 WeakPolarHBondContact O-CG 3.39Å; Q17-E21 PolarHBondContact O-N 3.35Å; E18-E21 PolarHBondContact O-N 2.89Å; E21-E23 VanDerWaalsContact C-N 3.32Å; E21-E23 PolarHBondContact O-N 3.28Å; E21-W24 HydrophobicContact CG-CE3 4.39Å; E21-W24 HydrophobicContact CG-CZ3 4.5Å; E21-W24 PolarHBondContact O-N 2.6Å; E21-D25 WeakPolarHBondContact O-CB 3.21Å; E21-D25 PolarHBondContact O-N 2.86Å
22	E	59.9	Low	57.3	Low	114 Å²	114	107.1 Å²	107.1	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-34.6	173.7	-84.3	-159.4	-178.5	0	0	113.4	E18 R26	E18-E22 WeakPolarHBondContact O-CB 3.33Å; E18-E22 PolarHBondContact O-N 3.49Å; E22-R26 WeakPolarHBondContact O-CB 3.41Å; E22-R26 WeakPolarHBondContact O-CG 3.44Å; E22-R26 PolarHBondContact O-N 3.09Å; E22-R26 VanDerWaalsContact O-N 3.09Å; E22-R26 PolarHBondContact O-NE 2.89Å; E22-R26 IonicContact OE2-CZ 2.71Å; E22-R26 IonicContact OE2-NH2 2.81Å; E22-R26 PolarHBondContact OE2-NH2 3.26Å
23	E	60.4	Low	58.9	Low	114 Å²	114	100.7 Å²	100.7	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-74	-39.7	177.1	-170.1	169.1	-146.7	0	0	111.1	E19 E20 E21 R26 Q27	E19-E23 WeakPolarHBondContact O-CB 3.28Å; E19-E23 PolarHBondContact O-N 3.19Å; E20-E23 PolarHBondContact O-N 2.93Å; E21-E23 VanDerWaalsContact C-N 3.32Å; E21-E23 PolarHBondContact O-N 3.28Å; E23-R26 PolarHBondContact O-N 3.36Å; E23-Q27 VanDerWaalsContact O-CG 3.31Å; E23-Q27 WeakPolarHBondContact O-CG 3.47Å; E23-Q27 PolarHBondContact O-N 3.2Å
24	W	61.2	Low	60.7	Low	58 Å²	58	96.4 Å²	96.4	22%	0.22	47%	0.471	C	S	.	.	H	α-helix	trans	-64.3	-40.9	172.1	-68.3	-12.7	0	0	0	112.7	E20 E21 Q27 A28 M176	E20-W24 HydrophobicContact CB-CZ2 4.5Å; E20-W24 WeakPolarHBondContact O-CB 3.41Å; E20-W24 VanDerWaalsContact O-CG 3.22Å; E20-W24 PolarHBondContact O-N 3.07Å; E21-W24 HydrophobicContact CG-CE3 4.39Å; E21-W24 HydrophobicContact CG-CZ3 4.5Å; E21-W24 PolarHBondContact O-N 2.6Å; W24-Q27 PolarHBondContact O-N 3.33Å; W24-A28 VanDerWaalsContact O-CB 3.25Å; W24-A28 WeakPolarHBondContact O-CB 3.13Å; W24-A28 PolarHBondContact O-N 3.43Å; W24-M176 HydrophobicContact CH2-CG 4.4Å
25	D	61.3	Low	62.6	Low	81 Å²	81	95.1 Å²	95.1	43%	0.433	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-42.9	175.9	-81.2	3	0	0	0	110.6	E21 Q27 A28 Y29 R237	E21-D25 WeakPolarHBondContact O-CB 3.21Å; E21-D25 PolarHBondContact O-N 2.86Å; D25-Q27 VanDerWaalsContact C-N 3.35Å; D25-Q27 PolarHBondContact O-N 3.07Å; D25-A28 PolarHBondContact O-N 3.33Å; D25-Y29 WeakPolarHBondContact O-CD2 3.2Å; D25-Y29 PolarHBondContact O-N 3.3Å; D25-R237 IonicContact OD1-CZ 3.47Å; D25-R237 IonicContact OD1-NH1 3.29Å; D25-R237 PolarHBondContact OD1-NH1 2.97Å
26	R	59.9	Low	64.3	Low	155 Å²	155	96.1 Å²	96.1	59%	0.585	46%	0.46	S	S	*	.	H	α-helix	trans	-60.7	-39.8	173.4	-84.4	179.4	-96.1	-171.6	-12.9	113.3	E22 E23	E22-R26 WeakPolarHBondContact O-CB 3.41Å; E22-R26 WeakPolarHBondContact O-CG 3.44Å; E22-R26 PolarHBondContact O-N 3.09Å; E22-R26 VanDerWaalsContact O-N 3.09Å; E22-R26 PolarHBondContact O-NE 2.89Å; E22-R26 IonicContact OE2-CZ 2.71Å; E22-R26 IonicContact OE2-NH2 2.81Å; E22-R26 PolarHBondContact OE2-NH2 3.26Å; E23-R26 PolarHBondContact O-N 3.36Å
27	Q	55.7	Low	65.8	Low	85 Å²	85	91.4 Å²	91.4	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-73.1	-39.9	177.6	-70.5	173.2	12.9	0	0	111.8	E23 W24 D25 Y29 L30 D31	E23-Q27 VanDerWaalsContact O-CG 3.31Å; E23-Q27 WeakPolarHBondContact O-CG 3.47Å; E23-Q27 PolarHBondContact O-N 3.2Å; W24-Q27 PolarHBondContact O-N 3.33Å; D25-Q27 VanDerWaalsContact C-N 3.35Å; D25-Q27 PolarHBondContact O-N 3.07Å; Q27-Y29 VanDerWaalsContact C-N 3.31Å; Q27-Y29 PolarHBondContact O-N 2.67Å; Q27-L30 PolarHBondContact O-N 3.28Å; Q27-L30 VanDerWaalsContact O-N 3.1Å; Q27-D31 PolarHBondContact O-N 3.22Å
28	A	54.9	Low	67.6	Low	36 Å²	36	85 Å²	85	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-32.2	176.3	0	0	0	0	0	112.9	W24 D25 L30 D31	W24-A28 VanDerWaalsContact O-CB 3.25Å; W24-A28 WeakPolarHBondContact O-CB 3.13Å; W24-A28 PolarHBondContact O-N 3.43Å; D25-A28 PolarHBondContact O-N 3.33Å; A28-L30 PolarHBondContact O-N 3.17Å; A28-D31 PolarHBondContact O-N 3.31Å
29	Y	56.2	Low	69.2	Low	212 Å²	212	83.8 Å²	83.8	83%	0.831	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.1	173.2	-102.8	-80.8	0	0	0	114.2	D25 Q27	D25-Y29 WeakPolarHBondContact O-CD2 3.2Å; D25-Y29 PolarHBondContact O-N 3.3Å; Q27-Y29 VanDerWaalsContact C-N 3.31Å; Q27-Y29 PolarHBondContact O-N 2.67Å
30	L	56	Low	70.9	Confident	153 Å²	153	82 Å²	82	80%	0.801	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-14.2	177.9	-73.2	164.7	0	0	0	113.3	Q27 A28	Q27-L30 PolarHBondContact O-N 3.28Å; Q27-L30 VanDerWaalsContact O-N 3.1Å; A28-L30 PolarHBondContact O-N 3.17Å
31	D	61.2	Low	72.4	Confident	53 Å²	53	77.4 Å²	77.4	28%	0.283	36%	0.363	S	S	.	.			trans	-108.6	111.8	-173.2	-170.8	1.7	0	0	0	112.2	Q27 A28 M33 W34	Q27-D31 PolarHBondContact O-N 3.22Å; A28-D31 PolarHBondContact O-N 3.31Å; D31-M33 PolarHBondContact O-N 3.1Å; D31-M33 VanDerWaalsContact O-N 3.08Å; D31-M33 WeakPolarHBondContact OD1-CB 3.35Å; D31-M33 WeakPolarHBondContact OD1-CG 3.38Å; D31-M33 PolarHBondContact OD1-N 2.9Å; D31-M33 VanDerWaalsContact OD1-N 3.14Å; D31-M33 WeakPolarHBondContact OD2-CG 3.47Å; D31-W34 VanDerWaalsContact O-CD1 3.24Å
32	P	73.8	Confident	74.2	Confident	77 Å²	77	73.1 Å²	73.1	50%	0.5	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	0.5	178.4	30.1	-35.9	0	0	0	114.5	W34 E35 I36	P32-W34 VanDerWaalsContact C-N 3.27Å; P32-W34 PolarHBondContact O-N 3.36Å; P32-E35 PolarHBondContact O-N 3.44Å; P32-I36 PolarHBondContact O-N 2.69Å
33	M	79.4	Confident	75.8	Confident	66 Å²	66	68.7 Å²	68.7	33%	0.325	32%	0.324	S	S	.	.	H	α-helix	trans	-56.9	-34.2	177.7	-69.9	-74.5	88.1	0	0	113.8	D31 E35 I36 Q37 T235	D31-M33 PolarHBondContact O-N 3.1Å; D31-M33 VanDerWaalsContact O-N 3.08Å; D31-M33 WeakPolarHBondContact OD1-CB 3.35Å; D31-M33 WeakPolarHBondContact OD1-CG 3.38Å; D31-M33 PolarHBondContact OD1-N 2.9Å; D31-M33 VanDerWaalsContact OD1-N 3.14Å; D31-M33 WeakPolarHBondContact OD2-CG 3.47Å; M33-E35 VanDerWaalsContact C-N 3.35Å; M33-E35 PolarHBondContact O-N 2.98Å; M33-I36 HydrophobicContact CE-CD1 3.52Å; M33-I36 PolarHBondContact O-N 3.42Å; M33-Q37 PolarHBondContact O-N 3.42Å; M33-T235 HydrophobicContact CB-CG2 3.91Å
34	W	85.8	Confident	77.4	Confident	76 Å²	76	64.3 Å²	64.3	29%	0.288	31%	0.308	S	S	.	.	H	α-helix	trans	-65.8	-36.2	179	75	-96.6	0	0	0	112.7	D31 P32 I36 Q37 Q38	D31-W34 VanDerWaalsContact O-CD1 3.24Å; P32-W34 VanDerWaalsContact C-N 3.27Å; P32-W34 PolarHBondContact O-N 3.36Å; W34-I36 VanDerWaalsContact C-N 3.33Å; W34-Q37 PolarHBondContact O-N 3.11Å; W34-Q38 HydrophobicContact CE3-CG 4.43Å; W34-Q38 PolarHBondContact O-N 3.32Å
35	E	87	Confident	79.1	Confident	41 Å²	41	61.7 Å²	61.7	19%	0.192	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-39.6	176.7	-62.8	-175.6	-156.5	0	0	110.5	P32 M33 K39 K126	P32-E35 PolarHBondContact O-N 3.44Å; M33-E35 VanDerWaalsContact C-N 3.35Å; M33-E35 PolarHBondContact O-N 2.98Å; E35-K39 VanDerWaalsContact O-CB 3.22Å; E35-K39 WeakPolarHBondContact O-CB 3.49Å; E35-K39 PolarHBondContact O-N 3.12Å; E35-K126 VanDerWaalsContact CD-CE 3.47Å; E35-K126 WeakPolarHBondContact OE1-CE 3Å; E35-K126 IonicContact OE1-NZ 3.02Å; E35-K126 PolarHBondContact OE1-NZ 3.34Å
36	I	87.3	Confident	80.7	Confident	73 Å²	73	57.9 Å²	57.9	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-42.3	177.2	-72.7	162.1	0	0	0	111.1	P32 M33 W34 K39 K40	P32-I36 PolarHBondContact O-N 2.69Å; M33-I36 HydrophobicContact CE-CD1 3.52Å; M33-I36 PolarHBondContact O-N 3.42Å; W34-I36 VanDerWaalsContact C-N 3.33Å; I36-K39 PolarHBondContact O-N 3.4Å; I36-K40 PolarHBondContact O-N 3.2Å
37	Q	89.7	Confident	82.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-67	-44.2	178.3	-166.9	169.3	31.6	0	0	111.9	M33 W34 K40 T41 M232 D239	M33-Q37 PolarHBondContact O-N 3.42Å; W34-Q37 PolarHBondContact O-N 3.11Å; Q37-K40 PolarHBondContact O-N 3.29Å; Q37-T41 WeakPolarHBondContact O-CB 3.23Å; Q37-T41 PolarHBondContact O-N 2.98Å; Q37-T41 PolarHBondContact O-OG1 3.47Å; Q37-M232 PolarHBondContact NE2-SD 3.11Å; Q37-D239 HydrophobicContact CB-CB 4.43Å; Q37-D239 HydrophobicContact CG-CB 4.43Å
38	Q	92.5	Very high	84.1	Confident	4 Å²	4	49 Å²	49	2%	0.019	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-42.6	172.9	-75.3	-176.2	21.6	0	0	111.5	W34 K40 T41 F42 L129 D239 S242	W34-Q38 HydrophobicContact CE3-CG 4.43Å; W34-Q38 PolarHBondContact O-N 3.32Å; Q38-K40 PolarHBondContact O-N 3.49Å; Q38-T41 PolarHBondContact O-N 3.47Å; Q38-F42 HydrophobicContact CB-CD2 4.35Å; Q38-F42 HydrophobicContact CB-CE2 4.14Å; Q38-F42 HydrophobicContact CB-CZ 4.39Å; Q38-F42 HydrophobicContact CG-CE2 4.25Å; Q38-F42 HydrophobicContact CG-CZ 4.11Å; Q38-F42 VanDerWaalsContact O-CB 3.28Å; Q38-F42 WeakPolarHBondContact O-CB 3.3Å; Q38-F42 WeakPolarHBondContact O-CG 3.32Å; Q38-F42 PolarHBondContact O-N 3.44Å; Q38-L129 HydrophobicContact CB-CD1 3.98Å; Q38-L129 HydrophobicContact CB-CD2 4.15Å; Q38-D239 WeakPolarHBondContact CG-OD2 3.09Å; Q38-D239 VanDerWaalsContact NE2-CG 3.33Å; Q38-D239 PolarHBondContact NE2-OD1 3.28Å; Q38-D239 PolarHBondContact NE2-OD2 3.16Å; Q38-S242 WeakPolarHBondContact CA-OG 3.47Å
39	K	92.9	Very high	85.9	Confident	55 Å²	55	49.7 Å²	49.7	24%	0.239	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-48.6	177	-178.6	166.9	-173.9	174.7	0	111.7	E35 I36 T43 N59 I60 E61	E35-K39 VanDerWaalsContact O-CB 3.22Å; E35-K39 WeakPolarHBondContact O-CB 3.49Å; E35-K39 PolarHBondContact O-N 3.12Å; I36-K39 PolarHBondContact O-N 3.4Å; K39-T43 WeakPolarHBondContact O-CB 3.41Å; K39-T43 PolarHBondContact O-N 2.78Å; K39-T43 PolarHBondContact O-OG1 2.7Å; K39-N59 VanDerWaalsContact CE-OD1 3.26Å; K39-N59 WeakPolarHBondContact CE-OD1 3.48Å; K39-N59 PolarHBondContact NZ-OD1 3.09Å; K39-I60 HydrophobicContact CD-CG2 4.34Å; K39-I60 HydrophobicContact CG-CG2 3.87Å; K39-E61 IonicContact NZ-OE1 2.93Å; K39-E61 PolarHBondContact NZ-OE1 3.01Å; K39-E61 IonicContact NZ-OE2 2.66Å; K39-E61 PolarHBondContact NZ-OE2 2.95Å
40	K	92.1	Very high	87.6	Confident	80 Å²	80	39.6 Å²	39.6	35%	0.348	20%	0.201	S	C	.	.	H	α-helix	trans	-60.7	-52.2	175.4	-71.6	-175.5	-173.7	174	0	111.4	I36 Q37 Q38 T43 A44 D228 D231	I36-K40 PolarHBondContact O-N 3.2Å; Q37-K40 PolarHBondContact O-N 3.29Å; Q38-K40 PolarHBondContact O-N 3.49Å; K40-T43 PolarHBondContact O-N 3.14Å; K40-A44 PolarHBondContact O-N 2.73Å; K40-D228 HydrophobicContact CD-CB 4.14Å; K40-D228 IonicContact NZ-OD2 3.13Å; K40-D228 PolarHBondContact NZ-OD2 3.1Å; K40-D231 VanDerWaalsContact CD-OD2 3.25Å; K40-D231 WeakPolarHBondContact CD-OD2 3.46Å; K40-D231 VanDerWaalsContact CE-OD2 3.25Å; K40-D231 WeakPolarHBondContact CE-OD2 3.47Å; K40-D231 IonicContact NZ-OD1 2.7Å; K40-D231 PolarHBondContact NZ-OD1 3.1Å; K40-D231 IonicContact NZ-OD2 3.02Å; K40-D231 PolarHBondContact NZ-OD2 2.94Å
41	T	93.9	Very high	89.3	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-47.4	-172.1	-47.2	0	0	0	0	112.6	Q37 Q38 A44 W45 M226 L227 S242 T245	Q37-T41 WeakPolarHBondContact O-CB 3.23Å; Q37-T41 PolarHBondContact O-N 2.98Å; Q37-T41 PolarHBondContact O-OG1 3.47Å; Q38-T41 PolarHBondContact O-N 3.47Å; T41-A44 PolarHBondContact O-N 2.82Å; T41-W45 WeakPolarHBondContact O-CB 3.45Å; T41-W45 PolarHBondContact O-N 3.04Å; T41-M226 VanDerWaalsContact CA-O 3.25Å; T41-M226 WeakPolarHBondContact CA-O 3.4Å; T41-M226 HydrophobicContact CG2-CB 3.77Å; T41-M226 PolarHBondContact OG1-O 3.14Å; T41-L227 HydrophobicContact CG2-CD2 4Å; T41-S242 WeakPolarHBondContact OG1-CB 3.39Å; T41-S242 PolarHBondContact OG1-OG 3.2Å; T41-T245 HydrophobicContact CG2-CG2 4.5Å
42	F	96	Very high	90.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.7	-33.2	-179.4	-65.6	-4.4	0	0	0	111.6	Q38 W45 C46 I60 L129 I132 W133 I136 R241	Q38-F42 HydrophobicContact CB-CD2 4.35Å; Q38-F42 HydrophobicContact CB-CE2 4.14Å; Q38-F42 HydrophobicContact CB-CZ 4.39Å; Q38-F42 HydrophobicContact CG-CE2 4.25Å; Q38-F42 HydrophobicContact CG-CZ 4.11Å; Q38-F42 VanDerWaalsContact O-CB 3.28Å; Q38-F42 WeakPolarHBondContact O-CB 3.3Å; Q38-F42 WeakPolarHBondContact O-CG 3.32Å; Q38-F42 PolarHBondContact O-N 3.44Å; F42-W45 PolarHBondContact O-N 2.86Å; F42-C46 WeakPolarHBondContact O-CB 3.44Å; F42-C46 PolarHBondContact O-N 2.97Å; F42-C46 PolarHBondContact O-SG 2.97Å; F42-I60 HydrophobicContact CB-CD1 3.75Å; F42-L129 HydrophobicContact CD2-CB 4.42Å; F42-L129 HydrophobicContact CD2-CD2 3.7Å; F42-L129 HydrophobicContact CE2-CB 4.37Å; F42-L129 HydrophobicContact CE2-CD2 4.35Å; F42-L129 WeakPolarHBondContact CE2-O 3.44Å; F42-I132 HydrophobicContact CB-CG2 3.85Å; F42-I132 HydrophobicContact CD2-CB 4.16Å; F42-I132 HydrophobicContact CD2-CG2 4Å; F42-I132 HydrophobicContact CG-CG2 3.99Å; F42-W133 HydrophobicContact CE1-CE3 4.31Å; F42-W133 HydrophobicContact CE2-CB 4Å; F42-W133 HydrophobicContact CZ-CB 4.03Å; F42-W133 AromaticContact CZ-CE3 3.96Å; F42-W133 HydrophobicContact CZ-CE3 3.96Å; F42-I136 HydrophobicContact CD1-CD1 3.48Å; F42-I136 VanDerWaalsContact CD1-CD1 3.48Å; F42-I136 HydrophobicContact CE1-CD1 3.63Å; F42-I136 HydrophobicContact CG-CD1 4.02Å; F42-I136 HydrophobicContact CZ-CD1 4.26Å; F42-R241 HydrophobicContact CE1-CB 4.48Å; F42-R241 HydrophobicContact CZ-CB 4.05Å
43	T	95	Very high	91.2	Very high	21 Å²	21	41.5 Å²	41.5	13%	0.129	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-47.5	172.8	-58	0	0	0	0	111.1	K39 K40 C46 N47 I57	K39-T43 WeakPolarHBondContact O-CB 3.41Å; K39-T43 PolarHBondContact O-N 2.78Å; K39-T43 PolarHBondContact O-OG1 2.7Å; K40-T43 PolarHBondContact O-N 3.14Å; T43-C46 PolarHBondContact O-N 3.46Å; T43-N47 WeakPolarHBondContact O-CB 3.45Å; T43-N47 PolarHBondContact O-N 3.49Å; T43-N47 PolarHBondContact O-ND2 3.12Å; T43-I57 HydrophobicContact CG2-CD1 4.1Å; T43-I57 HydrophobicContact CG2-CG1 4Å
44	A	94.3	Very high	91.7	Very high	23 Å²	23	48 Å²	48	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-41.2	176.5	0	0	0	0	0	112.3	K40 T41 N47 S48 M226	K40-A44 PolarHBondContact O-N 2.73Å; T41-A44 PolarHBondContact O-N 2.82Å; A44-N47 PolarHBondContact O-N 2.84Å; A44-S48 PolarHBondContact O-N 3.11Å; A44-M226 HydrophobicContact CB-CB 4.09Å; A44-M226 HydrophobicContact CB-CG 4.02Å
45	W	95.3	Very high	91.9	Very high	3 Å²	3	45.7 Å²	45.7	1%	0.011	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-50.4	174.9	177.9	87.6	0	0	0	112.1	T41 F42 N47 S48 Y49 L73 L77 I132 I135 I136 M226 T245	T41-W45 WeakPolarHBondContact O-CB 3.45Å; T41-W45 PolarHBondContact O-N 3.04Å; F42-W45 PolarHBondContact O-N 2.86Å; W45-N47 VanDerWaalsContact C-N 3.29Å; W45-N47 PolarHBondContact O-N 3.19Å; W45-S48 WeakPolarHBondContact O-CB 3.22Å; W45-S48 PolarHBondContact O-N 3.31Å; W45-S48 PolarHBondContact O-OG 2.76Å; W45-Y49 HydrophobicContact CD2-CE2 4.43Å; W45-Y49 AromaticContact CE2-CE2 3.68Å; W45-Y49 HydrophobicContact CZ2-CD2 4.3Å; W45-Y49 AromaticContact CZ2-CE2 3.97Å; W45-Y49 HydrophobicContact CZ2-CE2 3.97Å; W45-Y49 AromaticContact NE1-CE2 3.49Å; W45-Y49 WeakPolarHBondContact O-CD2 3.27Å; W45-L73 HydrophobicContact CZ3-CD1 4.48Å; W45-L73 HydrophobicContact CZ3-CD2 4.12Å; W45-L77 HydrophobicContact CH2-CD1 3.63Å; W45-L77 HydrophobicContact CH2-CD2 4.09Å; W45-L77 HydrophobicContact CZ2-CD1 4.23Å; W45-L77 HydrophobicContact CZ2-CD2 3.84Å; W45-I132 HydrophobicContact CE3-CG2 4.11Å; W45-I132 HydrophobicContact CZ3-CG2 4.02Å; W45-I135 HydrophobicContact CH2-CG2 3.94Å; W45-I136 HydrophobicContact CD2-CD1 3.93Å; W45-I136 HydrophobicContact CD2-CG1 3.61Å; W45-I136 HydrophobicContact CE3-CD1 3.85Å; W45-I136 HydrophobicContact CE3-CG1 3.61Å; W45-I136 HydrophobicContact CG-CD1 4.33Å; W45-I136 HydrophobicContact CG-CG1 4.35Å; W45-I136 HydrophobicContact CH2-CG1 3.65Å; W45-I136 HydrophobicContact CZ2-CB 4.45Å; W45-I136 HydrophobicContact CZ2-CG1 3.64Å; W45-I136 HydrophobicContact CZ3-CD1 4.25Å; W45-I136 HydrophobicContact CZ3-CG1 3.63Å; W45-M226 HydrophobicContact CB-CE 4.27Å; W45-M226 HydrophobicContact CB-SD 3.85Å; W45-M226 HydrophobicContact CG-SD 4.4Å; W45-T245 HydrophobicContact CB-CG2 4Å; W45-T245 HydrophobicContact CG-CG2 3.78Å
46	C	95.3	Very high	92.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.2	-43.5	175.9	-68.9	0	0	0	0	111.6	F42 T43 S48 Y49 L50 I57 F64 L73	F42-C46 WeakPolarHBondContact O-CB 3.44Å; F42-C46 PolarHBondContact O-N 2.97Å; F42-C46 PolarHBondContact O-SG 2.97Å; T43-C46 PolarHBondContact O-N 3.46Å; C46-S48 VanDerWaalsContact C-N 3.29Å; C46-S48 PolarHBondContact O-N 2.77Å; C46-Y49 PolarHBondContact O-N 3.29Å; C46-L50 HydrophobicContact CB-CD1 4.41Å; C46-L50 WeakPolarHBondContact O-CB 3.14Å; C46-L50 WeakPolarHBondContact O-CG 3.48Å; C46-L50 PolarHBondContact O-N 3.28Å; C46-I57 HydrophobicContact CB-CD1 3.66Å; C46-I57 HydrophobicContact CB-CG1 4.16Å; C46-F64 HydrophobicContact CB-CZ 4.28Å; C46-L73 HydrophobicContact CB-CD1 4.49Å; C46-L73 HydrophobicContact CB-CD2 4.29Å
47	N	94.9	Very high	92.5	Very high	41 Å²	41	43.4 Å²	43.4	22%	0.219	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-30.1	177.1	-77	-28.5	0	0	0	113.3	T43 A44 W45 Y49 R51 S56 I57	T43-N47 WeakPolarHBondContact O-CB 3.45Å; T43-N47 PolarHBondContact O-N 3.49Å; T43-N47 PolarHBondContact O-ND2 3.12Å; A44-N47 PolarHBondContact O-N 2.84Å; W45-N47 VanDerWaalsContact C-N 3.29Å; W45-N47 PolarHBondContact O-N 3.19Å; N47-Y49 PolarHBondContact O-N 3.09Å; N47-R51 WeakPolarHBondContact O-CB 3.43Å; N47-R51 WeakPolarHBondContact O-CG 3.36Å; N47-R51 PolarHBondContact O-N 3.12Å; N47-S56 VanDerWaalsContact OD1-CA 3.23Å; N47-S56 WeakPolarHBondContact OD1-CA 3.43Å; N47-S56 WeakPolarHBondContact OD1-CB 3.11Å; N47-I57 PolarHBondContact ND2-O 3.31Å; N47-I57 PolarHBondContact OD1-N 3.29Å; N47-I57 PolarHBondContact OD1-O 2.96Å
48	S	92.3	Very high	92.7	Very high	13 Å²	13	51.9 Å²	51.9	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-26	176.2	80.2	0	0	0	0	114.1	A44 W45 C46 R51 P224	A44-S48 PolarHBondContact O-N 3.11Å; W45-S48 WeakPolarHBondContact O-CB 3.22Å; W45-S48 PolarHBondContact O-N 3.31Å; W45-S48 PolarHBondContact O-OG 2.76Å; C46-S48 VanDerWaalsContact C-N 3.29Å; C46-S48 PolarHBondContact O-N 2.77Å; S48-R51 VanDerWaalsContact O-CG 3.31Å; S48-R51 WeakPolarHBondContact O-CG 3.29Å; S48-R51 PolarHBondContact O-NE 2.71Å; S48-P224 VanDerWaalsContact CB-CG 3.49Å
49	Y	92.1	Very high	92.6	Very high	50 Å²	50	53.3 Å²	53.3	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-94.6	-47.6	172.6	-68.6	-93.1	0	0	0	111.4	W45 C46 N47 R51 K52 L77	W45-Y49 HydrophobicContact CD2-CE2 4.43Å; W45-Y49 AromaticContact CE2-CE2 3.68Å; W45-Y49 HydrophobicContact CZ2-CD2 4.3Å; W45-Y49 AromaticContact CZ2-CE2 3.97Å; W45-Y49 HydrophobicContact CZ2-CE2 3.97Å; W45-Y49 AromaticContact NE1-CE2 3.49Å; W45-Y49 WeakPolarHBondContact O-CD2 3.27Å; C46-Y49 PolarHBondContact O-N 3.29Å; N47-Y49 PolarHBondContact O-N 3.09Å; Y49-R51 PolarHBondContact O-N 3.37Å; Y49-R51 VanDerWaalsContact O-N 3.12Å; Y49-K52 VanDerWaalsContact O-CB 3.24Å; Y49-K52 WeakPolarHBondContact O-CB 2.9Å; Y49-K52 WeakPolarHBondContact O-CG 2.88Å; Y49-K52 PolarHBondContact O-N 2.91Å; Y49-L77 HydrophobicContact CD1-CD2 3.52Å; Y49-L77 HydrophobicContact CD1-CG 4.24Å; Y49-L77 HydrophobicContact CD2-CD2 4.07Å; Y49-L77 HydrophobicContact CE1-CD2 3.46Å; Y49-L77 VanDerWaalsContact CE1-CD2 3.46Å; Y49-L77 HydrophobicContact CE2-CD2 4.05Å; Y49-L77 HydrophobicContact CG-CD2 3.84Å; Y49-L77 HydrophobicContact CG-CG 4.43Å
50	L	92.8	Very high	92.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.5	-27.2	-178.3	-69.2	173.3	0	0	0	113.3	C46 K52 V53 K54 C55 I57 Q72 L73	C46-L50 HydrophobicContact CB-CD1 4.41Å; C46-L50 WeakPolarHBondContact O-CB 3.14Å; C46-L50 WeakPolarHBondContact O-CG 3.48Å; C46-L50 PolarHBondContact O-N 3.28Å; L50-K52 PolarHBondContact O-N 3.06Å; L50-V53 HydrophobicContact CD2-CG2 4.22Å; L50-V53 CarbonylContact O-C 3.49Å; L50-V53 VanDerWaalsContact O-CG2 3.26Å; L50-V53 WeakPolarHBondContact O-CG2 3.36Å; L50-V53 PolarHBondContact O-N 2.91Å; L50-K54 PolarHBondContact O-N 3.12Å; L50-K54 VanDerWaalsContact O-N 3.14Å; L50-C55 CarbonylContact C-O 3.15Å; L50-C55 HydrophobicContact CB-CB 4.15Å; L50-C55 VanDerWaalsContact CB-O 3.3Å; L50-C55 WeakPolarHBondContact CB-O 3.11Å; L50-C55 HydrophobicContact CD2-CB 4.16Å; L50-C55 PolarHBondContact O-N 2.94Å; L50-C55 VanDerWaalsContact O-O 3.11Å; L50-I57 HydrophobicContact CD1-CG2 4.02Å; L50-Q72 HydrophobicContact CD2-CB 4.2Å; L50-L73 HydrophobicContact CD2-CB 4.06Å; L50-L73 HydrophobicContact CG-CD1 4.29Å
51	R	90.9	Very high	92.4	Very high	115 Å²	115	49.6 Å²	49.6	43%	0.434	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-55.3	-32.4	171.3	69.3	-177.5	179.8	153.2	4.5	113.1	N47 S48 Y49 V53 K54 D222	N47-R51 WeakPolarHBondContact O-CB 3.43Å; N47-R51 WeakPolarHBondContact O-CG 3.36Å; N47-R51 PolarHBondContact O-N 3.12Å; S48-R51 VanDerWaalsContact O-CG 3.31Å; S48-R51 WeakPolarHBondContact O-CG 3.29Å; S48-R51 PolarHBondContact O-NE 2.71Å; Y49-R51 PolarHBondContact O-N 3.37Å; Y49-R51 VanDerWaalsContact O-N 3.12Å; R51-V53 VanDerWaalsContact C-N 3.29Å; R51-V53 PolarHBondContact O-N 2.75Å; R51-K54 PolarHBondContact O-N 3.07Å; R51-D222 IonicContact CZ-OD1 3.66Å; R51-D222 IonicContact CZ-OD2 3.85Å; R51-D222 IonicContact NH1-OD1 3.33Å; R51-D222 PolarHBondContact NH1-OD1 3.36Å; R51-D222 IonicContact NH1-OD2 2.73Å; R51-D222 PolarHBondContact NH2-O 3.03Å; R51-D222 IonicContact NH2-OD1 3.53Å; R51-D222 PolarHBondContact NH2-OD1 2.88Å; R51-D222 VanDerWaalsContact NH2-OD1 3.1Å; R51-D222 IonicContact NH2-OD2 3.43Å; R51-D222 PolarHBondContact NH2-OD2 2.79Å
52	K	87	Confident	92.3	Very high	137 Å²	137	55.8 Å²	55.8	60%	0.596	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-63.3	-34.6	177.4	-61.2	-179.8	177.7	-178.1	0	112.1	Y49 L50 T76	Y49-K52 VanDerWaalsContact O-CB 3.24Å; Y49-K52 WeakPolarHBondContact O-CB 2.9Å; Y49-K52 WeakPolarHBondContact O-CG 2.88Å; Y49-K52 PolarHBondContact O-N 2.91Å; L50-K52 PolarHBondContact O-N 3.06Å; K52-T76 HydrophobicContact CB-CG2 4.15Å; K52-T76 HydrophobicContact CD-CG2 4.01Å
53	V	88.8	Confident	92.2	Very high	72 Å²	72	57.6 Å²	57.6	44%	0.436	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-100.9	13.8	178.2	-64.5	0	0	0	0	113.3	L50 R51 C55 T76	L50-V53 HydrophobicContact CD2-CG2 4.22Å; L50-V53 CarbonylContact O-C 3.49Å; L50-V53 VanDerWaalsContact O-CG2 3.26Å; L50-V53 WeakPolarHBondContact O-CG2 3.36Å; L50-V53 PolarHBondContact O-N 2.91Å; R51-V53 VanDerWaalsContact C-N 3.29Å; R51-V53 PolarHBondContact O-N 2.75Å; V53-C55 HydrophobicContact CG2-CB 4.09Å; V53-C55 PolarHBondContact O-N 3.45Å; V53-T76 HydrophobicContact CG1-CG2 4.41Å; V53-T76 WeakPolarHBondContact CG1-OG1 3.29Å
54	K	90.1	Very high	92.2	Very high	203 Å²	203	56.6 Å²	56.6	88%	0.883	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	32.8	-179	-53.5	179.4	-177.8	177.4	0	113.8	L50 R51	L50-K54 PolarHBondContact O-N 3.12Å; L50-K54 VanDerWaalsContact O-N 3.14Å; R51-K54 PolarHBondContact O-N 3.07Å
55	C	90.2	Very high	92.1	Very high	26 Å²	26	56.5 Å²	56.5	18%	0.176	27%	0.273	C	S	.	.			trans	-112.9	162.9	174.5	-168.5	0	0	0	0	109.9	L50 V53 Q72	L50-C55 CarbonylContact C-O 3.15Å; L50-C55 HydrophobicContact CB-CB 4.15Å; L50-C55 VanDerWaalsContact CB-O 3.3Å; L50-C55 WeakPolarHBondContact CB-O 3.11Å; L50-C55 HydrophobicContact CD2-CB 4.16Å; L50-C55 PolarHBondContact O-N 2.94Å; L50-C55 VanDerWaalsContact O-O 3.11Å; V53-C55 HydrophobicContact CG2-CB 4.09Å; V53-C55 PolarHBondContact O-N 3.45Å; C55-Q72 PolarHBondContact SG-OE1 2.95Å
56	S	93.1	Very high	92	Very high	64 Å²	64	58.8 Å²	58.8	45%	0.448	29%	0.285	S	S	.	.			trans	-157.3	161.8	174.1	57.4	0	0	0	0	111.8	N47 K69	N47-S56 VanDerWaalsContact OD1-CA 3.23Å; N47-S56 WeakPolarHBondContact OD1-CA 3.43Å; N47-S56 WeakPolarHBondContact OD1-CB 3.11Å; S56-K69 WeakPolarHBondContact O-CE 3.07Å; S56-K69 PolarHBondContact O-NZ 3.45Å
57	I	94.2	Very high	91.8	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.015	29%	0.285	C	S	.	.			trans	-120.4	144	170.5	58.5	164.4	0	0	0	110.4	T43 C46 N47 L50 I60 D63 F64 K69	T43-I57 HydrophobicContact CG2-CD1 4.1Å; T43-I57 HydrophobicContact CG2-CG1 4Å; C46-I57 HydrophobicContact CB-CD1 3.66Å; C46-I57 HydrophobicContact CB-CG1 4.16Å; N47-I57 PolarHBondContact ND2-O 3.31Å; N47-I57 PolarHBondContact OD1-N 3.29Å; N47-I57 PolarHBondContact OD1-O 2.96Å; L50-I57 HydrophobicContact CD1-CG2 4.02Å; I57-I60 HydrophobicContact CD1-CB 4.4Å; I57-I60 HydrophobicContact CD1-CD1 4.48Å; I57-I60 HydrophobicContact CD1-CG1 4.05Å; I57-D63 WeakPolarHBondContact CA-OD2 3.35Å; I57-D63 HydrophobicContact CB-CB 3.91Å; I57-D63 HydrophobicContact CG2-CB 3.61Å; I57-F64 HydrophobicContact CD1-CE2 3.78Å; I57-F64 HydrophobicContact CD1-CZ 3.85Å; I57-F64 HydrophobicContact CG2-CE1 4.36Å; I57-F64 HydrophobicContact CG2-CZ 4.33Å; I57-K69 HydrophobicContact CG2-CB 4.41Å; I57-K69 HydrophobicContact CG2-CD 3.55Å
58	E	92.6	Very high	91.7	Very high	179 Å²	179	59.9 Å²	59.9	84%	0.836	29%	0.291	S	S	*	.	S	Bend	trans	-112.6	-41	176.5	-65.4	-177.9	-177.6	0	0	110.7	D63	E58-D63 PolarHBondContact N-OD2 3.01Å
59	N	91.5	Very high	91.8	Very high	34 Å²	34	61.6 Å²	61.6	18%	0.182	30%	0.297	C	S	.	.			trans	-126.5	101.9	176.4	-172.2	14.8	0	0	0	111	K39 E61 E62 D63	K39-N59 VanDerWaalsContact CE-OD1 3.26Å; K39-N59 WeakPolarHBondContact CE-OD1 3.48Å; K39-N59 PolarHBondContact NZ-OD1 3.09Å; N59-E61 PolarHBondContact O-N 2.81Å; N59-E61 PolarHBondContact OD1-OE2 3.24Å; N59-E62 VanDerWaalsContact ND2-CD 3.27Å; N59-E62 WeakPolarHBondContact ND2-CG 3.38Å; N59-E62 PolarHBondContact ND2-OE2 3.38Å; N59-E62 PolarHBondContact O-N 3.47Å; N59-D63 PolarHBondContact N-OD2 3.32Å; N59-D63 WeakPolarHBondContact O-CB 3.35Å; N59-D63 PolarHBondContact O-N 2.87Å
60	I	91.9	Very high	91.8	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-54.6	-26.3	-177.4	-153.7	167.8	0	0	0	114	K39 F42 I57 F64 I125 T128 L129 I132	K39-I60 HydrophobicContact CD-CG2 4.34Å; K39-I60 HydrophobicContact CG-CG2 3.87Å; F42-I60 HydrophobicContact CB-CD1 3.75Å; I57-I60 HydrophobicContact CD1-CB 4.4Å; I57-I60 HydrophobicContact CD1-CD1 4.48Å; I57-I60 HydrophobicContact CD1-CG1 4.05Å; I60-F64 HydrophobicContact CD1-CE2 4.35Å; I60-F64 HydrophobicContact CG1-CD2 3.86Å; I60-F64 HydrophobicContact CG1-CE2 3.68Å; I60-I125 HydrophobicContact CG2-CD1 4.1Å; I60-T128 HydrophobicContact CG1-CG2 4.44Å; I60-T128 WeakPolarHBondContact O-CG2 3.46Å; I60-L129 HydrophobicContact CD1-CD2 4.31Å; I60-L129 HydrophobicContact CG2-CD2 4.45Å; I60-I132 HydrophobicContact CD1-CG1 4.3Å
61	E	87.4	Confident	91.9	Very high	56 Å²	56	59.3 Å²	59.3	26%	0.262	29%	0.288	S	S	.	.	H	α-helix	trans	-70.3	-33.9	178.7	-68.1	159.8	-171	0	0	113.1	K39 N59 T65 I125	K39-E61 IonicContact NZ-OE1 2.93Å; K39-E61 PolarHBondContact NZ-OE1 3.01Å; K39-E61 IonicContact NZ-OE2 2.66Å; K39-E61 PolarHBondContact NZ-OE2 2.95Å; N59-E61 PolarHBondContact O-N 2.81Å; N59-E61 PolarHBondContact OD1-OE2 3.24Å; E61-T65 WeakPolarHBondContact O-CG2 3.26Å; E61-I125 HydrophobicContact CG-CB 4.02Å; E61-I125 HydrophobicContact CG-CD1 3.57Å; E61-I125 HydrophobicContact CG-CG1 4.2Å
62	E	92	Very high	91.9	Very high	132 Å²	132	57.5 Å²	57.5	62%	0.617	28%	0.284	S	S	*	.	H	α-helix	trans	-108.3	-37.5	-170.2	-67.9	176.5	144.8	0	0	111.5	N59 F64 T65	N59-E62 VanDerWaalsContact ND2-CD 3.27Å; N59-E62 WeakPolarHBondContact ND2-CG 3.38Å; N59-E62 PolarHBondContact ND2-OE2 3.38Å; N59-E62 PolarHBondContact O-N 3.47Å; E62-F64 VanDerWaalsContact C-N 3.3Å; E62-F64 PolarHBondContact O-N 3.2Å; E62-T65 WeakPolarHBondContact O-CB 3.46Å; E62-T65 VanDerWaalsContact O-CG2 3.28Å; E62-T65 WeakPolarHBondContact O-CG2 3.39Å; E62-T65 PolarHBondContact O-N 3.26Å; E62-T65 VanDerWaalsContact O-N 3.1Å; E62-T65 PolarHBondContact O-OG1 2.76Å
63	D	94.6	Very high	92.3	Very high	37 Å²	37	51 Å²	51	20%	0.198	26%	0.256	C	S	.	.	H	α-helix	trans	-68.4	-23.2	-172.3	-87.8	-48.7	0	0	0	114.7	I57 E58 N59 K69	I57-D63 WeakPolarHBondContact CA-OD2 3.35Å; I57-D63 HydrophobicContact CB-CB 3.91Å; I57-D63 HydrophobicContact CG2-CB 3.61Å; E58-D63 PolarHBondContact N-OD2 3.01Å; N59-D63 PolarHBondContact N-OD2 3.32Å; N59-D63 WeakPolarHBondContact O-CB 3.35Å; N59-D63 PolarHBondContact O-N 2.87Å; D63-K69 HydrophobicContact CB-CD 4.18Å; D63-K69 IonicContact OD1-NZ 2.68Å; D63-K69 PolarHBondContact OD1-NZ 3.18Å; D63-K69 IonicContact OD2-NZ 2.79Å
64	F	94.4	Very high	92.5	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.5	174.5	-69.4	-50.9	0	0	0	113.6	C46 I57 I60 E62 D66 G67 K69 L70 L73 I120 T128 I132	C46-F64 HydrophobicContact CB-CZ 4.28Å; I57-F64 HydrophobicContact CD1-CE2 3.78Å; I57-F64 HydrophobicContact CD1-CZ 3.85Å; I57-F64 HydrophobicContact CG2-CE1 4.36Å; I57-F64 HydrophobicContact CG2-CZ 4.33Å; I60-F64 HydrophobicContact CD1-CE2 4.35Å; I60-F64 HydrophobicContact CG1-CD2 3.86Å; I60-F64 HydrophobicContact CG1-CE2 3.68Å; E62-F64 VanDerWaalsContact C-N 3.3Å; E62-F64 PolarHBondContact O-N 3.2Å; F64-D66 PolarHBondContact O-N 3.38Å; F64-G67 PolarHBondContact O-N 3.33Å; F64-K69 HydrophobicContact CD1-CB 4.08Å; F64-K69 HydrophobicContact CE1-CB 4.06Å; F64-L70 HydrophobicContact CD1-CB 3.78Å; F64-L70 HydrophobicContact CD1-CD1 4.42Å; F64-L70 HydrophobicContact CE1-CB 4.27Å; F64-L70 HydrophobicContact CE1-CD1 4.48Å; F64-L73 HydrophobicContact CE1-CD2 4.37Å; F64-L73 HydrophobicContact CZ-CD2 4.03Å; F64-I120 HydrophobicContact CB-CG2 4.46Å; F64-T128 HydrophobicContact CD2-CG2 4.23Å; F64-I132 HydrophobicContact CD2-CD1 4.12Å; F64-I132 HydrophobicContact CD2-CG1 4.48Å; F64-I132 HydrophobicContact CE2-CD1 3.56Å; F64-I132 HydrophobicContact CE2-CG1 4.05Å; F64-I132 HydrophobicContact CZ-CD1 3.95Å
65	T	93.1	Very high	92.6	Very high	21 Å²	21	41.1 Å²	41.1	13%	0.129	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.8	-174.4	65.3	0	0	0	0	114.5	E61 E62 K94 I120	E61-T65 WeakPolarHBondContact O-CG2 3.26Å; E62-T65 WeakPolarHBondContact O-CB 3.46Å; E62-T65 VanDerWaalsContact O-CG2 3.28Å; E62-T65 WeakPolarHBondContact O-CG2 3.39Å; E62-T65 PolarHBondContact O-N 3.26Å; E62-T65 VanDerWaalsContact O-N 3.1Å; E62-T65 PolarHBondContact O-OG1 2.76Å; T65-K94 WeakPolarHBondContact O-CB 3.27Å; T65-K94 VanDerWaalsContact O-CD 3.28Å; T65-K94 WeakPolarHBondContact O-CD 3.41Å; T65-K94 PolarHBondContact O-NZ 3.13Å; T65-K94 PolarHBondContact OG1-NZ 2.91Å; T65-I120 WeakPolarHBondContact CG2-O 3.19Å
66	D	92.1	Very high	92.6	Very high	51 Å²	51	40.9 Å²	40.9	27%	0.273	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-3.1	176	76.7	4.1	0	0	0	114.6	F64 L68 K94 N97	F64-D66 PolarHBondContact O-N 3.38Å; D66-L68 HydrophobicContact CB-CG 4.49Å; D66-L68 PolarHBondContact O-N 3.41Å; D66-L68 VanDerWaalsContact OD1-CB 3.31Å; D66-L68 WeakPolarHBondContact OD1-CB 3.34Å; D66-L68 PolarHBondContact OD1-N 2.81Å; D66-L68 WeakPolarHBondContact OD2-CD1 3.43Å; D66-K94 HydrophobicContact CB-CD 4.47Å; D66-K94 HydrophobicContact CB-CG 4.17Å; D66-N97 WeakPolarHBondContact O-CB 3.41Å; D66-N97 PolarHBondContact O-ND2 2.77Å; D66-N97 VanDerWaalsContact O-ND2 3.1Å
67	G	91.9	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	69.9	-8.8	-177.2	0	0	0	0	0	115.6	F64 L70 I71	F64-G67 PolarHBondContact O-N 3.33Å; G67-L70 PolarHBondContact O-N 3.06Å; G67-I71 WeakPolarHBondContact O-CG1 3.47Å; G67-I71 PolarHBondContact O-N 3.15Å
68	L	92.8	Very high	92.1	Very high	64 Å²	64	40.1 Å²	40.1	34%	0.335	20%	0.199	S	C	.	.	H	α-helix	trans	-70.1	-48.9	-172.4	-61.1	-177.7	0	0	0	111.9	D66 L70 I71 Q72 P85 N97	D66-L68 HydrophobicContact CB-CG 4.49Å; D66-L68 PolarHBondContact O-N 3.41Å; D66-L68 VanDerWaalsContact OD1-CB 3.31Å; D66-L68 WeakPolarHBondContact OD1-CB 3.34Å; D66-L68 PolarHBondContact OD1-N 2.81Å; D66-L68 WeakPolarHBondContact OD2-CD1 3.43Å; L68-L70 VanDerWaalsContact C-N 3.27Å; L68-L70 PolarHBondContact O-N 3.36Å; L68-I71 PolarHBondContact O-N 2.83Å; L68-Q72 WeakPolarHBondContact O-CG 3.13Å; L68-Q72 PolarHBondContact O-N 3.38Å; L68-P85 HydrophobicContact CD2-CB 3.41Å; L68-P85 VanDerWaalsContact CD2-CB 3.41Å; L68-P85 HydrophobicContact CD2-CG 3.94Å; L68-N97 WeakPolarHBondContact CD2-ND2 3.32Å
69	K	93.5	Very high	91.7	Very high	48 Å²	48	40 Å²	40	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-68.9	-28.2	177.6	-60.6	-170.1	-176.4	-177.2	0	112.2	S56 I57 D63 F64 L73	S56-K69 WeakPolarHBondContact O-CE 3.07Å; S56-K69 PolarHBondContact O-NZ 3.45Å; I57-K69 HydrophobicContact CG2-CB 4.41Å; I57-K69 HydrophobicContact CG2-CD 3.55Å; D63-K69 HydrophobicContact CB-CD 4.18Å; D63-K69 IonicContact OD1-NZ 2.68Å; D63-K69 PolarHBondContact OD1-NZ 3.18Å; D63-K69 IonicContact OD2-NZ 2.79Å; F64-K69 HydrophobicContact CD1-CB 4.08Å; F64-K69 HydrophobicContact CE1-CB 4.06Å; K69-L73 WeakPolarHBondContact O-CB 3.19Å; K69-L73 PolarHBondContact O-N 2.71Å
70	L	93.5	Very high	91.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69	-44.8	176.2	-177.8	62.5	0	0	0	111.4	F64 G67 L68 L73 L74 A101 M131 I132 I135	F64-L70 HydrophobicContact CD1-CB 3.78Å; F64-L70 HydrophobicContact CD1-CD1 4.42Å; F64-L70 HydrophobicContact CE1-CB 4.27Å; F64-L70 HydrophobicContact CE1-CD1 4.48Å; G67-L70 PolarHBondContact O-N 3.06Å; L68-L70 VanDerWaalsContact C-N 3.27Å; L68-L70 PolarHBondContact O-N 3.36Å; L70-L73 PolarHBondContact O-N 3.14Å; L70-L74 HydrophobicContact CG-CD1 4.47Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.41Å; L70-A101 HydrophobicContact CD2-CB 3.54Å; L70-A101 HydrophobicContact CG-CB 3.75Å; L70-M131 HydrophobicContact CD1-CE 3.66Å; L70-M131 HydrophobicContact CD1-SD 4.19Å; L70-M131 HydrophobicContact CD2-CE 3.76Å; L70-M131 HydrophobicContact CD2-SD 3.6Å; L70-M131 HydrophobicContact CG-CE 4.35Å; L70-I132 HydrophobicContact CD1-CD1 4.32Å; L70-I135 HydrophobicContact CD1-CD1 3.89Å
71	I	93.4	Very high	91.2	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-48.4	173.6	-71.6	165.8	0	0	0	110.4	G67 L68 L73 L74 E75 L82 P85 N97 K100 A101	G67-I71 WeakPolarHBondContact O-CG1 3.47Å; G67-I71 PolarHBondContact O-N 3.15Å; L68-I71 PolarHBondContact O-N 2.83Å; I71-L73 VanDerWaalsContact C-N 3.31Å; I71-L73 PolarHBondContact O-N 3.42Å; I71-L74 PolarHBondContact O-N 3.33Å; I71-L74 VanDerWaalsContact O-N 3.17Å; I71-E75 HydrophobicContact CG2-CG 4.39Å; I71-E75 WeakPolarHBondContact O-CG 3.45Å; I71-E75 PolarHBondContact O-N 3.32Å; I71-L82 HydrophobicContact CB-CD2 4.44Å; I71-L82 HydrophobicContact CG1-CD2 4.38Å; I71-L82 HydrophobicContact CG2-CB 3.88Å; I71-L82 HydrophobicContact CG2-CD2 4.08Å; I71-P85 HydrophobicContact CD1-CB 3.94Å; I71-N97 HydrophobicContact CD1-CB 4.25Å; I71-K100 HydrophobicContact CD1-CB 4.45Å; I71-A101 HydrophobicContact CG1-CB 4.14Å
72	Q	92.4	Very high	91.3	Very high	76 Å²	76	45.7 Å²	45.7	36%	0.355	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-38.1	178.4	-71.8	179.5	-19.8	0	0	113.2	L50 C55 L68 T76	L50-Q72 HydrophobicContact CD2-CB 4.2Å; C55-Q72 PolarHBondContact SG-OE1 2.95Å; L68-Q72 WeakPolarHBondContact O-CG 3.13Å; L68-Q72 PolarHBondContact O-N 3.38Å; Q72-T76 WeakPolarHBondContact O-CB 3.12Å; Q72-T76 PolarHBondContact O-N 3.43Å; Q72-T76 VanDerWaalsContact O-N 3.09Å; Q72-T76 PolarHBondContact O-OG1 2.83Å
73	L	94	Very high	91.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-46.8	175.2	177.6	63.4	0	0	0	110.8	W45 C46 L50 F64 K69 L70 I71 T76 L77 I132	W45-L73 HydrophobicContact CZ3-CD1 4.48Å; W45-L73 HydrophobicContact CZ3-CD2 4.12Å; C46-L73 HydrophobicContact CB-CD1 4.49Å; C46-L73 HydrophobicContact CB-CD2 4.29Å; L50-L73 HydrophobicContact CD2-CB 4.06Å; L50-L73 HydrophobicContact CG-CD1 4.29Å; F64-L73 HydrophobicContact CE1-CD2 4.37Å; F64-L73 HydrophobicContact CZ-CD2 4.03Å; K69-L73 WeakPolarHBondContact O-CB 3.19Å; K69-L73 PolarHBondContact O-N 2.71Å; L70-L73 PolarHBondContact O-N 3.14Å; I71-L73 VanDerWaalsContact C-N 3.31Å; I71-L73 PolarHBondContact O-N 3.42Å; L73-T76 PolarHBondContact O-N 3.03Å; L73-L77 HydrophobicContact CD1-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CG 4.32Å; L73-L77 HydrophobicContact CG-CD1 3.79Å; L73-L77 WeakPolarHBondContact O-CD1 3.28Å; L73-L77 VanDerWaalsContact O-CG 3.3Å; L73-L77 WeakPolarHBondContact O-CG 3.36Å; L73-L77 PolarHBondContact O-N 2.84Å; L73-I132 HydrophobicContact CD2-CD1 4.29Å
74	L	93.2	Very high	90.8	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-46.5	178.4	-70	168.5	0	0	0	112.1	L70 I71 T76 L77 S78 L82 A101 Y104 I105 I135 F139	L70-L74 HydrophobicContact CG-CD1 4.47Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.41Å; I71-L74 PolarHBondContact O-N 3.33Å; I71-L74 VanDerWaalsContact O-N 3.17Å; L74-T76 PolarHBondContact O-N 3.21Å; L74-L77 PolarHBondContact O-N 2.91Å; L74-L77 VanDerWaalsContact O-N 3.08Å; L74-S78 PolarHBondContact O-N 3.49Å; L74-S78 PolarHBondContact O-OG 3.44Å; L74-L82 HydrophobicContact CB-CD1 4.27Å; L74-L82 HydrophobicContact CB-CD2 3.76Å; L74-L82 HydrophobicContact CD1-CD2 3.93Å; L74-A101 HydrophobicContact CD1-CB 3.69Å; L74-Y104 HydrophobicContact CB-CD1 4.21Å; L74-Y104 HydrophobicContact CB-CE1 4.35Å; L74-Y104 HydrophobicContact CD1-CD1 4.18Å; L74-Y104 HydrophobicContact CD2-CD1 4.36Å; L74-Y104 HydrophobicContact CG-CD1 4.49Å; L74-I105 HydrophobicContact CD1-CD1 4.04Å; L74-I105 HydrophobicContact CD1-CG1 3.98Å; L74-I105 HydrophobicContact CD2-CD1 4.17Å; L74-I105 HydrophobicContact CD2-CG1 3.77Å; L74-I135 HydrophobicContact CD2-CD1 4.1Å; L74-I135 HydrophobicContact CD2-CG1 4.33Å; L74-I135 HydrophobicContact CD2-CG2 4.1Å; L74-F139 HydrophobicContact CD2-CE2 4.11Å; L74-F139 HydrophobicContact CD2-CZ 4.49Å
75	E	92.3	Very high	90.6	Very high	69 Å²	69	52.4 Å²	52.4	32%	0.322	27%	0.272	S	S	.	.	H	α-helix	trans	-56.9	-36.1	174.7	-68.8	-176.7	134.8	0	0	112.2	I71 E79 E80 L82	I71-E75 HydrophobicContact CG2-CG 4.39Å; I71-E75 WeakPolarHBondContact O-CG 3.45Å; I71-E75 PolarHBondContact O-N 3.32Å; E75-E79 WeakPolarHBondContact O-CA 3.32Å; E75-E79 PolarHBondContact O-N 3.32Å; E75-E80 WeakPolarHBondContact CA-O 3.41Å; E75-L82 HydrophobicContact CG-CB 3.78Å; E75-L82 HydrophobicContact CG-CD1 3.69Å; E75-L82 HydrophobicContact CG-CG 4.21Å; E75-L82 PolarHBondContact OE1-N 2.98Å
76	T	91	Very high	90.5	Very high	21 Å²	21	54.3 Å²	54.3	13%	0.129	28%	0.282	C	S	.	.	H	α-helix	trans	-78.6	-22	179.7	-51.7	0	0	0	0	113.1	K52 V53 Q72 L73 L74	K52-T76 HydrophobicContact CB-CG2 4.15Å; K52-T76 HydrophobicContact CD-CG2 4.01Å; V53-T76 HydrophobicContact CG1-CG2 4.41Å; V53-T76 WeakPolarHBondContact CG1-OG1 3.29Å; Q72-T76 WeakPolarHBondContact O-CB 3.12Å; Q72-T76 PolarHBondContact O-N 3.43Å; Q72-T76 VanDerWaalsContact O-N 3.09Å; Q72-T76 PolarHBondContact O-OG1 2.83Å; L73-T76 PolarHBondContact O-N 3.03Å; L74-T76 PolarHBondContact O-N 3.21Å
77	L	89.7	Confident	90	Very high	27 Å²	27	63.6 Å²	63.6	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-88.9	-36.1	179.2	-76.9	164.4	0	0	0	112.8	W45 Y49 L73 L74 I135 F139	W45-L77 HydrophobicContact CH2-CD1 3.63Å; W45-L77 HydrophobicContact CH2-CD2 4.09Å; W45-L77 HydrophobicContact CZ2-CD1 4.23Å; W45-L77 HydrophobicContact CZ2-CD2 3.84Å; Y49-L77 HydrophobicContact CD1-CD2 3.52Å; Y49-L77 HydrophobicContact CD1-CG 4.24Å; Y49-L77 HydrophobicContact CD2-CD2 4.07Å; Y49-L77 HydrophobicContact CE1-CD2 3.46Å; Y49-L77 VanDerWaalsContact CE1-CD2 3.46Å; Y49-L77 HydrophobicContact CE2-CD2 4.05Å; Y49-L77 HydrophobicContact CG-CD2 3.84Å; Y49-L77 HydrophobicContact CG-CG 4.43Å; L73-L77 HydrophobicContact CD1-CD1 3.92Å; L73-L77 HydrophobicContact CD1-CG 4.32Å; L73-L77 HydrophobicContact CG-CD1 3.79Å; L73-L77 WeakPolarHBondContact O-CD1 3.28Å; L73-L77 VanDerWaalsContact O-CG 3.3Å; L73-L77 WeakPolarHBondContact O-CG 3.36Å; L73-L77 PolarHBondContact O-N 2.84Å; L74-L77 PolarHBondContact O-N 2.91Å; L74-L77 VanDerWaalsContact O-N 3.08Å; L77-I135 HydrophobicContact CD1-CG2 3.56Å; L77-F139 HydrophobicContact CB-CD1 4.31Å; L77-F139 HydrophobicContact CB-CG 4.37Å
78	S	86.7	Confident	89.3	Confident	24 Å²	24	64.8 Å²	64.8	17%	0.168	33%	0.325	C	S	.	.	H	α-helix	trans	-94.4	-14.7	-177.7	63.6	0	0	0	0	114.5	L74 E80 Y104	L74-S78 PolarHBondContact O-N 3.49Å; L74-S78 PolarHBondContact O-OG 3.44Å; S78-E80 PolarHBondContact O-N 2.83Å; S78-E80 PolarHBondContact OG-N 3.26Å; S78-Y104 WeakPolarHBondContact CB-OH 3.16Å; S78-Y104 PolarHBondContact OG-OH 3.4Å
79	E	85.3	Confident	88.9	Confident	175 Å²	175	71.5 Å²	71.5	82%	0.818	35%	0.351	S	S	*	.	S	Bend	trans	58.4	18.9	-168.8	-53	-170.4	164.4	0	0	113.5	E75	E75-E79 WeakPolarHBondContact O-CA 3.32Å; E75-E79 PolarHBondContact O-N 3.32Å
80	E	86.8	Confident	88.7	Confident	81 Å²	81	75 Å²	75	38%	0.379	37%	0.37	S	S	.	.	S	Bend	trans	-112.8	143.1	177.9	-67.9	173.3	-177.5	0	0	111.9	E75 S78 Y104 K108	E75-E80 WeakPolarHBondContact CA-O 3.41Å; S78-E80 PolarHBondContact O-N 2.83Å; S78-E80 PolarHBondContact OG-N 3.26Å; E80-Y104 PolarHBondContact OE2-OH 3.42Å; E80-K108 IonicContact OE1-NZ 3.9Å; E80-K108 PolarHBondContact OE1-NZ 3.21Å; E80-K108 VanDerWaalsContact OE2-CE 3.25Å; E80-K108 WeakPolarHBondContact OE2-CE 3.45Å; E80-K108 IonicContact OE2-NZ 3Å; E80-K108 PolarHBondContact OE2-NZ 2.96Å
81	P	86	Confident	88.6	Confident	116 Å²	116	80.5 Å²	80.5	75%	0.753	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-73.9	135.8	175.1	30.7	-34.3	0	0	0	112.1
82	L	88.9	Confident	88.5	Confident	13 Å²	13	86.1 Å²	86.1	7%	0.068	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-94.8	165.3	177.4	-95.7	69.9	0	0	0	112.2	I71 L74 E75 K84 Y104	I71-L82 HydrophobicContact CB-CD2 4.44Å; I71-L82 HydrophobicContact CG1-CD2 4.38Å; I71-L82 HydrophobicContact CG2-CB 3.88Å; I71-L82 HydrophobicContact CG2-CD2 4.08Å; L74-L82 HydrophobicContact CB-CD1 4.27Å; L74-L82 HydrophobicContact CB-CD2 3.76Å; L74-L82 HydrophobicContact CD1-CD2 3.93Å; E75-L82 HydrophobicContact CG-CB 3.78Å; E75-L82 HydrophobicContact CG-CD1 3.69Å; E75-L82 HydrophobicContact CG-CG 4.21Å; E75-L82 PolarHBondContact OE1-N 2.98Å; L82-K84 PolarHBondContact O-N 3.24Å; L82-Y104 HydrophobicContact CD1-CD1 3.91Å; L82-Y104 HydrophobicContact CD1-CD2 3.83Å; L82-Y104 HydrophobicContact CD1-CE1 3.77Å; L82-Y104 HydrophobicContact CD1-CE2 3.7Å; L82-Y104 HydrophobicContact CD1-CG 3.93Å; L82-Y104 HydrophobicContact CD2-CD1 4.04Å; L82-Y104 HydrophobicContact CD2-CD2 4.43Å; L82-Y104 HydrophobicContact CD2-CG 3.89Å; L82-Y104 HydrophobicContact CG-CD1 4.22Å; L82-Y104 HydrophobicContact CG-CD2 3.87Å; L82-Y104 HydrophobicContact CG-CE2 4.25Å; L82-Y104 HydrophobicContact CG-CG 3.85Å
83	P	87.7	Confident	88.5	Confident	74 Å²	74	84.4 Å²	84.4	48%	0.481	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-56.8	129	172.7	-24.3	34.9	0	0	0	111.9	K100	P83-K100 HydrophobicContact CB-CD 4.34Å; P83-K100 HydrophobicContact CB-CG 4.34Å
84	K	89	Confident	88.5	Confident	186 Å²	186	87 Å²	87	81%	0.809	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-54.8	132.9	-173.5	-67.5	-178.8	-179.5	175.4	0	111.9	L82 K100	L82-K84 PolarHBondContact O-N 3.24Å; K84-K100 PolarHBondContact O-NZ 3.23Å
85	P	89.8	Confident	88.5	Confident	51 Å²	51	88.7 Å²	88.7	33%	0.331	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-70.4	150.3	-178.7	25.8	-33.6	0	0	0	113.1	L68 I71 N97	L68-P85 HydrophobicContact CD2-CB 3.41Å; L68-P85 VanDerWaalsContact CD2-CB 3.41Å; L68-P85 HydrophobicContact CD2-CG 3.94Å; I71-P85 HydrophobicContact CD1-CB 3.94Å; P85-N97 WeakPolarHBondContact CA-OD1 3.28Å
86	D	90.3	Very high	88.6	Confident	61 Å²	61	86.8 Å²	86.8	33%	0.326	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-79.2	128.7	174	-59.7	-32.6	0	0	0	109.9	G88 H93 A96 N97 K100	D86-G88 VanDerWaalsContact C-N 3.3Å; D86-G88 PolarHBondContact O-N 2.99Å; D86-H93 HydrophobicContact CB-CB 4.41Å; D86-A96 VanDerWaalsContact OD2-CB 3.22Å; D86-A96 WeakPolarHBondContact OD2-CB 2.71Å; D86-N97 PolarHBondContact N-OD1 2.71Å; D86-N97 PolarHBondContact O-ND2 3.17Å; D86-N97 VanDerWaalsContact O-ND2 3.08Å; D86-K100 IonicContact OD1-NZ 2.67Å; D86-K100 PolarHBondContact OD1-NZ 3.22Å; D86-K100 IonicContact OD2-NZ 3.93Å; D86-K100 PolarHBondContact OD2-NZ 3.09Å
87	R	81.1	Confident	88.8	Confident	247 Å²	247	85.9 Å²	85.9	93%	0.932	42%	0.418	S	S	*	.			trans	-89.3	20.4	-166.5	-62.2	-178.5	171.8	-171.8	-5.6	114.7
88	G	78.6	Confident	89	Confident	25 Å²	25	84.6 Å²	84.6	26%	0.258	41%	0.411	S	S	.	.			trans	-101	156.7	-174	0	0	0	0	0	114	D86 H93	D86-G88 VanDerWaalsContact C-N 3.3Å; D86-G88 PolarHBondContact O-N 2.99Å; G88-H93 VanDerWaalsContact CA-CG 3.5Å; G88-H93 WeakPolarHBondContact O-CB 3.27Å
89	K	84.7	Confident	89.4	Confident	204 Å²	204	86.7 Å²	86.7	89%	0.887	42%	0.42	S	S	*	.			trans	-94.2	-12.9	-176.8	-63.3	-170.7	177.3	-171.4	0	115.2
90	M	89	Confident	89.8	Confident	122 Å²	122	80.1 Å²	80.1	60%	0.601	39%	0.389	S	S	*	.	S	Bend	trans	-74.7	149.3	-178.6	-57.9	174.6	66.5	0	0	111.2	F92 H93 K94	M90-F92 HydrophobicContact CB-CD1 3.83Å; M90-F92 HydrophobicContact CB-CE1 3.82Å; M90-F92 HydrophobicContact CE-CD1 4.33Å; M90-F92 HydrophobicContact CE-CE1 3.95Å; M90-F92 HydrophobicContact CG-CE1 4.37Å; M90-F92 PolarHBondContact O-N 3.38Å; M90-F92 HydrophobicContact SD-CE1 3.74Å; M90-H93 PolarHBondContact N-ND1 2.67Å; M90-H93 WeakPolarHBondContact O-CB 3.45Å; M90-H93 PolarHBondContact O-N 2.82Å; M90-H93 PolarHBondContact O-ND1 3Å; M90-K94 PolarHBondContact O-N 2.93Å
91	R	91.7	Very high	90.1	Very high	116 Å²	116	76.3 Å²	76.3	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-48.6	-34.9	-176.5	-171.9	175.2	177.1	-91.2	1	114.3	H93 K94 L95 V121 D122	R91-H93 VanDerWaalsContact C-N 3.35Å; R91-H93 PolarHBondContact O-N 2.74Å; R91-K94 WeakPolarHBondContact O-CB 3.34Å; R91-K94 PolarHBondContact O-N 3.43Å; R91-L95 HydrophobicContact CG-CD1 4.4Å; R91-L95 WeakPolarHBondContact O-CG 2.92Å; R91-L95 PolarHBondContact O-N 3.47Å; R91-V121 HydrophobicContact CG-CG1 3.79Å; R91-D122 IonicContact CZ-OD1 3.32Å; R91-D122 VanDerWaalsContact CZ-OD1 3.32Å; R91-D122 IonicContact CZ-OD2 3.75Å; R91-D122 IonicContact NE-OD1 2.77Å; R91-D122 PolarHBondContact NE-OD1 3.24Å; R91-D122 IonicContact NE-OD2 3.04Å; R91-D122 IonicContact NH2-OD1 2.67Å; R91-D122 PolarHBondContact NH2-OD1 2.84Å; R91-D122 IonicContact NH2-OD2 3.58Å; R91-D122 PolarHBondContact NH2-OD2 2.76Å
92	F	90.7	Very high	90.4	Very high	121 Å²	121	71.2 Å²	71.2	53%	0.531	34%	0.338	S	S	.	.	H	α-helix	trans	-67.5	-29.6	178	79.3	-98.7	0	0	0	114	M90 A96	M90-F92 HydrophobicContact CB-CD1 3.83Å; M90-F92 HydrophobicContact CB-CE1 3.82Å; M90-F92 HydrophobicContact CE-CD1 4.33Å; M90-F92 HydrophobicContact CE-CE1 3.95Å; M90-F92 HydrophobicContact CG-CE1 4.37Å; M90-F92 PolarHBondContact O-N 3.38Å; M90-F92 HydrophobicContact SD-CE1 3.74Å; F92-A96 WeakPolarHBondContact O-CB 3.22Å; F92-A96 PolarHBondContact O-N 2.95Å
93	H	91.7	Very high	90.6	Very high	39 Å²	39	75.3 Å²	75.3	18%	0.181	36%	0.359	C	S	.	.	H	α-helix	trans	-71.1	-39.2	173	-54.2	97.7	0	0	0	110.8	D86 G88 M90 R91 A96 N97	D86-H93 HydrophobicContact CB-CB 4.41Å; G88-H93 VanDerWaalsContact CA-CG 3.5Å; G88-H93 WeakPolarHBondContact O-CB 3.27Å; M90-H93 PolarHBondContact N-ND1 2.67Å; M90-H93 WeakPolarHBondContact O-CB 3.45Å; M90-H93 PolarHBondContact O-N 2.82Å; M90-H93 PolarHBondContact O-ND1 3Å; R91-H93 VanDerWaalsContact C-N 3.35Å; R91-H93 PolarHBondContact O-N 2.74Å; H93-A96 PolarHBondContact O-N 3.42Å; H93-N97 VanDerWaalsContact O-CG 3.3Å; H93-N97 PolarHBondContact O-N 2.88Å; H93-N97 PolarHBondContact O-ND2 2.75Å
94	K	94.2	Very high	90.8	Very high	56 Å²	56	72.8 Å²	72.8	24%	0.243	34%	0.34	C	S	.	.	H	α-helix	trans	-58.6	-49.9	173.2	-63.5	-171.3	145.2	-146.2	0	110.7	T65 D66 M90 R91 A96 N97 V98 V121	T65-K94 WeakPolarHBondContact O-CB 3.27Å; T65-K94 VanDerWaalsContact O-CD 3.28Å; T65-K94 WeakPolarHBondContact O-CD 3.41Å; T65-K94 PolarHBondContact O-NZ 3.13Å; T65-K94 PolarHBondContact OG1-NZ 2.91Å; D66-K94 HydrophobicContact CB-CD 4.47Å; D66-K94 HydrophobicContact CB-CG 4.17Å; M90-K94 PolarHBondContact O-N 2.93Å; R91-K94 WeakPolarHBondContact O-CB 3.34Å; R91-K94 PolarHBondContact O-N 3.43Å; K94-A96 VanDerWaalsContact C-N 3.34Å; K94-A96 PolarHBondContact O-N 2.97Å; K94-N97 PolarHBondContact O-N 3.5Å; K94-V98 WeakPolarHBondContact O-CG2 3.38Å; K94-V98 PolarHBondContact O-N 2.84Å; K94-V121 HydrophobicContact CB-CG1 3.83Å; K94-V121 HydrophobicContact CB-CG2 3.9Å; K94-V121 HydrophobicContact CD-CG1 4.15Å
95	L	94	Very high	90.9	Very high	35 Å²	35	63.9 Å²	63.9	18%	0.183	30%	0.302	C	S	.	.	H	α-helix	trans	-57.5	-44.1	174.2	-73.5	168.6	0	0	0	112.2	R91 N97 V98 N99 A117 E118 V121	R91-L95 HydrophobicContact CG-CD1 4.4Å; R91-L95 WeakPolarHBondContact O-CG 2.92Å; R91-L95 PolarHBondContact O-N 3.47Å; L95-N97 VanDerWaalsContact C-N 3.35Å; L95-N97 PolarHBondContact O-N 3.04Å; L95-V98 PolarHBondContact O-N 3.34Å; L95-N99 WeakPolarHBondContact O-CB 3.38Å; L95-N99 VanDerWaalsContact O-CG 3.32Å; L95-N99 PolarHBondContact O-N 3.02Å; L95-N99 PolarHBondContact O-ND2 3.33Å; L95-A117 HydrophobicContact CD2-CB 4.11Å; L95-E118 HydrophobicContact CD2-CB 4.21Å; L95-V121 HydrophobicContact CD2-CB 4.12Å; L95-V121 HydrophobicContact CD2-CG1 4.5Å; L95-V121 HydrophobicContact CD2-CG2 3.88Å; L95-V121 HydrophobicContact CG-CG1 4.43Å; L95-V121 HydrophobicContact CG-CG2 4.16Å
96	A	94	Very high	90.8	Very high	28 Å²	28	66.5 Å²	66.5	23%	0.231	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-37.2	178.4	0	0	0	0	0	112.8	D86 F92 H93 K94 K100	D86-A96 VanDerWaalsContact OD2-CB 3.22Å; D86-A96 WeakPolarHBondContact OD2-CB 2.71Å; F92-A96 WeakPolarHBondContact O-CB 3.22Å; F92-A96 PolarHBondContact O-N 2.95Å; H93-A96 PolarHBondContact O-N 3.42Å; K94-A96 VanDerWaalsContact C-N 3.34Å; K94-A96 PolarHBondContact O-N 2.97Å; A96-K100 VanDerWaalsContact O-CG 3.28Å; A96-K100 WeakPolarHBondContact O-CG 3.34Å; A96-K100 PolarHBondContact O-N 3.49Å; A96-K100 VanDerWaalsContact O-N 3.09Å
97	N	95.5	Very high	90.8	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-43	175.1	-69.5	-21.2	0	0	0	112.6	D66 L68 I71 P85 D86 H93 K94 L95 K100 A101	D66-N97 WeakPolarHBondContact O-CB 3.41Å; D66-N97 PolarHBondContact O-ND2 2.77Å; D66-N97 VanDerWaalsContact O-ND2 3.1Å; L68-N97 WeakPolarHBondContact CD2-ND2 3.32Å; I71-N97 HydrophobicContact CD1-CB 4.25Å; P85-N97 WeakPolarHBondContact CA-OD1 3.28Å; D86-N97 PolarHBondContact N-OD1 2.71Å; D86-N97 PolarHBondContact O-ND2 3.17Å; D86-N97 VanDerWaalsContact O-ND2 3.08Å; H93-N97 VanDerWaalsContact O-CG 3.3Å; H93-N97 PolarHBondContact O-N 2.88Å; H93-N97 PolarHBondContact O-ND2 2.75Å; K94-N97 PolarHBondContact O-N 3.5Å; L95-N97 VanDerWaalsContact C-N 3.35Å; L95-N97 PolarHBondContact O-N 3.04Å; N97-K100 PolarHBondContact O-N 3.22Å; N97-A101 PolarHBondContact O-N 3.48Å
98	V	94.2	Very high	91	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-45.3	175.3	173.2	0	0	0	0	110.3	K94 L95 K100 A101 L102 A117 I120 V121	K94-V98 WeakPolarHBondContact O-CG2 3.38Å; K94-V98 PolarHBondContact O-N 2.84Å; L95-V98 PolarHBondContact O-N 3.34Å; V98-K100 PolarHBondContact O-N 3.11Å; V98-A101 WeakPolarHBondContact O-CA 3.47Å; V98-A101 WeakPolarHBondContact O-CB 3.4Å; V98-A101 PolarHBondContact O-N 3.29Å; V98-L102 HydrophobicContact CG1-CD1 4.04Å; V98-L102 HydrophobicContact CG1-CG 4.04Å; V98-L102 WeakPolarHBondContact O-CG 3.42Å; V98-L102 PolarHBondContact O-N 3.47Å; V98-A117 HydrophobicContact CB-CB 4.12Å; V98-A117 HydrophobicContact CG1-CB 3.64Å; V98-I120 HydrophobicContact CG1-CB 3.91Å; V98-I120 HydrophobicContact CG1-CG1 4.16Å; V98-I120 HydrophobicContact CG1-CG2 4.17Å; V98-I120 HydrophobicContact CG2-CB 4.49Å; V98-I120 HydrophobicContact CG2-CG2 4.15Å; V98-V121 HydrophobicContact CB-CG2 4.19Å; V98-V121 HydrophobicContact CG2-CG2 3.71Å
99	N	94.5	Very high	91.1	Very high	67 Å²	67	60.2 Å²	60.2	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-55.7	-46.7	174.9	-78.2	-44	0	0	0	112	L95 A101 L102 D103 A117	L95-N99 WeakPolarHBondContact O-CB 3.38Å; L95-N99 VanDerWaalsContact O-CG 3.32Å; L95-N99 PolarHBondContact O-N 3.02Å; L95-N99 PolarHBondContact O-ND2 3.33Å; N99-A101 PolarHBondContact O-N 3.29Å; N99-A101 VanDerWaalsContact O-N 3.12Å; N99-L102 PolarHBondContact O-N 2.89Å; N99-L102 VanDerWaalsContact O-N 3.09Å; N99-D103 WeakPolarHBondContact O-CB 3.09Å; N99-D103 PolarHBondContact O-N 3.41Å; N99-A117 WeakPolarHBondContact OD1-CB 3.33Å
100	K	94.2	Very high	91	Very high	38 Å²	38	51.4 Å²	51.4	17%	0.165	27%	0.27	C	S	.	.	H	α-helix	trans	-55.6	-32.5	175.1	-72.7	165.7	-172.2	172.2	0	113.5	I71 P83 K84 D86 A96 N97 V98 Y104	I71-K100 HydrophobicContact CD1-CB 4.45Å; P83-K100 HydrophobicContact CB-CD 4.34Å; P83-K100 HydrophobicContact CB-CG 4.34Å; K84-K100 PolarHBondContact O-NZ 3.23Å; D86-K100 IonicContact OD1-NZ 2.67Å; D86-K100 PolarHBondContact OD1-NZ 3.22Å; D86-K100 IonicContact OD2-NZ 3.93Å; D86-K100 PolarHBondContact OD2-NZ 3.09Å; A96-K100 VanDerWaalsContact O-CG 3.28Å; A96-K100 WeakPolarHBondContact O-CG 3.34Å; A96-K100 PolarHBondContact O-N 3.49Å; A96-K100 VanDerWaalsContact O-N 3.09Å; N97-K100 PolarHBondContact O-N 3.22Å; V98-K100 PolarHBondContact O-N 3.11Å; K100-Y104 PolarHBondContact O-N 3.17Å
101	A	93	Very high	90.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-78.6	-42.2	175.8	0	0	0	0	0	112.5	L70 I71 L74 N97 V98 N99 Y104 I105	L70-A101 HydrophobicContact CD2-CB 3.54Å; L70-A101 HydrophobicContact CG-CB 3.75Å; I71-A101 HydrophobicContact CG1-CB 4.14Å; L74-A101 HydrophobicContact CD1-CB 3.69Å; N97-A101 PolarHBondContact O-N 3.48Å; V98-A101 WeakPolarHBondContact O-CA 3.47Å; V98-A101 WeakPolarHBondContact O-CB 3.4Å; V98-A101 PolarHBondContact O-N 3.29Å; N99-A101 PolarHBondContact O-N 3.29Å; N99-A101 VanDerWaalsContact O-N 3.12Å; A101-Y104 PolarHBondContact O-N 3.39Å; A101-I105 WeakPolarHBondContact O-CD1 3.43Å; A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.43Å; A101-I105 PolarHBondContact O-N 3.1Å
102	L	92.9	Very high	90.1	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-46.6	176.3	-60.1	-173.5	0	0	0	111.2	V98 N99 Y104 I105 E106 L112 A117 M131	V98-L102 HydrophobicContact CG1-CD1 4.04Å; V98-L102 HydrophobicContact CG1-CG 4.04Å; V98-L102 WeakPolarHBondContact O-CG 3.42Å; V98-L102 PolarHBondContact O-N 3.47Å; N99-L102 PolarHBondContact O-N 2.89Å; N99-L102 VanDerWaalsContact O-N 3.09Å; L102-Y104 PolarHBondContact O-N 3.5Å; L102-I105 HydrophobicContact CD2-CD1 4.38Å; L102-I105 WeakPolarHBondContact O-CA 2.85Å; L102-I105 WeakPolarHBondContact O-CB 3.44Å; L102-I105 PolarHBondContact O-N 3.47Å; L102-E106 PolarHBondContact O-N 2.93Å; L102-L112 HydrophobicContact CB-CD1 3.82Å; L102-L112 HydrophobicContact CD2-CD1 3.89Å; L102-L112 HydrophobicContact CG-CD1 4.28Å; L102-A117 HydrophobicContact CD1-CB 4.02Å; L102-M131 HydrophobicContact CD2-CG 4.22Å; L102-M131 HydrophobicContact CD2-SD 3.77Å
103	D	92.1	Very high	89.5	Confident	98 Å²	98	48.7 Å²	48.7	52%	0.524	27%	0.27	S	S	.	.	H	α-helix	trans	-52.9	-41	173.6	-66.6	-21.1	0	0	0	111.3	N99 S107	N99-D103 WeakPolarHBondContact O-CB 3.09Å; N99-D103 PolarHBondContact O-N 3.41Å; D103-S107 WeakPolarHBondContact O-CB 3.05Å; D103-S107 PolarHBondContact O-N 3.08Å
104	Y	92.5	Very high	89	Confident	21 Å²	21	51.3 Å²	51.3	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-43.1	176.9	-176.2	-97.9	0	0	0	112.1	L74 S78 E80 L82 K100 A101 L102 S107 K108 F139	L74-Y104 HydrophobicContact CB-CD1 4.21Å; L74-Y104 HydrophobicContact CB-CE1 4.35Å; L74-Y104 HydrophobicContact CD1-CD1 4.18Å; L74-Y104 HydrophobicContact CD2-CD1 4.36Å; L74-Y104 HydrophobicContact CG-CD1 4.49Å; S78-Y104 WeakPolarHBondContact CB-OH 3.16Å; S78-Y104 PolarHBondContact OG-OH 3.4Å; E80-Y104 PolarHBondContact OE2-OH 3.42Å; L82-Y104 HydrophobicContact CD1-CD1 3.91Å; L82-Y104 HydrophobicContact CD1-CD2 3.83Å; L82-Y104 HydrophobicContact CD1-CE1 3.77Å; L82-Y104 HydrophobicContact CD1-CE2 3.7Å; L82-Y104 HydrophobicContact CD1-CG 3.93Å; L82-Y104 HydrophobicContact CD2-CD1 4.04Å; L82-Y104 HydrophobicContact CD2-CD2 4.43Å; L82-Y104 HydrophobicContact CD2-CG 3.89Å; L82-Y104 HydrophobicContact CG-CD1 4.22Å; L82-Y104 HydrophobicContact CG-CD2 3.87Å; L82-Y104 HydrophobicContact CG-CE2 4.25Å; L82-Y104 HydrophobicContact CG-CG 3.85Å; K100-Y104 PolarHBondContact O-N 3.17Å; A101-Y104 PolarHBondContact O-N 3.39Å; L102-Y104 PolarHBondContact O-N 3.5Å; Y104-S107 PolarHBondContact O-N 2.92Å; Y104-S107 PolarHBondContact O-OG 2.84Å; Y104-K108 HydrophobicContact CE1-CG 4.19Å; Y104-K108 VanDerWaalsContact CZ-CE 3.43Å; Y104-K108 PolarHBondContact O-N 3.36Å; Y104-K108 WeakPolarHBondContact OH-CE 3.49Å; Y104-F139 HydrophobicContact CE1-CZ 4.18Å
105	I	89.8	Confident	88.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-44.8	176.2	-68.5	161.2	0	0	0	110.7	L74 A101 L102 S107 K108 V110 L112 I135	L74-I105 HydrophobicContact CD1-CD1 4.04Å; L74-I105 HydrophobicContact CD1-CG1 3.98Å; L74-I105 HydrophobicContact CD2-CD1 4.17Å; L74-I105 HydrophobicContact CD2-CG1 3.77Å; A101-I105 WeakPolarHBondContact O-CD1 3.43Å; A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.43Å; A101-I105 PolarHBondContact O-N 3.1Å; L102-I105 HydrophobicContact CD2-CD1 4.38Å; L102-I105 WeakPolarHBondContact O-CA 2.85Å; L102-I105 WeakPolarHBondContact O-CB 3.44Å; L102-I105 PolarHBondContact O-N 3.47Å; I105-S107 PolarHBondContact O-N 3.39Å; I105-K108 PolarHBondContact O-N 3.43Å; I105-V110 HydrophobicContact CG2-CB 3.66Å; I105-V110 HydrophobicContact CG2-CG1 3.8Å; I105-V110 HydrophobicContact CG2-CG2 3.96Å; I105-L112 HydrophobicContact CB-CD1 4.5Å; I105-L112 HydrophobicContact CG2-CD1 4.3Å; I105-L112 HydrophobicContact CG2-CD2 3.99Å; I105-L112 HydrophobicContact CG2-CG 4.31Å; I105-I135 HydrophobicContact CD1-CD1 3.71Å; I105-I135 HydrophobicContact CD1-CG1 3.72Å; I105-I135 HydrophobicContact CG1-CG1 4.2Å
106	E	89.5	Confident	88.3	Confident	105 Å²	105	48.8 Å²	48.8	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-40.7	174.3	-65.5	-162	150.9	0	0	112	L102 K108 G109 L112	L102-E106 PolarHBondContact O-N 2.93Å; E106-K108 PolarHBondContact O-N 3.46Å; E106-K108 VanDerWaalsContact O-N 3.13Å; E106-G109 PolarHBondContact O-N 3.46Å; E106-L112 HydrophobicContact CG-CD1 3.77Å; E106-L112 HydrophobicContact CG-CG 4.08Å
107	S	90	Very high	88.2	Confident	85 Å²	85	47.5 Å²	47.5	59%	0.594	28%	0.276	S	S	*	.	H	α-helix	trans	-60.4	-23.7	176.9	83.7	0	0	0	0	113.7	D103 Y104 I105 G109	D103-S107 WeakPolarHBondContact O-CB 3.05Å; D103-S107 PolarHBondContact O-N 3.08Å; Y104-S107 PolarHBondContact O-N 2.92Å; Y104-S107 PolarHBondContact O-OG 2.84Å; I105-S107 PolarHBondContact O-N 3.39Å; S107-G109 VanDerWaalsContact C-N 3.29Å
108	K	85.3	Confident	88	Confident	57 Å²	57	51.8 Å²	51.8	25%	0.248	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	5.4	174.4	-64.9	-64.5	-176.6	-179.8	0	113.5	E80 Y104 I105 E106 R138 F139	E80-K108 IonicContact OE1-NZ 3.9Å; E80-K108 PolarHBondContact OE1-NZ 3.21Å; E80-K108 VanDerWaalsContact OE2-CE 3.25Å; E80-K108 WeakPolarHBondContact OE2-CE 3.45Å; E80-K108 IonicContact OE2-NZ 3Å; E80-K108 PolarHBondContact OE2-NZ 2.96Å; Y104-K108 HydrophobicContact CE1-CG 4.19Å; Y104-K108 VanDerWaalsContact CZ-CE 3.43Å; Y104-K108 PolarHBondContact O-N 3.36Å; Y104-K108 WeakPolarHBondContact OH-CE 3.49Å; I105-K108 PolarHBondContact O-N 3.43Å; E106-K108 PolarHBondContact O-N 3.46Å; E106-K108 VanDerWaalsContact O-N 3.13Å; K108-R138 VanDerWaalsContact O-CZ 3.31Å; K108-R138 PolarHBondContact O-NE 2.82Å; K108-R138 PolarHBondContact O-NH2 2.72Å; K108-F139 HydrophobicContact CB-CZ 4.4Å; K108-F139 HydrophobicContact CG-CZ 4.02Å
109	G	80.9	Confident	88	Confident	60 Å²	60	54.8 Å²	54.8	62%	0.619	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	21.8	173.5	0	0	0	0	0	114.8	E106 S107	E106-G109 PolarHBondContact O-N 3.46Å; S107-G109 VanDerWaalsContact C-N 3.29Å
110	V	82.3	Confident	87.9	Confident	19 Å²	19	51.6 Å²	51.6	12%	0.115	29%	0.293	C	S	.	.			trans	-93.6	134	176.2	-179.7	0	0	0	0	109.8	I105 L112 T134 R138	I105-V110 HydrophobicContact CG2-CB 3.66Å; I105-V110 HydrophobicContact CG2-CG1 3.8Å; I105-V110 HydrophobicContact CG2-CG2 3.96Å; V110-L112 HydrophobicContact CG1-CD2 4.15Å; V110-T134 HydrophobicContact CG1-CG2 4.36Å; V110-R138 HydrophobicContact CG2-CB 3.64Å; V110-R138 HydrophobicContact CG2-CG 3.53Å
111	Q	80	Confident	87.9	Confident	171 Å²	171	50.2 Å²	50.2	80%	0.799	29%	0.288	S	S	*	.			trans	-93.2	108.4	173.7	-69	-173.8	-18.1	0	0	110.7	V113	Q111-V113 VanDerWaalsContact C-N 3.34Å; Q111-V113 PolarHBondContact O-N 2.77Å; Q111-V113 VanDerWaalsContact O-N 3.07Å
112	L	82.1	Confident	87.8	Confident	20 Å²	20	55.3 Å²	55.3	11%	0.105	32%	0.315	C	S	.	.			trans	-84.1	71.7	-180	-66.4	178.3	0	0	0	111.8	L102 I105 E106 V110 S114 I115	L102-L112 HydrophobicContact CB-CD1 3.82Å; L102-L112 HydrophobicContact CD2-CD1 3.89Å; L102-L112 HydrophobicContact CG-CD1 4.28Å; I105-L112 HydrophobicContact CB-CD1 4.5Å; I105-L112 HydrophobicContact CG2-CD1 4.3Å; I105-L112 HydrophobicContact CG2-CD2 3.99Å; I105-L112 HydrophobicContact CG2-CG 4.31Å; E106-L112 HydrophobicContact CG-CD1 3.77Å; E106-L112 HydrophobicContact CG-CG 4.08Å; V110-L112 HydrophobicContact CG1-CD2 4.15Å; L112-S114 PolarHBondContact O-N 3.19Å; L112-I115 HydrophobicContact CD2-CD1 4.26Å
113	V	76.9	Confident	87.7	Confident	111 Å²	111	56.1 Å²	56.1	67%	0.673	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	121.5	176.7	-174.1	0	0	0	0	110.2	Q111 I115	Q111-V113 VanDerWaalsContact C-N 3.34Å; Q111-V113 PolarHBondContact O-N 2.77Å; Q111-V113 VanDerWaalsContact O-N 3.07Å; V113-I115 VanDerWaalsContact C-N 3.28Å; V113-I115 PolarHBondContact O-N 2.87Å
114	S	80.6	Confident	87.7	Confident	93 Å²	93	54 Å²	54	65%	0.65	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	13.8	177	-53.5	0	0	0	0	116.9	L112 M127	L112-S114 PolarHBondContact O-N 3.19Å; S114-M127 VanDerWaalsContact O-CE 3.3Å; S114-M127 WeakPolarHBondContact O-CE 3.13Å
115	I	85.6	Confident	87.6	Confident	20 Å²	20	54.6 Å²	54.6	10%	0.103	32%	0.318	C	S	.	.			trans	-107.3	95	176.7	-60.7	163.4	0	0	0	109.7	L112 V113 I120 M131 T134	L112-I115 HydrophobicContact CD2-CD1 4.26Å; V113-I115 VanDerWaalsContact C-N 3.28Å; V113-I115 PolarHBondContact O-N 2.87Å; I115-I120 HydrophobicContact CG2-CD1 4.13Å; I115-I120 HydrophobicContact CG2-CG1 4.41Å; I115-M131 HydrophobicContact CD1-CB 4.44Å; I115-M131 HydrophobicContact CG2-CB 4.19Å; I115-T134 HydrophobicContact CD1-CG2 4.5Å
116	G	87.7	Confident	87.6	Confident	18 Å²	18	59.8 Å²	59.8	19%	0.186	34%	0.341	C	S	.	.			trans	-89.4	155.8	173.9	0	0	0	0	0	112.9	E118 E119	G116-E118 PolarHBondContact O-N 3.4Å; G116-E119 WeakPolarHBondContact O-CB 3.47Å; G116-E119 PolarHBondContact O-N 3.24Å
117	A	92.1	Very high	87.7	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-31.5	178.1	0	0	0	0	0	112.6	L95 V98 N99 L102 E119 I120 V121	L95-A117 HydrophobicContact CD2-CB 4.11Å; V98-A117 HydrophobicContact CB-CB 4.12Å; V98-A117 HydrophobicContact CG1-CB 3.64Å; N99-A117 WeakPolarHBondContact OD1-CB 3.33Å; L102-A117 HydrophobicContact CD1-CB 4.02Å; A117-E119 VanDerWaalsContact C-N 3.33Å; A117-E119 PolarHBondContact O-N 2.85Å; A117-I120 PolarHBondContact O-N 2.74Å; A117-V121 WeakPolarHBondContact O-CB 3.49Å; A117-V121 VanDerWaalsContact O-CG2 3.28Å; A117-V121 WeakPolarHBondContact O-CG2 3.45Å; A117-V121 PolarHBondContact O-N 3.21Å
118	E	93	Very high	87.8	Confident	93 Å²	93	53.2 Å²	53.2	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-40.3	172.8	58.2	-77.4	-179	0	0	113	L95 G116 I120 V121 D122	L95-E118 HydrophobicContact CD2-CB 4.21Å; G116-E118 PolarHBondContact O-N 3.4Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 3.47Å; E118-V121 PolarHBondContact O-N 2.62Å; E118-D122 VanDerWaalsContact O-CB 3.3Å; E118-D122 WeakPolarHBondContact O-CB 3.28Å; E118-D122 PolarHBondContact O-N 2.69Å
119	E	93	Very high	88.2	Confident	62 Å²	62	50.6 Å²	50.6	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-39.5	179.9	-60.9	-65.2	153.8	0	0	111.6	G116 A117 G123 N124 M127	G116-E119 WeakPolarHBondContact O-CB 3.47Å; G116-E119 PolarHBondContact O-N 3.24Å; A117-E119 VanDerWaalsContact C-N 3.33Å; A117-E119 PolarHBondContact O-N 2.85Å; E119-G123 PolarHBondContact O-N 2.98Å; E119-N124 HydrophobicContact CB-CB 4.26Å; E119-N124 WeakPolarHBondContact O-CB 3.32Å; E119-N124 PolarHBondContact O-N 3.37Å; E119-N124 WeakPolarHBondContact OE2-CB 3.48Å; E119-N124 PolarHBondContact OE2-ND2 3.48Å; E119-M127 HydrophobicContact CB-CB 3.71Å; E119-M127 HydrophobicContact CB-CG 3.78Å; E119-M127 HydrophobicContact CG-CB 4.42Å; E119-M127 HydrophobicContact CG-CG 3.97Å
120	I	93	Very high	88.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-73.5	-40.4	177.4	-50.5	-59.2	0	0	0	111.2	F64 T65 V98 I115 A117 E118 G123 M127 M131	F64-I120 HydrophobicContact CB-CG2 4.46Å; T65-I120 WeakPolarHBondContact CG2-O 3.19Å; V98-I120 HydrophobicContact CG1-CB 3.91Å; V98-I120 HydrophobicContact CG1-CG1 4.16Å; V98-I120 HydrophobicContact CG1-CG2 4.17Å; V98-I120 HydrophobicContact CG2-CB 4.49Å; V98-I120 HydrophobicContact CG2-CG2 4.15Å; I115-I120 HydrophobicContact CG2-CD1 4.13Å; I115-I120 HydrophobicContact CG2-CG1 4.41Å; A117-I120 PolarHBondContact O-N 2.74Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 3.47Å; I120-G123 PolarHBondContact O-N 3.29Å; I120-M127 HydrophobicContact CD1-CB 4.42Å; I120-M131 HydrophobicContact CD1-CB 4.05Å; I120-M131 HydrophobicContact CD1-CE 4.1Å; I120-M131 HydrophobicContact CD1-SD 3.78Å; I120-M131 HydrophobicContact CG1-SD 3.92Å; I120-M131 HydrophobicContact CG2-CE 4.19Å; I120-M131 HydrophobicContact CG2-SD 4.39Å
121	V	93.1	Very high	89.2	Confident	10 Å²	10	47.6 Å²	47.6	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-69.8	-34	-179.8	169.6	0	0	0	0	112.4	R91 K94 L95 V98 A117 E118	R91-V121 HydrophobicContact CG-CG1 3.79Å; K94-V121 HydrophobicContact CB-CG1 3.83Å; K94-V121 HydrophobicContact CB-CG2 3.9Å; K94-V121 HydrophobicContact CD-CG1 4.15Å; L95-V121 HydrophobicContact CD2-CB 4.12Å; L95-V121 HydrophobicContact CD2-CG1 4.5Å; L95-V121 HydrophobicContact CD2-CG2 3.88Å; L95-V121 HydrophobicContact CG-CG1 4.43Å; L95-V121 HydrophobicContact CG-CG2 4.16Å; V98-V121 HydrophobicContact CB-CG2 4.19Å; V98-V121 HydrophobicContact CG2-CG2 3.71Å; A117-V121 WeakPolarHBondContact O-CB 3.49Å; A117-V121 VanDerWaalsContact O-CG2 3.28Å; A117-V121 WeakPolarHBondContact O-CG2 3.45Å; A117-V121 PolarHBondContact O-N 3.21Å; E118-V121 PolarHBondContact O-N 2.62Å
122	D	92.2	Very high	89.9	Confident	106 Å²	106	39.4 Å²	39.4	57%	0.567	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	1.7	179.6	-63.1	-14	0	0	0	113	R91 E118	R91-D122 IonicContact CZ-OD1 3.32Å; R91-D122 VanDerWaalsContact CZ-OD1 3.32Å; R91-D122 IonicContact CZ-OD2 3.75Å; R91-D122 IonicContact NE-OD1 2.77Å; R91-D122 PolarHBondContact NE-OD1 3.24Å; R91-D122 IonicContact NE-OD2 3.04Å; R91-D122 IonicContact NH2-OD1 2.67Å; R91-D122 PolarHBondContact NH2-OD1 2.84Å; R91-D122 IonicContact NH2-OD2 3.58Å; R91-D122 PolarHBondContact NH2-OD2 2.76Å; E118-D122 VanDerWaalsContact O-CB 3.3Å; E118-D122 WeakPolarHBondContact O-CB 3.28Å; E118-D122 PolarHBondContact O-N 2.69Å
123	G	90	Very high	90.4	Very high	27 Å²	27	39.9 Å²	39.9	28%	0.278	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	28.7	168.3	0	0	0	0	0	115.5	E119 I120 I125	E119-G123 PolarHBondContact O-N 2.98Å; I120-G123 PolarHBondContact O-N 3.29Å; G123-I125 PolarHBondContact O-N 2.92Å
124	N	91.8	Very high	91.1	Very high	54 Å²	54	35.8 Å²	35.8	29%	0.289	20%	0.201	S	C	.	.			trans	-70.4	98.4	176.6	-174.8	-18.6	0	0	0	111	E119 K126 M127 T128	E119-N124 HydrophobicContact CB-CB 4.26Å; E119-N124 WeakPolarHBondContact O-CB 3.32Å; E119-N124 PolarHBondContact O-N 3.37Å; E119-N124 WeakPolarHBondContact OE2-CB 3.48Å; E119-N124 PolarHBondContact OE2-ND2 3.48Å; N124-K126 PolarHBondContact O-N 3.28Å; N124-K126 VanDerWaalsContact O-N 3.09Å; N124-K126 PolarHBondContact OD1-N 3.05Å; N124-M127 HydrophobicContact CB-CB 4.28Å; N124-M127 HydrophobicContact CB-CG 4.26Å; N124-M127 WeakPolarHBondContact ND2-CG 3.41Å; N124-M127 PolarHBondContact O-N 3.3Å; N124-T128 PolarHBondContact O-N 2.91Å; N124-T128 PolarHBondContact O-OG1 3.25Å
125	I	91.4	Very high	91.6	Very high	33 Å²	33	31.4 Å²	31.4	17%	0.169	17%	0.17	C	C	.	.	H	α-helix	trans	-46	-42.7	-179.7	178.8	60	0	0	0	113.3	I60 E61 G123 M127 T128 L129	I60-I125 HydrophobicContact CG2-CD1 4.1Å; E61-I125 HydrophobicContact CG-CB 4.02Å; E61-I125 HydrophobicContact CG-CD1 3.57Å; E61-I125 HydrophobicContact CG-CG1 4.2Å; G123-I125 PolarHBondContact O-N 2.92Å; I125-M127 PolarHBondContact O-N 2.76Å; I125-T128 PolarHBondContact O-N 3.02Å; I125-L129 HydrophobicContact CD1-CD1 3.74Å; I125-L129 HydrophobicContact CD1-CD2 4.1Å; I125-L129 HydrophobicContact CD1-CG 3.63Å; I125-L129 HydrophobicContact CG1-CD1 3.93Å; I125-L129 HydrophobicContact CG1-CG 4.21Å; I125-L129 WeakPolarHBondContact O-CB 3.24Å; I125-L129 VanDerWaalsContact O-CG 3.31Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 2.82Å
126	K	90.1	Very high	92	Very high	109 Å²	109	30.4 Å²	30.4	47%	0.474	17%	0.165	S	C	.	.	H	α-helix	trans	-67.8	-39.9	-176.6	-65.6	-169.2	177.3	-160.1	0	112.1	E35 N124 G130	E35-K126 VanDerWaalsContact CD-CE 3.47Å; E35-K126 WeakPolarHBondContact OE1-CE 3Å; E35-K126 IonicContact OE1-NZ 3.02Å; E35-K126 PolarHBondContact OE1-NZ 3.34Å; N124-K126 PolarHBondContact O-N 3.28Å; N124-K126 VanDerWaalsContact O-N 3.09Å; N124-K126 PolarHBondContact OD1-N 3.05Å; K126-G130 PolarHBondContact O-N 3.43Å
127	M	91.4	Very high	92.1	Very high	52 Å²	52	32.7 Å²	32.7	26%	0.256	17%	0.172	S	C	.	.	H	α-helix	trans	-74.6	-35.8	177.2	-59.1	-53.2	-165.4	0	0	111.4	S114 E119 I120 N124 I125 G130 M131	S114-M127 VanDerWaalsContact O-CE 3.3Å; S114-M127 WeakPolarHBondContact O-CE 3.13Å; E119-M127 HydrophobicContact CB-CB 3.71Å; E119-M127 HydrophobicContact CB-CG 3.78Å; E119-M127 HydrophobicContact CG-CB 4.42Å; E119-M127 HydrophobicContact CG-CG 3.97Å; I120-M127 HydrophobicContact CD1-CB 4.42Å; N124-M127 HydrophobicContact CB-CB 4.28Å; N124-M127 HydrophobicContact CB-CG 4.26Å; N124-M127 WeakPolarHBondContact ND2-CG 3.41Å; N124-M127 PolarHBondContact O-N 3.3Å; I125-M127 PolarHBondContact O-N 2.76Å; M127-G130 PolarHBondContact O-N 3.44Å; M127-M131 WeakPolarHBondContact O-CB 3.16Å; M127-M131 PolarHBondContact O-N 3.23Å
128	T	92.4	Very high	91.9	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-45.7	174.2	-57.9	0	0	0	0	112.1	I60 F64 N124 I125 G130 M131 I132	I60-T128 HydrophobicContact CG1-CG2 4.44Å; I60-T128 WeakPolarHBondContact O-CG2 3.46Å; F64-T128 HydrophobicContact CD2-CG2 4.23Å; N124-T128 PolarHBondContact O-N 2.91Å; N124-T128 PolarHBondContact O-OG1 3.25Å; I125-T128 PolarHBondContact O-N 3.02Å; T128-G130 VanDerWaalsContact C-N 3.33Å; T128-G130 PolarHBondContact O-N 2.98Å; T128-M131 HydrophobicContact CG2-CE 4.49Å; T128-M131 PolarHBondContact O-N 3.06Å; T128-I132 WeakPolarHBondContact O-CG1 3.31Å; T128-I132 PolarHBondContact O-N 2.87Å
129	L	92.7	Very high	91.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-39.9	172.6	-67.6	177.8	0	0	0	111.5	Q38 F42 I60 I125 I132 W133	Q38-L129 HydrophobicContact CB-CD1 3.98Å; Q38-L129 HydrophobicContact CB-CD2 4.15Å; F42-L129 HydrophobicContact CD2-CB 4.42Å; F42-L129 HydrophobicContact CD2-CD2 3.7Å; F42-L129 HydrophobicContact CE2-CB 4.37Å; F42-L129 HydrophobicContact CE2-CD2 4.35Å; F42-L129 WeakPolarHBondContact CE2-O 3.44Å; I60-L129 HydrophobicContact CD1-CD2 4.31Å; I60-L129 HydrophobicContact CG2-CD2 4.45Å; I125-L129 HydrophobicContact CD1-CD1 3.74Å; I125-L129 HydrophobicContact CD1-CD2 4.1Å; I125-L129 HydrophobicContact CD1-CG 3.63Å; I125-L129 HydrophobicContact CG1-CD1 3.93Å; I125-L129 HydrophobicContact CG1-CG 4.21Å; I125-L129 WeakPolarHBondContact O-CB 3.24Å; I125-L129 VanDerWaalsContact O-CG 3.31Å; I125-L129 WeakPolarHBondContact O-CG 3.49Å; I125-L129 PolarHBondContact O-N 2.82Å; L129-I132 PolarHBondContact O-N 3.03Å; L129-W133 WeakPolarHBondContact O-CB 3.06Å; L129-W133 PolarHBondContact O-N 3.43Å
130	G	91.3	Very high	91.5	Very high	16 Å²	16	30.3 Å²	30.3	17%	0.165	16%	0.158	C	C	.	.	H	α-helix	trans	-57.9	-47.8	173.3	0	0	0	0	0	112.8	K126 M127 T128 W133 T134	K126-G130 PolarHBondContact O-N 3.43Å; M127-G130 PolarHBondContact O-N 3.44Å; T128-G130 VanDerWaalsContact C-N 3.33Å; T128-G130 PolarHBondContact O-N 2.98Å; G130-W133 PolarHBondContact O-N 3.44Å; G130-T134 WeakPolarHBondContact O-CG2 3.33Å; G130-T134 PolarHBondContact O-N 3.16Å
131	M	93	Very high	91.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.9	-53.3	175.9	-176.7	-171.8	65.3	0	0	111.3	L70 L102 I115 I120 M127 T128 W133 T134 I135	L70-M131 HydrophobicContact CD1-CE 3.66Å; L70-M131 HydrophobicContact CD1-SD 4.19Å; L70-M131 HydrophobicContact CD2-CE 3.76Å; L70-M131 HydrophobicContact CD2-SD 3.6Å; L70-M131 HydrophobicContact CG-CE 4.35Å; L102-M131 HydrophobicContact CD2-CG 4.22Å; L102-M131 HydrophobicContact CD2-SD 3.77Å; I115-M131 HydrophobicContact CD1-CB 4.44Å; I115-M131 HydrophobicContact CG2-CB 4.19Å; I120-M131 HydrophobicContact CD1-CB 4.05Å; I120-M131 HydrophobicContact CD1-CE 4.1Å; I120-M131 HydrophobicContact CD1-SD 3.78Å; I120-M131 HydrophobicContact CG1-SD 3.92Å; I120-M131 HydrophobicContact CG2-CE 4.19Å; I120-M131 HydrophobicContact CG2-SD 4.39Å; M127-M131 WeakPolarHBondContact O-CB 3.16Å; M127-M131 PolarHBondContact O-N 3.23Å; T128-M131 HydrophobicContact CG2-CE 4.49Å; T128-M131 PolarHBondContact O-N 3.06Å; M131-W133 VanDerWaalsContact C-N 3.27Å; M131-W133 PolarHBondContact O-N 3.24Å; M131-T134 PolarHBondContact O-N 2.7Å; M131-T134 PolarHBondContact O-OG1 3.24Å; M131-I135 HydrophobicContact CG-CD1 4.38Å; M131-I135 WeakPolarHBondContact O-CG1 3.41Å; M131-I135 PolarHBondContact O-N 3.42Å; M131-I135 VanDerWaalsContact O-N 3.12Å
132	I	94	Very high	90.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-37.5	-179.1	-61.2	-60.6	0	0	0	111.2	F42 W45 I60 F64 L70 L73 T128 L129 T134 I135 I136	F42-I132 HydrophobicContact CB-CG2 3.85Å; F42-I132 HydrophobicContact CD2-CB 4.16Å; F42-I132 HydrophobicContact CD2-CG2 4Å; F42-I132 HydrophobicContact CG-CG2 3.99Å; W45-I132 HydrophobicContact CE3-CG2 4.11Å; W45-I132 HydrophobicContact CZ3-CG2 4.02Å; I60-I132 HydrophobicContact CD1-CG1 4.3Å; F64-I132 HydrophobicContact CD2-CD1 4.12Å; F64-I132 HydrophobicContact CD2-CG1 4.48Å; F64-I132 HydrophobicContact CE2-CD1 3.56Å; F64-I132 HydrophobicContact CE2-CG1 4.05Å; F64-I132 HydrophobicContact CZ-CD1 3.95Å; L70-I132 HydrophobicContact CD1-CD1 4.32Å; L73-I132 HydrophobicContact CD2-CD1 4.29Å; T128-I132 WeakPolarHBondContact O-CG1 3.31Å; T128-I132 PolarHBondContact O-N 2.87Å; L129-I132 PolarHBondContact O-N 3.03Å; I132-T134 PolarHBondContact O-N 3.13Å; I132-I135 HydrophobicContact CD1-CD1 4.16Å; I132-I135 PolarHBondContact O-N 3.36Å; I132-I136 HydrophobicContact CG2-CD1 3.86Å; I132-I136 HydrophobicContact CG2-CG1 4.38Å; I132-I136 WeakPolarHBondContact O-CG1 3.45Å; I132-I136 PolarHBondContact O-N 3.38Å
133	W	93.3	Very high	90.2	Very high	30 Å²	30	34.8 Å²	34.8	11%	0.114	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-43.6	171.6	174.2	-112.5	0	0	0	113	F42 L129 G130 M131 I135 I136 L137 I141 R241 M244	F42-W133 HydrophobicContact CE1-CE3 4.31Å; F42-W133 HydrophobicContact CE2-CB 4Å; F42-W133 HydrophobicContact CZ-CB 4.03Å; F42-W133 AromaticContact CZ-CE3 3.96Å; F42-W133 HydrophobicContact CZ-CE3 3.96Å; L129-W133 WeakPolarHBondContact O-CB 3.06Å; L129-W133 PolarHBondContact O-N 3.43Å; G130-W133 PolarHBondContact O-N 3.44Å; M131-W133 VanDerWaalsContact C-N 3.27Å; M131-W133 PolarHBondContact O-N 3.24Å; W133-I135 VanDerWaalsContact C-N 3.28Å; W133-I135 PolarHBondContact O-N 2.93Å; W133-I136 HydrophobicContact CE3-CB 4.4Å; W133-I136 HydrophobicContact CE3-CG2 4.32Å; W133-I136 HydrophobicContact CZ3-CG2 4.21Å; W133-I136 PolarHBondContact O-N 2.62Å; W133-L137 HydrophobicContact CZ2-CD1 4.31Å; W133-L137 VanDerWaalsContact O-CB 3.31Å; W133-L137 WeakPolarHBondContact O-CB 3.27Å; W133-L137 PolarHBondContact O-N 2.68Å; W133-I141 HydrophobicContact CH2-CD1 4.12Å; W133-I141 HydrophobicContact CZ3-CD1 4.3Å; W133-R241 HydrophobicContact CD2-CB 4.03Å; W133-R241 HydrophobicContact CD2-CG 3.78Å; W133-R241 HydrophobicContact CE3-CB 3.61Å; W133-R241 HydrophobicContact CE3-CG 3.89Å; W133-R241 HydrophobicContact CG-CG 4.43Å; W133-R241 HydrophobicContact CH2-CB 4.02Å; W133-R241 HydrophobicContact CH2-CG 3.95Å; W133-R241 HydrophobicContact CZ2-CB 4.42Å; W133-R241 HydrophobicContact CZ2-CG 3.87Å; W133-R241 HydrophobicContact CZ3-CB 3.6Å; W133-R241 HydrophobicContact CZ3-CG 3.97Å; W133-R241 WeakPolarHBondContact CZ3-O 3.4Å; W133-M244 HydrophobicContact CH2-CB 4.13Å; W133-M244 HydrophobicContact CH2-CE 4.14Å; W133-M244 HydrophobicContact CH2-SD 4.03Å; W133-M244 HydrophobicContact CZ3-CB 4.45Å
134	T	90.9	Very high	89.6	Confident	25 Å²	25	33.6 Å²	33.6	15%	0.153	17%	0.166	C	C	.	.	H	α-helix	trans	-63.1	-34.2	177.1	61.8	0	0	0	0	112.8	V110 I115 G130 M131 I132 R138	V110-T134 HydrophobicContact CG1-CG2 4.36Å; I115-T134 HydrophobicContact CD1-CG2 4.5Å; G130-T134 WeakPolarHBondContact O-CG2 3.33Å; G130-T134 PolarHBondContact O-N 3.16Å; M131-T134 PolarHBondContact O-N 2.7Å; M131-T134 PolarHBondContact O-OG1 3.24Å; I132-T134 PolarHBondContact O-N 3.13Å; T134-R138 WeakPolarHBondContact O-CB 3.33Å; T134-R138 PolarHBondContact O-N 2.95Å
135	I	92	Very high	88.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-48.8	174.7	-58.7	170.7	0	0	0	110.3	W45 L70 L74 L77 I105 M131 I132 W133 L137 R138 F139	W45-I135 HydrophobicContact CH2-CG2 3.94Å; L70-I135 HydrophobicContact CD1-CD1 3.89Å; L74-I135 HydrophobicContact CD2-CD1 4.1Å; L74-I135 HydrophobicContact CD2-CG1 4.33Å; L74-I135 HydrophobicContact CD2-CG2 4.1Å; L77-I135 HydrophobicContact CD1-CG2 3.56Å; I105-I135 HydrophobicContact CD1-CD1 3.71Å; I105-I135 HydrophobicContact CD1-CG1 3.72Å; I105-I135 HydrophobicContact CG1-CG1 4.2Å; M131-I135 HydrophobicContact CG-CD1 4.38Å; M131-I135 WeakPolarHBondContact O-CG1 3.41Å; M131-I135 PolarHBondContact O-N 3.42Å; M131-I135 VanDerWaalsContact O-N 3.12Å; I132-I135 HydrophobicContact CD1-CD1 4.16Å; I132-I135 PolarHBondContact O-N 3.36Å; W133-I135 VanDerWaalsContact C-N 3.28Å; W133-I135 PolarHBondContact O-N 2.93Å; I135-L137 VanDerWaalsContact C-N 3.34Å; I135-L137 PolarHBondContact O-N 2.86Å; I135-R138 PolarHBondContact O-N 3.43Å; I135-F139 HydrophobicContact CG2-CD2 3.71Å; I135-F139 HydrophobicContact CG2-CE2 4.19Å; I135-F139 WeakPolarHBondContact O-CD2 3.34Å; I135-F139 PolarHBondContact O-N 3.45Å
136	I	92.9	Very high	87.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.6	-48.9	176.4	-68.5	163.6	0	0	0	110.6	F42 W45 I132 W133 R138 C140 I141 T245	F42-I136 HydrophobicContact CD1-CD1 3.48Å; F42-I136 VanDerWaalsContact CD1-CD1 3.48Å; F42-I136 HydrophobicContact CE1-CD1 3.63Å; F42-I136 HydrophobicContact CG-CD1 4.02Å; F42-I136 HydrophobicContact CZ-CD1 4.26Å; W45-I136 HydrophobicContact CD2-CD1 3.93Å; W45-I136 HydrophobicContact CD2-CG1 3.61Å; W45-I136 HydrophobicContact CE3-CD1 3.85Å; W45-I136 HydrophobicContact CE3-CG1 3.61Å; W45-I136 HydrophobicContact CG-CD1 4.33Å; W45-I136 HydrophobicContact CG-CG1 4.35Å; W45-I136 HydrophobicContact CH2-CG1 3.65Å; W45-I136 HydrophobicContact CZ2-CB 4.45Å; W45-I136 HydrophobicContact CZ2-CG1 3.64Å; W45-I136 HydrophobicContact CZ3-CD1 4.25Å; W45-I136 HydrophobicContact CZ3-CG1 3.63Å; I132-I136 HydrophobicContact CG2-CD1 3.86Å; I132-I136 HydrophobicContact CG2-CG1 4.38Å; I132-I136 WeakPolarHBondContact O-CG1 3.45Å; I132-I136 PolarHBondContact O-N 3.38Å; W133-I136 HydrophobicContact CE3-CB 4.4Å; W133-I136 HydrophobicContact CE3-CG2 4.32Å; W133-I136 HydrophobicContact CZ3-CG2 4.21Å; W133-I136 PolarHBondContact O-N 2.62Å; I136-R138 VanDerWaalsContact C-N 3.32Å; I136-R138 PolarHBondContact O-N 3.45Å; I136-C140 WeakPolarHBondContact O-CA 3.19Å; I136-C140 WeakPolarHBondContact O-CB 3.38Å; I136-C140 PolarHBondContact O-N 2.92Å; I136-I141 HydrophobicContact CG2-CD1 4.13Å; I136-I141 PolarHBondContact O-N 2.99Å; I136-T245 HydrophobicContact CD1-CG2 3.94Å; I136-T245 HydrophobicContact CG1-CG2 4.45Å; I136-T245 HydrophobicContact CG2-CG2 4.05Å
137	L	90.8	Very high	86	Confident	65 Å²	65	36.2 Å²	36.2	34%	0.34	19%	0.187	S	C	.	.	I	π-helix	trans	-57.8	-46.7	179.7	-177.4	63.1	0	0	0	110.5	W133 I135 I141 Q142	W133-L137 HydrophobicContact CZ2-CD1 4.31Å; W133-L137 VanDerWaalsContact O-CB 3.31Å; W133-L137 WeakPolarHBondContact O-CB 3.27Å; W133-L137 PolarHBondContact O-N 2.68Å; I135-L137 VanDerWaalsContact C-N 3.34Å; I135-L137 PolarHBondContact O-N 2.86Å; L137-I141 HydrophobicContact CD1-CB 4.25Å; L137-I141 HydrophobicContact CD1-CG2 4.23Å; L137-I141 PolarHBondContact O-N 3.38Å; L137-Q142 WeakPolarHBondContact O-CB 3.36Å; L137-Q142 PolarHBondContact O-N 3.24Å
138	R	88.6	Confident	84.9	Confident	60 Å²	60	43.3 Å²	43.3	23%	0.226	22%	0.219	C	C	.	.	I	π-helix	trans	-70.4	-50.9	-177.6	-176	58.5	176.9	125.7	-6.6	113.8	K108 V110 T134 I135 I136 D143	K108-R138 VanDerWaalsContact O-CZ 3.31Å; K108-R138 PolarHBondContact O-NE 2.82Å; K108-R138 PolarHBondContact O-NH2 2.72Å; V110-R138 HydrophobicContact CG2-CB 3.64Å; V110-R138 HydrophobicContact CG2-CG 3.53Å; T134-R138 WeakPolarHBondContact O-CB 3.33Å; T134-R138 PolarHBondContact O-N 2.95Å; I135-R138 PolarHBondContact O-N 3.43Å; I136-R138 VanDerWaalsContact C-N 3.32Å; I136-R138 PolarHBondContact O-N 3.45Å; R138-D143 IonicContact NH1-OD1 2.75Å
139	F	88.7	Confident	84	Confident	44 Å²	44	47 Å²	47	19%	0.193	24%	0.237	C	C	.	.	I	π-helix	trans	-93.4	-16	-168.2	-70.9	-85.7	0	0	0	114.2	L74 L77 Y104 K108 I135	L74-F139 HydrophobicContact CD2-CE2 4.11Å; L74-F139 HydrophobicContact CD2-CZ 4.49Å; L77-F139 HydrophobicContact CB-CD1 4.31Å; L77-F139 HydrophobicContact CB-CG 4.37Å; Y104-F139 HydrophobicContact CE1-CZ 4.18Å; K108-F139 HydrophobicContact CB-CZ 4.4Å; K108-F139 HydrophobicContact CG-CZ 4.02Å; I135-F139 HydrophobicContact CG2-CD2 3.71Å; I135-F139 HydrophobicContact CG2-CE2 4.19Å; I135-F139 WeakPolarHBondContact O-CD2 3.34Å; I135-F139 PolarHBondContact O-N 3.45Å
140	C	88	Confident	83.4	Confident	4 Å²	4	50 Å²	50	3%	0.027	26%	0.258	C	S	.	.	I	π-helix	trans	-118.6	-28	179.8	-61.2	0	0	0	0	113.8	I136 H252	I136-C140 WeakPolarHBondContact O-CA 3.19Å; I136-C140 WeakPolarHBondContact O-CB 3.38Å; I136-C140 PolarHBondContact O-N 2.92Å; C140-H252 PolarHBondContact O-NE2 3.16Å
141	I	86.5	Confident	83	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	I	π-helix	trans	-108.3	-46	-172.8	-58.4	179.6	0	0	0	111.4	W133 I136 L137 D143 I144 A151 M244	W133-I141 HydrophobicContact CH2-CD1 4.12Å; W133-I141 HydrophobicContact CZ3-CD1 4.3Å; I136-I141 HydrophobicContact CG2-CD1 4.13Å; I136-I141 PolarHBondContact O-N 2.99Å; L137-I141 HydrophobicContact CD1-CB 4.25Å; L137-I141 HydrophobicContact CD1-CG2 4.23Å; L137-I141 PolarHBondContact O-N 3.38Å; I141-D143 VanDerWaalsContact C-N 3.27Å; I141-D143 PolarHBondContact O-N 3.45Å; I141-D143 VanDerWaalsContact O-N 3.12Å; I141-I144 VanDerWaalsContact O-CB 3.22Å; I141-I144 WeakPolarHBondContact O-CB 3.49Å; I141-I144 VanDerWaalsContact O-CG1 3.28Å; I141-I144 WeakPolarHBondContact O-CG1 3.08Å; I141-I144 PolarHBondContact O-N 2.95Å; I141-A151 HydrophobicContact CG2-CB 4.15Å; I141-A151 VanDerWaalsContact O-CB 3.27Å; I141-A151 WeakPolarHBondContact O-CB 3.4Å; I141-M244 HydrophobicContact CD1-CB 4.13Å; I141-M244 HydrophobicContact CD1-CE 4.03Å; I141-M244 HydrophobicContact CG2-CE 4.26Å
142	Q	84.5	Confident	82.7	Confident	95 Å²	95	54.4 Å²	54.4	44%	0.444	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.5	-167.8	-170.4	168.2	-4.6	0	0	115.1	L137 I144	L137-Q142 WeakPolarHBondContact O-CB 3.36Å; L137-Q142 PolarHBondContact O-N 3.24Å; Q142-I144 VanDerWaalsContact C-N 3.27Å; Q142-I144 PolarHBondContact O-N 3.16Å
143	D	79.3	Confident	82.4	Confident	115 Å²	115	58.9 Å²	58.9	62%	0.615	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	4.2	179.3	-61.4	-19.6	0	0	0	113.2	R138 I141 T145	R138-D143 IonicContact NH1-OD1 2.75Å; I141-D143 VanDerWaalsContact C-N 3.27Å; I141-D143 PolarHBondContact O-N 3.45Å; I141-D143 VanDerWaalsContact O-N 3.12Å; D143-T145 PolarHBondContact O-N 2.95Å; D143-T145 VanDerWaalsContact O-N 3.09Å
144	I	78.1	Confident	82	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	29%	0.292	C	S	.	.			trans	-76.9	92.2	173.4	-61	179.5	0	0	0	109.2	I141 Q142 V146 L155 Y251	I141-I144 VanDerWaalsContact O-CB 3.22Å; I141-I144 WeakPolarHBondContact O-CB 3.49Å; I141-I144 VanDerWaalsContact O-CG1 3.28Å; I141-I144 WeakPolarHBondContact O-CG1 3.08Å; I141-I144 PolarHBondContact O-N 2.95Å; Q142-I144 VanDerWaalsContact C-N 3.27Å; Q142-I144 PolarHBondContact O-N 3.16Å; I144-V146 HydrophobicContact CG2-CG2 4.14Å; I144-L155 HydrophobicContact CD1-CB 4.5Å; I144-L155 HydrophobicContact CD1-CD1 4.08Å; I144-L155 HydrophobicContact CD1-CD2 4.3Å; I144-L155 HydrophobicContact CG2-CB 4.29Å; I144-Y251 HydrophobicContact CB-CE1 4.25Å; I144-Y251 HydrophobicContact CD1-CD1 3.62Å; I144-Y251 HydrophobicContact CD1-CE1 4.1Å; I144-Y251 HydrophobicContact CD1-CG 3.96Å; I144-Y251 HydrophobicContact CG1-CD1 3.77Å; I144-Y251 HydrophobicContact CG1-CE1 3.72Å; I144-Y251 HydrophobicContact CG1-CG 4.48Å; I144-Y251 HydrophobicContact CG2-CD1 4.27Å; I144-Y251 HydrophobicContact CG2-CD2 4.24Å; I144-Y251 HydrophobicContact CG2-CE1 3.85Å; I144-Y251 HydrophobicContact CG2-CE2 3.83Å; I144-Y251 HydrophobicContact CG2-CG 4.46Å
145	T	69.1	Low	82.1	Confident	113 Å²	113	56.3 Å²	56.3	69%	0.693	28%	0.284	S	S	*	.			trans	-95.3	115	174.3	52.3	0	0	0	0	111.1	D143	D143-T145 PolarHBondContact O-N 2.95Å; D143-T145 VanDerWaalsContact O-N 3.09Å
146	V	64.9	Low	82.1	Confident	22 Å²	22	57.7 Å²	57.7	13%	0.133	29%	0.292	C	S	.	.	S	Bend	trans	-132.9	114.7	174.2	-178.3	0	0	0	0	107.1	I144 E148 M149 L157 W158 Y251	I144-V146 HydrophobicContact CG2-CG2 4.14Å; V146-E148 VanDerWaalsContact C-N 3.32Å; V146-E148 PolarHBondContact O-N 3.06Å; V146-M149 WeakPolarHBondContact O-CB 3.32Å; V146-M149 WeakPolarHBondContact O-CG 3.43Å; V146-M149 PolarHBondContact O-N 3.22Å; V146-L157 HydrophobicContact CG1-CD2 4.22Å; V146-W158 HydrophobicContact CG2-CB 4.38Å; V146-Y251 HydrophobicContact CG2-CE2 4.24Å
147	E	63.9	Low	81.9	Confident	115 Å²	115	59 Å²	59	54%	0.537	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	43.6	179.3	-58	-165.7	155.4	0	0	114.8	M149 L157 R161	E147-M149 PolarHBondContact O-N 3.45Å; E147-L157 HydrophobicContact CB-CD2 4.38Å; E147-L157 HydrophobicContact CG-CD2 4.49Å; E147-R161 VanDerWaalsContact CD-CZ 3.46Å; E147-R161 VanDerWaalsContact CD-NH1 3.28Å; E147-R161 IonicContact OE1-CZ 3.39Å; E147-R161 IonicContact OE1-NH1 3.77Å; E147-R161 PolarHBondContact OE1-NH1 2.82Å; E147-R161 IonicContact OE1-NH2 3.16Å; E147-R161 PolarHBondContact OE1-NH2 2.79Å; E147-R161 IonicContact OE2-CZ 2.78Å; E147-R161 VanDerWaalsContact OE2-CZ 3.29Å; E147-R161 IonicContact OE2-NH1 2.8Å; E147-R161 IonicContact OE2-NH2 2.76Å; E147-R161 PolarHBondContact OE2-NH2 2.66Å
148	E	69	Low	81.9	Confident	202 Å²	202	56.8 Å²	56.8	94%	0.944	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	7.5	177.1	-54.2	-175.7	167.4	0	0	115.2	V146	V146-E148 VanDerWaalsContact C-N 3.32Å; V146-E148 PolarHBondContact O-N 3.06Å
149	M	72.2	Confident	82.1	Confident	78 Å²	78	53.9 Å²	53.9	38%	0.384	28%	0.275	S	S	.	.			trans	-72.4	165.2	177.5	-56	-164.4	81.7	0	0	112.5	V146 E147 E153 L157	V146-M149 WeakPolarHBondContact O-CB 3.32Å; V146-M149 WeakPolarHBondContact O-CG 3.43Å; V146-M149 PolarHBondContact O-N 3.22Å; E147-M149 PolarHBondContact O-N 3.45Å; M149-E153 HydrophobicContact CB-CB 4.05Å; M149-E153 HydrophobicContact CE-CB 3.74Å; M149-E153 HydrophobicContact CE-CG 4.4Å; M149-E153 HydrophobicContact SD-CB 4.21Å; M149-L157 HydrophobicContact SD-CB 4.27Å; M149-L157 HydrophobicContact SD-CD2 3.58Å; M149-L157 VanDerWaalsContact SD-CD2 3.58Å
150	S	80.9	Confident	82.3	Confident	63 Å²	63	55.2 Å²	55.2	44%	0.441	28%	0.282	S	S	.	.			trans	-63	151.7	168.7	77.9	0	0	0	0	110.7	K152 E153 G154	S150-K152 VanDerWaalsContact C-N 3.31Å; S150-K152 PolarHBondContact O-N 3.38Å; S150-K152 VanDerWaalsContact O-N 3.15Å; S150-E153 VanDerWaalsContact CB-OE2 3.26Å; S150-E153 WeakPolarHBondContact CB-OE2 3.49Å; S150-E153 PolarHBondContact N-OE2 3.19Å; S150-E153 CarbonylContact O-C 3.5Å; S150-E153 PolarHBondContact O-N 2.87Å; S150-E153 WeakPolarHBondContact OG-CG 3.13Å; S150-E153 PolarHBondContact OG-OE2 3.45Å; S150-G154 PolarHBondContact O-N 2.85Å
151	A	81.9	Confident	82.3	Confident	17 Å²	17	61.4 Å²	61.4	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-53.8	-39.2	-173.2	0	0	0	0	0	115.7	I141 L155	I141-A151 HydrophobicContact CG2-CB 4.15Å; I141-A151 VanDerWaalsContact O-CB 3.27Å; I141-A151 WeakPolarHBondContact O-CB 3.4Å; A151-L155 WeakPolarHBondContact O-CB 3.39Å; A151-L155 PolarHBondContact O-N 2.86Å
152	K	87.2	Confident	82.5	Confident	92 Å²	92	63.6 Å²	63.6	40%	0.4	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-45.2	176.1	171.8	173.2	161.7	168.6	0	111	S150 L156 F174 E240 M244	S150-K152 VanDerWaalsContact C-N 3.31Å; S150-K152 PolarHBondContact O-N 3.38Å; S150-K152 VanDerWaalsContact O-N 3.15Å; K152-L156 WeakPolarHBondContact O-CB 3.42Å; K152-L156 PolarHBondContact O-N 3.23Å; K152-F174 HydrophobicContact CG-CE2 4.09Å; K152-E240 WeakPolarHBondContact CE-OE1 3.47Å; K152-E240 IonicContact NZ-OE1 3.03Å; K152-E240 PolarHBondContact NZ-OE1 2.94Å; K152-E240 IonicContact NZ-OE2 3.99Å; K152-E240 PolarHBondContact NZ-OE2 3.48Å; K152-M244 HydrophobicContact CB-CE 3.97Å; K152-M244 HydrophobicContact CD-CE 4.09Å; K152-M244 HydrophobicContact CD-SD 4.18Å; K152-M244 HydrophobicContact CG-CE 3.81Å; K152-M244 HydrophobicContact CG-SD 4.35Å
153	E	87.2	Confident	82.8	Confident	95 Å²	95	59.2 Å²	59.2	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-69.4	-40.8	179.4	-64.1	166.7	137.8	0	0	111.4	M149 S150 L156 L157	M149-E153 HydrophobicContact CB-CB 4.05Å; M149-E153 HydrophobicContact CE-CB 3.74Å; M149-E153 HydrophobicContact CE-CG 4.4Å; M149-E153 HydrophobicContact SD-CB 4.21Å; S150-E153 VanDerWaalsContact CB-OE2 3.26Å; S150-E153 WeakPolarHBondContact CB-OE2 3.49Å; S150-E153 PolarHBondContact N-OE2 3.19Å; S150-E153 CarbonylContact O-C 3.5Å; S150-E153 PolarHBondContact O-N 2.87Å; S150-E153 WeakPolarHBondContact OG-CG 3.13Å; S150-E153 PolarHBondContact OG-OE2 3.45Å; E153-L156 PolarHBondContact O-N 2.8Å; E153-L157 VanDerWaalsContact O-CB 3.29Å; E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 PolarHBondContact O-N 3.37Å
154	G	86.5	Confident	83.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.6	-42.3	176.2	0	0	0	0	0	112.7	S150 W158	S150-G154 PolarHBondContact O-N 2.85Å; G154-W158 WeakPolarHBondContact O-CB 3.21Å; G154-W158 PolarHBondContact O-N 2.91Å
155	L	91.2	Very high	83.8	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-40.4	172.4	-177.6	58.4	0	0	0	111.8	I144 A151 W158 C159 F174 V247 Y251	I144-L155 HydrophobicContact CD1-CB 4.5Å; I144-L155 HydrophobicContact CD1-CD1 4.08Å; I144-L155 HydrophobicContact CD1-CD2 4.3Å; I144-L155 HydrophobicContact CG2-CB 4.29Å; A151-L155 WeakPolarHBondContact O-CB 3.39Å; A151-L155 PolarHBondContact O-N 2.86Å; L155-W158 HydrophobicContact CD1-CE3 4.14Å; L155-W158 HydrophobicContact CD1-CZ3 4.48Å; L155-W158 PolarHBondContact O-N 3.35Å; L155-C159 PolarHBondContact O-N 3.32Å; L155-C159 PolarHBondContact O-SG 2.9Å; L155-F174 HydrophobicContact CB-CZ 4.14Å; L155-F174 HydrophobicContact CD2-CE1 4.26Å; L155-F174 HydrophobicContact CD2-CZ 4.07Å; L155-F174 HydrophobicContact CG-CE1 4.15Å; L155-F174 HydrophobicContact CG-CZ 3.83Å; L155-V247 HydrophobicContact CD1-CG1 4.21Å; L155-V247 HydrophobicContact CG-CG1 4.39Å; L155-Y251 HydrophobicContact CD1-CD2 4Å; L155-Y251 HydrophobicContact CD1-CG 4.02Å
156	L	92.6	Very high	84.9	Confident	30 Å²	30	56.9 Å²	56.9	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-45.8	177.9	-176.2	63	0	0	0	111.6	K152 E153 W158 C159 Q160 V171 F174	K152-L156 WeakPolarHBondContact O-CB 3.42Å; K152-L156 PolarHBondContact O-N 3.23Å; E153-L156 PolarHBondContact O-N 2.8Å; L156-W158 VanDerWaalsContact C-N 3.33Å; L156-W158 PolarHBondContact O-N 2.91Å; L156-C159 WeakPolarHBondContact O-CB 3.39Å; L156-C159 PolarHBondContact O-N 3.44Å; L156-Q160 WeakPolarHBondContact O-CG 3.22Å; L156-Q160 PolarHBondContact O-N 3.44Å; L156-V171 HydrophobicContact CD1-CG1 3.82Å; L156-F174 HydrophobicContact CB-CE2 3.84Å; L156-F174 HydrophobicContact CB-CZ 3.81Å; L156-F174 HydrophobicContact CD1-CE1 4.5Å; L156-F174 HydrophobicContact CD1-CE2 4.13Å; L156-F174 HydrophobicContact CD1-CZ 4.12Å; L156-F174 HydrophobicContact CG-CE2 4.47Å
157	L	88.8	Confident	86.1	Confident	28 Å²	28	66.1 Å²	66.1	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-40.4	176.2	177.5	62.5	0	0	0	111.4	V146 E147 M149 E153 Q160 R161	V146-L157 HydrophobicContact CG1-CD2 4.22Å; E147-L157 HydrophobicContact CB-CD2 4.38Å; E147-L157 HydrophobicContact CG-CD2 4.49Å; M149-L157 HydrophobicContact SD-CB 4.27Å; M149-L157 HydrophobicContact SD-CD2 3.58Å; M149-L157 VanDerWaalsContact SD-CD2 3.58Å; E153-L157 VanDerWaalsContact O-CB 3.29Å; E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 PolarHBondContact O-N 3.37Å; L157-Q160 PolarHBondContact O-N 3.36Å; L157-R161 HydrophobicContact CD1-CG 4.15Å; L157-R161 WeakPolarHBondContact O-CB 3.3Å; L157-R161 WeakPolarHBondContact O-CG 3.5Å; L157-R161 PolarHBondContact O-N 3.36Å
158	W	90.5	Very high	87.4	Confident	17 Å²	17	64 Å²	64	6%	0.064	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-46	173.2	175.3	93.8	0	0	0	111.3	V146 G154 L155 L156 Q160 R161 K162 L187 H191 Y251 F254	V146-W158 HydrophobicContact CG2-CB 4.38Å; G154-W158 WeakPolarHBondContact O-CB 3.21Å; G154-W158 PolarHBondContact O-N 2.91Å; L155-W158 HydrophobicContact CD1-CE3 4.14Å; L155-W158 HydrophobicContact CD1-CZ3 4.48Å; L155-W158 PolarHBondContact O-N 3.35Å; L156-W158 VanDerWaalsContact C-N 3.33Å; L156-W158 PolarHBondContact O-N 2.91Å; W158-Q160 PolarHBondContact O-N 3.37Å; W158-R161 PolarHBondContact O-N 3.31Å; W158-K162 HydrophobicContact CD2-CG 4.21Å; W158-K162 HydrophobicContact CG-CG 4.42Å; W158-K162 HydrophobicContact CZ2-CG 4.45Å; W158-K162 WeakPolarHBondContact O-CB 3.41Å; W158-K162 WeakPolarHBondContact O-CG 3.18Å; W158-K162 PolarHBondContact O-N 2.75Å; W158-L187 HydrophobicContact CE3-CD1 4.28Å; W158-L187 HydrophobicContact CH2-CD1 3.65Å; W158-L187 HydrophobicContact CH2-CD2 3.86Å; W158-L187 HydrophobicContact CH2-CG 4.04Å; W158-L187 HydrophobicContact CZ2-CD1 4.3Å; W158-L187 HydrophobicContact CZ3-CD1 3.65Å; W158-L187 HydrophobicContact CZ3-CD2 3.72Å; W158-L187 HydrophobicContact CZ3-CG 4.19Å; W158-H191 AromaticContact CZ2-CE1 3.65Å; W158-Y251 HydrophobicContact CB-CD2 4.41Å; W158-Y251 HydrophobicContact CB-CE2 4.36Å; W158-Y251 AromaticContact CD1-CD2 3.94Å; W158-Y251 AromaticContact CD1-CE2 3.7Å; W158-Y251 AromaticContact CD2-CD2 3.53Å; W158-Y251 HydrophobicContact CD2-CD2 3.53Å; W158-Y251 HydrophobicContact CD2-CE2 4.09Å; W158-Y251 AromaticContact CE2-CD2 3.62Å; W158-Y251 AromaticContact CE3-CD2 3.86Å; W158-Y251 HydrophobicContact CE3-CD2 3.86Å; W158-Y251 AromaticContact CG-CD2 3.76Å; W158-Y251 HydrophobicContact CG-CD2 3.76Å; W158-Y251 AromaticContact CG-CE2 3.84Å; W158-Y251 HydrophobicContact CG-CE2 3.84Å; W158-Y251 HydrophobicContact CH2-CD2 4.37Å; W158-Y251 HydrophobicContact CZ2-CD2 4.09Å; W158-Y251 HydrophobicContact CZ3-CD2 4.25Å; W158-Y251 AromaticContact NE1-CD2 3.84Å; W158-Y251 AromaticContact NE1-CE2 3.86Å; W158-F254 HydrophobicContact CH2-CD2 4.08Å; W158-F254 HydrophobicContact CZ2-CB 4.18Å; W158-F254 HydrophobicContact CZ2-CD2 4.23Å
159	C	92.9	Very high	88.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.4	-52.6	174.9	-64.6	0	0	0	0	110.8	L155 L156 R161 K162 T163 V171 W178 V247	L155-C159 PolarHBondContact O-N 3.32Å; L155-C159 PolarHBondContact O-SG 2.9Å; L156-C159 WeakPolarHBondContact O-CB 3.39Å; L156-C159 PolarHBondContact O-N 3.44Å; C159-R161 PolarHBondContact O-N 3.18Å; C159-K162 PolarHBondContact O-N 3.45Å; C159-T163 WeakPolarHBondContact O-CG2 3.3Å; C159-T163 PolarHBondContact O-N 3.12Å; C159-T163 PolarHBondContact O-OG1 3.03Å; C159-V171 HydrophobicContact CB-CG1 4.07Å; C159-W178 HydrophobicContact CB-CH2 4.13Å; C159-W178 HydrophobicContact CB-CZ2 3.98Å; C159-V247 WeakPolarHBondContact SG-CG1 3.45Å
160	Q	92.5	Very high	89.6	Confident	71 Å²	71	56.6 Å²	56.6	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-53.1	-49.7	177.7	-75.8	170.6	-6.9	0	0	112.4	L156 L157 W158 K162 T163 A164 V171	L156-Q160 WeakPolarHBondContact O-CG 3.22Å; L156-Q160 PolarHBondContact O-N 3.44Å; L157-Q160 PolarHBondContact O-N 3.36Å; W158-Q160 PolarHBondContact O-N 3.37Å; Q160-K162 PolarHBondContact O-N 3.14Å; Q160-T163 PolarHBondContact O-N 3.39Å; Q160-T163 PolarHBondContact O-OG1 3.38Å; Q160-A164 WeakPolarHBondContact O-CA 3.25Å; Q160-A164 VanDerWaalsContact O-CB 3.27Å; Q160-A164 WeakPolarHBondContact O-CB 3.2Å; Q160-A164 PolarHBondContact O-N 3.33Å; Q160-V171 HydrophobicContact CG-CB 4.25Å; Q160-V171 WeakPolarHBondContact CG-O 3.25Å; Q160-V171 PolarHBondContact NE2-O 2.96Å
161	R	88.3	Confident	90.2	Very high	135 Å²	135	53.7 Å²	53.7	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-36.7	-179.6	-75.5	-179.3	170.1	-159.5	-0.3	113.2	E147 L157 W158 C159	E147-R161 VanDerWaalsContact CD-CZ 3.46Å; E147-R161 VanDerWaalsContact CD-NH1 3.28Å; E147-R161 IonicContact OE1-CZ 3.39Å; E147-R161 IonicContact OE1-NH1 3.77Å; E147-R161 PolarHBondContact OE1-NH1 2.82Å; E147-R161 IonicContact OE1-NH2 3.16Å; E147-R161 PolarHBondContact OE1-NH2 2.79Å; E147-R161 IonicContact OE2-CZ 2.78Å; E147-R161 VanDerWaalsContact OE2-CZ 3.29Å; E147-R161 IonicContact OE2-NH1 2.8Å; E147-R161 IonicContact OE2-NH2 2.76Å; E147-R161 PolarHBondContact OE2-NH2 2.66Å; L157-R161 HydrophobicContact CD1-CG 4.15Å; L157-R161 WeakPolarHBondContact O-CB 3.3Å; L157-R161 WeakPolarHBondContact O-CG 3.5Å; L157-R161 PolarHBondContact O-N 3.36Å; W158-R161 PolarHBondContact O-N 3.31Å; C159-R161 PolarHBondContact O-N 3.18Å
162	K	90.6	Very high	90.8	Very high	46 Å²	46	58.3 Å²	58.3	20%	0.2	29%	0.288	C	S	.	.	H	α-helix	trans	-75.4	-31.9	178.1	-62.4	-68.9	-176.5	153.5	0	111.5	W158 C159 Q160 L187 R190 H191	W158-K162 HydrophobicContact CD2-CG 4.21Å; W158-K162 HydrophobicContact CG-CG 4.42Å; W158-K162 HydrophobicContact CZ2-CG 4.45Å; W158-K162 WeakPolarHBondContact O-CB 3.41Å; W158-K162 WeakPolarHBondContact O-CG 3.18Å; W158-K162 PolarHBondContact O-N 2.75Å; C159-K162 PolarHBondContact O-N 3.45Å; Q160-K162 PolarHBondContact O-N 3.14Å; K162-L187 HydrophobicContact CB-CD1 3.76Å; K162-L187 HydrophobicContact CG-CD1 4.38Å; K162-R190 HydrophobicContact CB-CG 4.22Å; K162-R190 HydrophobicContact CD-CG 4.31Å; K162-R190 WeakPolarHBondContact O-CD 3.46Å; K162-R190 VanDerWaalsContact O-CG 3.29Å; K162-R190 WeakPolarHBondContact O-CG 3.48Å; K162-H191 WeakPolarHBondContact CD-NE2 3.47Å; K162-H191 VanDerWaalsContact CE-NE2 3.33Å; K162-H191 WeakPolarHBondContact CE-NE2 3.31Å; K162-H191 PolarHBondContact NZ-NE2 3.36Å
163	T	91.6	Very high	91.1	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-92.7	-11.9	178.2	63.1	0	0	0	0	115	C159 Q160 P165 Y166 V169 V171 A186	C159-T163 WeakPolarHBondContact O-CG2 3.3Å; C159-T163 PolarHBondContact O-N 3.12Å; C159-T163 PolarHBondContact O-OG1 3.03Å; Q160-T163 PolarHBondContact O-N 3.39Å; Q160-T163 PolarHBondContact O-OG1 3.38Å; T163-P165 VanDerWaalsContact C-N 3.29Å; T163-P165 VanDerWaalsContact O-N 3.11Å; T163-Y166 WeakPolarHBondContact O-CB 3.18Å; T163-Y166 WeakPolarHBondContact O-CD2 3.3Å; T163-Y166 PolarHBondContact O-N 3.1Å; T163-V169 HydrophobicContact CG2-CG1 4.06Å; T163-V171 HydrophobicContact CG2-CG2 4.27Å; T163-A186 HydrophobicContact CG2-CB 4.03Å
164	A	89	Confident	91.4	Very high	77 Å²	77	51 Å²	51	64%	0.636	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-32.1	-179.6	0	0	0	0	0	115.9	Q160 Y166	Q160-A164 WeakPolarHBondContact O-CA 3.25Å; Q160-A164 VanDerWaalsContact O-CB 3.27Å; Q160-A164 WeakPolarHBondContact O-CB 3.2Å; Q160-A164 PolarHBondContact O-N 3.33Å; A164-Y166 PolarHBondContact O-N 2.88Å
165	P	88.7	Confident	91.7	Very high	79 Å²	79	51.3 Å²	51.3	51%	0.513	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.5	174.2	-24	36.3	0	0	0	115.1	T163	T163-P165 VanDerWaalsContact C-N 3.29Å; T163-P165 VanDerWaalsContact O-N 3.11Å
166	Y	93.5	Very high	91.8	Very high	26 Å²	26	54.6 Å²	54.6	10%	0.102	27%	0.274	C	S	.	.			trans	-96.9	98.1	-172.9	-59.8	-94.5	0	0	0	110.6	T163 A164 N168 V169 A186 H189 R190 Y198	T163-Y166 WeakPolarHBondContact O-CB 3.18Å; T163-Y166 WeakPolarHBondContact O-CD2 3.3Å; T163-Y166 PolarHBondContact O-N 3.1Å; A164-Y166 PolarHBondContact O-N 2.88Å; Y166-N168 PolarHBondContact O-N 2.97Å; Y166-V169 PolarHBondContact O-N 3.17Å; Y166-A186 HydrophobicContact CD1-CB 3.94Å; Y166-A186 HydrophobicContact CD2-CB 3.7Å; Y166-A186 HydrophobicContact CE1-CB 4.12Å; Y166-A186 HydrophobicContact CE2-CB 3.88Å; Y166-A186 WeakPolarHBondContact CE2-O 3.34Å; Y166-A186 HydrophobicContact CG-CB 3.7Å; Y166-A186 PolarHBondContact OH-O 3.19Å; Y166-A186 VanDerWaalsContact OH-O 3.1Å; Y166-H189 AromaticContact CE1-ND1 3.43Å; Y166-H189 WeakPolarHBondContact CE1-ND1 3.37Å; Y166-H189 AromaticContact CZ-ND1 3.54Å; Y166-H189 VanDerWaalsContact OH-C 3.26Å; Y166-H189 WeakPolarHBondContact OH-CB 3.49Å; Y166-H189 PolarHBondContact OH-ND1 3Å; Y166-R190 HydrophobicContact CE2-CB 4.15Å; Y166-R190 WeakPolarHBondContact OH-CA 3.44Å; Y166-R190 PolarHBondContact OH-N 3.28Å; Y166-Y198 AromaticContact CD1-CD1 3.8Å; Y166-Y198 HydrophobicContact CD1-CD1 3.8Å; Y166-Y198 HydrophobicContact CD1-CD2 4.21Å; Y166-Y198 AromaticContact CD1-CE1 3.49Å; Y166-Y198 HydrophobicContact CD1-CE1 3.49Å; Y166-Y198 VanDerWaalsContact CD1-CE1 3.49Å; Y166-Y198 AromaticContact CD1-CE2 3.95Å; Y166-Y198 HydrophobicContact CD1-CE2 3.95Å; Y166-Y198 HydrophobicContact CD1-CG 4.15Å; Y166-Y198 AromaticContact CD1-CZ 3.57Å; Y166-Y198 AromaticContact CE1-CD1 3.99Å; Y166-Y198 HydrophobicContact CE1-CD1 3.99Å; Y166-Y198 AromaticContact CE1-CD2 3.97Å; Y166-Y198 HydrophobicContact CE1-CD2 3.97Å; Y166-Y198 HydrophobicContact CE1-CE1 4.12Å; Y166-Y198 HydrophobicContact CE1-CE2 4.12Å; Y166-Y198 AromaticContact CE1-CG 3.92Å; Y166-Y198 HydrophobicContact CE1-CG 3.92Å; Y166-Y198 HydrophobicContact CG-CE1 4.48Å
167	K	88.7	Confident	91.9	Very high	216 Å²	216	54 Å²	54	94%	0.939	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.5	-174.5	-61.8	-178.7	179.7	179.9	0	115.5
168	N	91.5	Very high	92.2	Very high	71 Å²	71	52.7 Å²	52.7	38%	0.38	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.5	178.6	62.6	-32	0	0	0	113.8	Y166 Y198	Y166-N168 PolarHBondContact O-N 2.97Å; N168-Y198 VanDerWaalsContact CG-OH 3.32Å; N168-Y198 PolarHBondContact ND2-OH 3.18Å; N168-Y198 VanDerWaalsContact ND2-OH 3.13Å; N168-Y198 WeakPolarHBondContact OD1-CE1 3.45Å; N168-Y198 PolarHBondContact OD1-OH 2.95Å
169	V	93.8	Very high	92.3	Very high	18 Å²	18	54.1 Å²	54.1	11%	0.109	27%	0.273	C	S	.	.			trans	-123.8	129.3	179.5	177	0	0	0	0	109.6	T163 Y166 V171 L182 A183 A186 Y198	T163-V169 HydrophobicContact CG2-CG1 4.06Å; Y166-V169 PolarHBondContact O-N 3.17Å; V169-V171 HydrophobicContact CG1-CG2 3.82Å; V169-L182 HydrophobicContact CG2-CB 3.76Å; V169-A183 HydrophobicContact CG1-CB 3.92Å; V169-A186 HydrophobicContact CG2-CB 4.06Å; V169-Y198 WeakPolarHBondContact CG2-OH 3.5Å
170	N	93.6	Very high	92.4	Very high	105 Å²	105	55 Å²	55	56%	0.561	28%	0.277	S	S	*	.			trans	-137.1	100.4	174	177.8	23.6	0	0	0	108.2	Q172	N170-Q172 VanDerWaalsContact ND2-CD 3.35Å; N170-Q172 PolarHBondContact ND2-NE2 3.09Å; N170-Q172 PolarHBondContact O-N 3.48Å
171	V	94.2	Very high	92.5	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	26%	0.262	C	S	.	.			trans	-87.4	106.3	-176.6	-175	0	0	0	0	109.6	L156 C159 Q160 T163 V169 W178 A183	L156-V171 HydrophobicContact CD1-CG1 3.82Å; C159-V171 HydrophobicContact CB-CG1 4.07Å; Q160-V171 HydrophobicContact CG-CB 4.25Å; Q160-V171 WeakPolarHBondContact CG-O 3.25Å; Q160-V171 PolarHBondContact NE2-O 2.96Å; T163-V171 HydrophobicContact CG2-CG2 4.27Å; V169-V171 HydrophobicContact CG1-CG2 3.82Å; V171-W178 HydrophobicContact CG1-CZ2 3.73Å; V171-W178 HydrophobicContact CG2-CZ2 4.41Å; V171-A183 HydrophobicContact CG2-CB 4.09Å
172	Q	93.2	Very high	92.9	Very high	114 Å²	114	45.2 Å²	45.2	53%	0.533	24%	0.237	S	C	.	.			trans	-112.8	-23.7	-179.7	-65.4	-175.5	-33.2	0	0	113.1	N170 S177	N170-Q172 VanDerWaalsContact ND2-CD 3.35Å; N170-Q172 PolarHBondContact ND2-NE2 3.09Å; N170-Q172 PolarHBondContact O-N 3.48Å; Q172-S177 PolarHBondContact N-OG 3.48Å
173	N	93.2	Very high	93.2	Very high	34 Å²	34	43 Å²	43	18%	0.182	23%	0.228	C	C	.	.	S	Bend	trans	-150.3	167.9	-177.3	52.1	44.6	0	0	0	110.7	H175 M176 S177 W178	N173-H175 VanDerWaalsContact C-N 3.28Å; N173-H175 PolarHBondContact ND2-CE1 2.81Å; N173-H175 PolarHBondContact O-N 2.76Å; N173-H175 PolarHBondContact OD1-N 2.97Å; N173-M176 PolarHBondContact OD1-N 2.87Å; N173-M176 VanDerWaalsContact OD1-N 3.09Å; N173-S177 PolarHBondContact N-OG 3.02Å; N173-S177 WeakPolarHBondContact O-CB 3.49Å; N173-S177 PolarHBondContact O-OG 3.17Å; N173-S177 PolarHBondContact OD1-N 3.44Å; N173-S177 PolarHBondContact OD1-OG 3.25Å; N173-W178 PolarHBondContact O-NE1 2.93Å
174	F	94.6	Very high	93.4	Very high	1 Å²	1	43 Å²	43	0%	0.004	23%	0.227	C	C	.	.	S	Bend	trans	-91.1	30.5	173.7	-64.7	-75	0	0	0	112.9	K152 L155 L156 W178 E240 V243 M244 V247	K152-F174 HydrophobicContact CG-CE2 4.09Å; L155-F174 HydrophobicContact CB-CZ 4.14Å; L155-F174 HydrophobicContact CD2-CE1 4.26Å; L155-F174 HydrophobicContact CD2-CZ 4.07Å; L155-F174 HydrophobicContact CG-CE1 4.15Å; L155-F174 HydrophobicContact CG-CZ 3.83Å; L156-F174 HydrophobicContact CB-CE2 3.84Å; L156-F174 HydrophobicContact CB-CZ 3.81Å; L156-F174 HydrophobicContact CD1-CE1 4.5Å; L156-F174 HydrophobicContact CD1-CE2 4.13Å; L156-F174 HydrophobicContact CD1-CZ 4.12Å; L156-F174 HydrophobicContact CG-CE2 4.47Å; F174-W178 HydrophobicContact CD1-CZ2 4.41Å; F174-W178 AromaticContact CD1-NE1 3.93Å; F174-W178 HydrophobicContact CE1-CZ2 4.45Å; F174-E240 HydrophobicContact CB-CG 3.61Å; F174-E240 WeakPolarHBondContact O-CA 3.16Å; F174-V243 HydrophobicContact CB-CB 4.47Å; F174-V243 HydrophobicContact CB-CG1 4.18Å; F174-V243 HydrophobicContact CD1-CG1 4.45Å; F174-V243 WeakPolarHBondContact O-CB 2.85Å; F174-V243 WeakPolarHBondContact O-CG1 3.15Å; F174-M244 HydrophobicContact CB-CG 3.6Å; F174-M244 HydrophobicContact CD1-CG 3.9Å; F174-M244 HydrophobicContact CD2-CG 3.44Å; F174-M244 VanDerWaalsContact CD2-CG 3.44Å; F174-M244 HydrophobicContact CD2-SD 3.87Å; F174-M244 HydrophobicContact CE1-CG 4.4Å; F174-M244 HydrophobicContact CE2-CE 4.46Å; F174-M244 HydrophobicContact CE2-CG 4Å; F174-M244 HydrophobicContact CE2-SD 4.34Å; F174-M244 HydrophobicContact CG-CG 3.38Å; F174-M244 HydrophobicContact CG-SD 4.37Å; F174-M244 HydrophobicContact CZ-CG 4.44Å; F174-V247 HydrophobicContact CE1-CB 4.42Å; F174-V247 HydrophobicContact CE1-CG1 4.07Å
175	H	92.2	Very high	93.8	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.028	20%	0.197	C	C	.	.	S	Bend	trans	-131.6	-87.5	173	45.4	96.6	0	0	0	111.5	N173 S177 W178 R237 P238	N173-H175 VanDerWaalsContact C-N 3.28Å; N173-H175 PolarHBondContact ND2-CE1 2.81Å; N173-H175 PolarHBondContact O-N 2.76Å; N173-H175 PolarHBondContact OD1-N 2.97Å; H175-S177 VanDerWaalsContact C-N 3.26Å; H175-S177 PolarHBondContact O-N 3.41Å; H175-W178 PolarHBondContact O-N 2.98Å; H175-R237 HydrophobicContact CB-CG 4.05Å; H175-R237 PolarHBondContact NE2-NH2 3.23Å; H175-P238 WeakPolarHBondContact CB-O 3.44Å
176	M	92.8	Very high	94.1	Very high	69 Å²	69	35.5 Å²	35.5	34%	0.34	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-65.4	-28.6	-171.3	-68.2	-63.8	-88	0	0	113	W24 N173 W178 K179	W24-M176 HydrophobicContact CH2-CG 4.4Å; N173-M176 PolarHBondContact OD1-N 2.87Å; N173-M176 VanDerWaalsContact OD1-N 3.09Å; M176-W178 PolarHBondContact O-N 2.75Å; M176-W178 VanDerWaalsContact O-N 3.17Å; M176-K179 HydrophobicContact CE-CD 4.39Å; M176-K179 WeakPolarHBondContact O-CB 3.47Å; M176-K179 PolarHBondContact O-N 2.89Å; M176-K179 HydrophobicContact SD-CD 3.88Å
177	S	94.8	Very high	94.1	Very high	18 Å²	18	34.3 Å²	34.3	13%	0.126	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-64.5	-17	178.5	-50.9	0	0	0	0	114.6	Q172 N173 H175	Q172-S177 PolarHBondContact N-OG 3.48Å; N173-S177 PolarHBondContact N-OG 3.02Å; N173-S177 WeakPolarHBondContact O-CB 3.49Å; N173-S177 PolarHBondContact O-OG 3.17Å; N173-S177 PolarHBondContact OD1-N 3.44Å; N173-S177 PolarHBondContact OD1-OG 3.25Å; H175-S177 VanDerWaalsContact C-N 3.26Å; H175-S177 PolarHBondContact O-N 3.41Å
178	W	95.5	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-108.3	-6.1	-176.4	-58.8	84.1	0	0	0	112.7	C159 V171 N173 F174 H175 M176 D180 G181 A183 F184 L187 M232 V243 V247	C159-W178 HydrophobicContact CB-CH2 4.13Å; C159-W178 HydrophobicContact CB-CZ2 3.98Å; V171-W178 HydrophobicContact CG1-CZ2 3.73Å; V171-W178 HydrophobicContact CG2-CZ2 4.41Å; N173-W178 PolarHBondContact O-NE1 2.93Å; F174-W178 HydrophobicContact CD1-CZ2 4.41Å; F174-W178 AromaticContact CD1-NE1 3.93Å; F174-W178 HydrophobicContact CE1-CZ2 4.45Å; H175-W178 PolarHBondContact O-N 2.98Å; M176-W178 PolarHBondContact O-N 2.75Å; M176-W178 VanDerWaalsContact O-N 3.17Å; W178-D180 VanDerWaalsContact C-N 3.31Å; W178-D180 PolarHBondContact O-N 3.46Å; W178-G181 PolarHBondContact O-N 2.99Å; W178-G181 VanDerWaalsContact O-N 3.14Å; W178-A183 HydrophobicContact CD2-CB 3.96Å; W178-A183 HydrophobicContact CE3-CB 3.53Å; W178-A183 HydrophobicContact CH2-CB 4.47Å; W178-A183 HydrophobicContact CZ3-CB 3.81Å; W178-F184 HydrophobicContact CB-CE2 3.87Å; W178-F184 HydrophobicContact CB-CZ 4.28Å; W178-F184 HydrophobicContact CD2-CE1 4.5Å; W178-F184 HydrophobicContact CD2-CE2 4.41Å; W178-F184 HydrophobicContact CD2-CZ 4.23Å; W178-F184 AromaticContact CE3-CD1 3.71Å; W178-F184 HydrophobicContact CE3-CD1 3.71Å; W178-F184 AromaticContact CE3-CD2 3.88Å; W178-F184 HydrophobicContact CE3-CD2 3.88Å; W178-F184 AromaticContact CE3-CE1 3.59Å; W178-F184 HydrophobicContact CE3-CE1 3.59Å; W178-F184 AromaticContact CE3-CE2 3.79Å; W178-F184 HydrophobicContact CE3-CE2 3.79Å; W178-F184 AromaticContact CE3-CG 3.84Å; W178-F184 HydrophobicContact CE3-CG 3.84Å; W178-F184 AromaticContact CE3-CZ 3.63Å; W178-F184 HydrophobicContact CE3-CZ 3.63Å; W178-F184 HydrophobicContact CG-CE2 4.49Å; W178-F184 AromaticContact CZ3-CD1 3.75Å; W178-F184 HydrophobicContact CZ3-CD1 3.75Å; W178-F184 AromaticContact CZ3-CE1 3.86Å; W178-F184 HydrophobicContact CZ3-CE1 3.86Å; W178-F184 HydrophobicContact CZ3-CG 4.15Å; W178-F184 HydrophobicContact CZ3-CZ 4.37Å; W178-L187 HydrophobicContact CH2-CD2 4.42Å; W178-M232 HydrophobicContact CB-CE 4.27Å; W178-V243 HydrophobicContact CB-CG1 4.15Å; W178-V243 HydrophobicContact CD2-CG1 4.15Å; W178-V243 HydrophobicContact CG-CG1 3.73Å; W178-V247 HydrophobicContact CD2-CG2 4.13Å; W178-V247 HydrophobicContact CE3-CG2 3.98Å; W178-V247 HydrophobicContact CH2-CB 4.44Å; W178-V247 HydrophobicContact CH2-CG1 3.85Å; W178-V247 HydrophobicContact CH2-CG2 3.6Å; W178-V247 HydrophobicContact CZ2-CG1 4.06Å; W178-V247 HydrophobicContact CZ2-CG2 3.76Å; W178-V247 HydrophobicContact CZ3-CG2 3.72Å
179	K	94	Very high	94.5	Very high	47 Å²	47	23.1 Å²	23.1	20%	0.204	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-27.7	-170.3	-169.8	168.5	-168.4	179.5	0	114.4	M176 M232 V233 T235 V236 P238	M176-K179 HydrophobicContact CE-CD 4.39Å; M176-K179 WeakPolarHBondContact O-CB 3.47Å; M176-K179 PolarHBondContact O-N 2.89Å; M176-K179 HydrophobicContact SD-CD 3.88Å; K179-M232 VanDerWaalsContact CE-O 3.26Å; K179-M232 WeakPolarHBondContact CE-O 3.46Å; K179-M232 WeakPolarHBondContact CG-O 3.41Å; K179-V233 WeakPolarHBondContact CE-O 3.46Å; K179-V233 PolarHBondContact NZ-O 3.46Å; K179-T235 WeakPolarHBondContact CE-O 3.32Å; K179-T235 PolarHBondContact NZ-O 3.24Å; K179-V236 PolarHBondContact NZ-O 3.33Å; K179-P238 HydrophobicContact CB-CG 4.3Å; K179-P238 HydrophobicContact CD-CG 4.2Å; K179-P238 HydrophobicContact CG-CG 4.24Å
180	D	93.6	Very high	94.4	Very high	19 Å²	19	28.5 Å²	28.5	10%	0.102	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.3	177.9	63.3	25	0	0	0	114.6	W178 L182 K203 N209	W178-D180 VanDerWaalsContact C-N 3.31Å; W178-D180 PolarHBondContact O-N 3.46Å; D180-L182 PolarHBondContact O-N 3.33Å; D180-L182 VanDerWaalsContact O-N 3.1Å; D180-L182 WeakPolarHBondContact OD1-CB 3.44Å; D180-L182 PolarHBondContact OD1-N 3.35Å; D180-L182 VanDerWaalsContact OD1-N 3.09Å; D180-K203 HydrophobicContact CB-CG 3.93Å; D180-K203 WeakPolarHBondContact OD2-CD 3.5Å; D180-K203 WeakPolarHBondContact OD2-CE 3.45Å; D180-K203 IonicContact OD2-NZ 3.89Å; D180-K203 PolarHBondContact OD2-NZ 3.38Å; D180-N209 WeakPolarHBondContact O-CB 3.48Å; D180-N209 PolarHBondContact O-ND2 2.93Å
181	G	94.7	Very high	94.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	72.8	-13.3	-179.5	0	0	0	0	0	115.6	W178 A183 F184 C185	W178-G181 PolarHBondContact O-N 2.99Å; W178-G181 VanDerWaalsContact O-N 3.14Å; G181-A183 VanDerWaalsContact C-N 3.29Å; G181-A183 PolarHBondContact O-N 3.31Å; G181-F184 PolarHBondContact O-N 3.13Å; G181-C185 PolarHBondContact O-N 3.4Å
182	L	96.6	Very high	93.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-34.5	-174.6	-65.2	173.1	0	0	0	111.9	V169 D180 C185 A186 L201 K203	V169-L182 HydrophobicContact CG2-CB 3.76Å; D180-L182 PolarHBondContact O-N 3.33Å; D180-L182 VanDerWaalsContact O-N 3.1Å; D180-L182 WeakPolarHBondContact OD1-CB 3.44Å; D180-L182 PolarHBondContact OD1-N 3.35Å; D180-L182 VanDerWaalsContact OD1-N 3.09Å; L182-C185 PolarHBondContact O-N 3.01Å; L182-A186 VanDerWaalsContact O-CB 3.26Å; L182-A186 WeakPolarHBondContact O-CB 3.49Å; L182-A186 PolarHBondContact O-N 2.97Å; L182-L201 HydrophobicContact CD2-CB 3.79Å; L182-K203 HydrophobicContact CD1-CB 3.91Å; L182-K203 HydrophobicContact CD1-CG 4.41Å
183	A	96.6	Very high	93.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-43.2	176	0	0	0	0	0	112.9	V169 V171 W178 G181 A186 L187	V169-A183 HydrophobicContact CG1-CB 3.92Å; V171-A183 HydrophobicContact CG2-CB 4.09Å; W178-A183 HydrophobicContact CD2-CB 3.96Å; W178-A183 HydrophobicContact CE3-CB 3.53Å; W178-A183 HydrophobicContact CH2-CB 4.47Å; W178-A183 HydrophobicContact CZ3-CB 3.81Å; G181-A183 VanDerWaalsContact C-N 3.29Å; G181-A183 PolarHBondContact O-N 3.31Å; A183-A186 PolarHBondContact O-N 3.04Å; A183-L187 WeakPolarHBondContact O-CB 3.47Å; A183-L187 PolarHBondContact O-N 2.73Å
184	F	96.9	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-46.7	175.4	-69.7	-69.8	0	0	0	111.4	W178 G181 A186 L187 I188 L210 A213 F214 L227 V243 Y246 V247 Y250	W178-F184 HydrophobicContact CB-CE2 3.87Å; W178-F184 HydrophobicContact CB-CZ 4.28Å; W178-F184 HydrophobicContact CD2-CE1 4.5Å; W178-F184 HydrophobicContact CD2-CE2 4.41Å; W178-F184 HydrophobicContact CD2-CZ 4.23Å; W178-F184 AromaticContact CE3-CD1 3.71Å; W178-F184 HydrophobicContact CE3-CD1 3.71Å; W178-F184 AromaticContact CE3-CD2 3.88Å; W178-F184 HydrophobicContact CE3-CD2 3.88Å; W178-F184 AromaticContact CE3-CE1 3.59Å; W178-F184 HydrophobicContact CE3-CE1 3.59Å; W178-F184 AromaticContact CE3-CE2 3.79Å; W178-F184 HydrophobicContact CE3-CE2 3.79Å; W178-F184 AromaticContact CE3-CG 3.84Å; W178-F184 HydrophobicContact CE3-CG 3.84Å; W178-F184 AromaticContact CE3-CZ 3.63Å; W178-F184 HydrophobicContact CE3-CZ 3.63Å; W178-F184 HydrophobicContact CG-CE2 4.49Å; W178-F184 AromaticContact CZ3-CD1 3.75Å; W178-F184 HydrophobicContact CZ3-CD1 3.75Å; W178-F184 AromaticContact CZ3-CE1 3.86Å; W178-F184 HydrophobicContact CZ3-CE1 3.86Å; W178-F184 HydrophobicContact CZ3-CG 4.15Å; W178-F184 HydrophobicContact CZ3-CZ 4.37Å; G181-F184 PolarHBondContact O-N 3.13Å; F184-A186 VanDerWaalsContact C-N 3.32Å; F184-A186 PolarHBondContact O-N 3.41Å; F184-L187 PolarHBondContact O-N 2.88Å; F184-I188 WeakPolarHBondContact O-CG1 3.39Å; F184-I188 PolarHBondContact O-N 3.39Å; F184-I188 VanDerWaalsContact O-N 3.12Å; F184-L210 HydrophobicContact CD2-CD2 3.87Å; F184-L210 HydrophobicContact CE2-CD2 4Å; F184-A213 HydrophobicContact CB-CB 3.66Å; F184-F214 AromaticContact CD2-CE1 3.98Å; F184-F214 HydrophobicContact CD2-CE1 3.98Å; F184-F214 HydrophobicContact CE2-CE1 4.07Å; F184-F214 HydrophobicContact CE2-CZ 4.42Å; F184-F214 HydrophobicContact CG-CE1 4.29Å; F184-F214 HydrophobicContact CZ-CE1 4.46Å; F184-L227 HydrophobicContact CE2-CD1 4.27Å; F184-L227 HydrophobicContact CZ-CD1 3.77Å; F184-V243 HydrophobicContact CZ-CG1 4.45Å; F184-Y246 HydrophobicContact CD1-CD1 4.3Å; F184-Y246 HydrophobicContact CD1-CE1 4.29Å; F184-Y246 AromaticContact CE1-CD1 3.55Å; F184-Y246 HydrophobicContact CE1-CD1 3.55Å; F184-Y246 AromaticContact CE1-CE1 3.98Å; F184-Y246 HydrophobicContact CE1-CE1 3.98Å; F184-Y246 AromaticContact CZ-CD1 3.86Å; F184-Y246 HydrophobicContact CZ-CD1 3.86Å; F184-Y246 HydrophobicContact CZ-CE1 4.41Å; F184-V247 HydrophobicContact CE1-CG2 3.71Å; F184-V247 HydrophobicContact CZ-CG2 4.24Å; F184-Y250 HydrophobicContact CD1-CD2 4.46Å; F184-Y250 AromaticContact CD1-CE2 3.86Å; F184-Y250 HydrophobicContact CD1-CE2 3.86Å; F184-Y250 HydrophobicContact CE1-CE2 4.15Å
185	C	96.5	Very high	93.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-40.9	176.8	-64.7	0	0	0	0	112.5	G181 L182 H189 I196 Y198 L201 N209	G181-C185 PolarHBondContact O-N 3.4Å; L182-C185 PolarHBondContact O-N 3.01Å; C185-H189 VanDerWaalsContact O-CB 3.26Å; C185-H189 WeakPolarHBondContact O-CB 3.48Å; C185-H189 PolarHBondContact O-N 3.42Å; C185-I196 HydrophobicContact CB-CD1 4.12Å; C185-I196 HydrophobicContact CB-CG2 4.35Å; C185-Y198 HydrophobicContact CB-CD2 4.07Å; C185-Y198 HydrophobicContact CB-CE2 3.92Å; C185-L201 HydrophobicContact CB-CD1 3.37Å; C185-N209 PolarHBondContact SG-O 3.45Å
186	A	95.7	Very high	93.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-39.9	178.9	0	0	0	0	0	111.8	T163 Y166 V169 L182 A183 F184 R190 Y198	T163-A186 HydrophobicContact CG2-CB 4.03Å; Y166-A186 HydrophobicContact CD1-CB 3.94Å; Y166-A186 HydrophobicContact CD2-CB 3.7Å; Y166-A186 HydrophobicContact CE1-CB 4.12Å; Y166-A186 HydrophobicContact CE2-CB 3.88Å; Y166-A186 WeakPolarHBondContact CE2-O 3.34Å; Y166-A186 HydrophobicContact CG-CB 3.7Å; Y166-A186 PolarHBondContact OH-O 3.19Å; Y166-A186 VanDerWaalsContact OH-O 3.1Å; V169-A186 HydrophobicContact CG2-CB 4.06Å; L182-A186 VanDerWaalsContact O-CB 3.26Å; L182-A186 WeakPolarHBondContact O-CB 3.49Å; L182-A186 PolarHBondContact O-N 2.97Å; A183-A186 PolarHBondContact O-N 3.04Å; F184-A186 VanDerWaalsContact C-N 3.32Å; F184-A186 PolarHBondContact O-N 3.41Å; A186-R190 VanDerWaalsContact O-CB 3.3Å; A186-R190 WeakPolarHBondContact O-CB 3.49Å; A186-R190 PolarHBondContact O-N 3.19Å; A186-Y198 HydrophobicContact CB-CE2 3.71Å
187	L	94.3	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-42.4	179	-170.3	67.2	0	0	0	112.2	W158 K162 W178 A183 F184 H191 Y250 F254	W158-L187 HydrophobicContact CE3-CD1 4.28Å; W158-L187 HydrophobicContact CH2-CD1 3.65Å; W158-L187 HydrophobicContact CH2-CD2 3.86Å; W158-L187 HydrophobicContact CH2-CG 4.04Å; W158-L187 HydrophobicContact CZ2-CD1 4.3Å; W158-L187 HydrophobicContact CZ3-CD1 3.65Å; W158-L187 HydrophobicContact CZ3-CD2 3.72Å; W158-L187 HydrophobicContact CZ3-CG 4.19Å; K162-L187 HydrophobicContact CB-CD1 3.76Å; K162-L187 HydrophobicContact CG-CD1 4.38Å; W178-L187 HydrophobicContact CH2-CD2 4.42Å; A183-L187 WeakPolarHBondContact O-CB 3.47Å; A183-L187 PolarHBondContact O-N 2.73Å; F184-L187 PolarHBondContact O-N 2.88Å; L187-H191 PolarHBondContact O-ND1 2.66Å; L187-Y250 HydrophobicContact CD2-CG 4.14Å; L187-F254 HydrophobicContact CG-CE2 4.35Å
188	I	94.3	Very high	92.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-54.8	174	-64.1	164.1	0	0	0	109.9	F184 R190 H191 R192 L195 I196 A213 V216 L221 Y250 F254	F184-I188 WeakPolarHBondContact O-CG1 3.39Å; F184-I188 PolarHBondContact O-N 3.39Å; F184-I188 VanDerWaalsContact O-N 3.12Å; I188-R190 PolarHBondContact O-N 2.85Å; I188-R190 VanDerWaalsContact O-N 3.11Å; I188-H191 PolarHBondContact O-N 2.99Å; I188-R192 PolarHBondContact O-N 3.4Å; I188-L195 HydrophobicContact CG2-CB 4.44Å; I188-I196 HydrophobicContact CB-CD1 3.7Å; I188-I196 HydrophobicContact CB-CG1 4.48Å; I188-I196 HydrophobicContact CD1-CD1 3.86Å; I188-I196 HydrophobicContact CG1-CD1 4.4Å; I188-I196 HydrophobicContact CG2-CD1 3.65Å; I188-I196 HydrophobicContact CG2-CG1 3.93Å; I188-A213 HydrophobicContact CD1-CB 4.07Å; I188-V216 HydrophobicContact CD1-CG1 4.49Å; I188-V216 HydrophobicContact CG2-CG1 3.96Å; I188-L221 HydrophobicContact CG1-CD1 4.25Å; I188-L221 HydrophobicContact CG2-CD1 4.44Å; I188-Y250 HydrophobicContact CD1-CE1 3.69Å; I188-Y250 HydrophobicContact CG1-CD1 4.09Å; I188-Y250 HydrophobicContact CG1-CE1 3.55Å; I188-F254 HydrophobicContact CG1-CZ 4.45Å
189	H	94.4	Very high	92.7	Very high	52 Å²	52	38.5 Å²	38.5	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-59	-27.1	-179	-178.9	-104.9	0	0	0	112.6	Y166 C185 H191 P193 I196 Y198	Y166-H189 AromaticContact CE1-ND1 3.43Å; Y166-H189 WeakPolarHBondContact CE1-ND1 3.37Å; Y166-H189 AromaticContact CZ-ND1 3.54Å; Y166-H189 VanDerWaalsContact OH-C 3.26Å; Y166-H189 WeakPolarHBondContact OH-CB 3.49Å; Y166-H189 PolarHBondContact OH-ND1 3Å; C185-H189 VanDerWaalsContact O-CB 3.26Å; C185-H189 WeakPolarHBondContact O-CB 3.48Å; C185-H189 PolarHBondContact O-N 3.42Å; H189-H191 PolarHBondContact O-N 3.45Å; H189-P193 VanDerWaalsContact CD2-CA 3.49Å; H189-P193 WeakPolarHBondContact CD2-CA 3.44Å; H189-P193 VanDerWaalsContact O-CA 3.28Å; H189-P193 WeakPolarHBondContact O-CA 3.31Å; H189-P193 WeakPolarHBondContact O-CB 3.38Å; H189-P193 WeakPolarHBondContact O-CD 3.43Å; H189-I196 HydrophobicContact CB-CB 4.15Å; H189-I196 HydrophobicContact CB-CG2 4.15Å; H189-I196 PolarHBondContact CD2-O 2.79Å; H189-Y198 HydrophobicContact CB-CD2 4.38Å
190	R	90.3	Very high	92.6	Very high	131 Å²	131	44.2 Å²	44.2	49%	0.494	22%	0.218	S	C	.	.	H	α-helix	trans	-67.8	-34.2	177.2	-173.1	63.7	179.4	120.4	-4.5	113.2	K162 Y166 A186 I188	K162-R190 HydrophobicContact CB-CG 4.22Å; K162-R190 HydrophobicContact CD-CG 4.31Å; K162-R190 WeakPolarHBondContact O-CD 3.46Å; K162-R190 VanDerWaalsContact O-CG 3.29Å; K162-R190 WeakPolarHBondContact O-CG 3.48Å; Y166-R190 HydrophobicContact CE2-CB 4.15Å; Y166-R190 WeakPolarHBondContact OH-CA 3.44Å; Y166-R190 PolarHBondContact OH-N 3.28Å; A186-R190 VanDerWaalsContact O-CB 3.3Å; A186-R190 WeakPolarHBondContact O-CB 3.49Å; A186-R190 PolarHBondContact O-N 3.19Å; I188-R190 PolarHBondContact O-N 2.85Å; I188-R190 VanDerWaalsContact O-N 3.11Å
191	H	87	Confident	92.5	Very high	47 Å²	47	44.6 Å²	44.6	22%	0.218	22%	0.22	C	C	.	.	H	α-helix	trans	-100.6	-31.8	-177.6	-64	97.5	0	0	0	112.6	W158 K162 L187 I188 H189 F254	W158-H191 AromaticContact CZ2-CE1 3.65Å; K162-H191 WeakPolarHBondContact CD-NE2 3.47Å; K162-H191 VanDerWaalsContact CE-NE2 3.33Å; K162-H191 WeakPolarHBondContact CE-NE2 3.31Å; K162-H191 PolarHBondContact NZ-NE2 3.36Å; L187-H191 PolarHBondContact O-ND1 2.66Å; I188-H191 PolarHBondContact O-N 2.99Å; H189-H191 PolarHBondContact O-N 3.45Å; H191-F254 HydrophobicContact CB-CD1 3.54Å; H191-F254 HydrophobicContact CB-CD2 4.21Å; H191-F254 HydrophobicContact CB-CE1 3.62Å; H191-F254 HydrophobicContact CB-CE2 4.27Å; H191-F254 HydrophobicContact CB-CG 3.87Å; H191-F254 HydrophobicContact CB-CZ 4Å; H191-F254 AromaticContact CD2-CG 3.91Å; H191-F254 AromaticContact CE1-CD2 3.71Å; H191-F254 AromaticContact CG-CD1 3.8Å; H191-F254 AromaticContact CG-CD2 3.75Å; H191-F254 AromaticContact CG-CG 3.56Å; H191-F254 AromaticContact ND1-CD2 3.34Å; H191-F254 VanDerWaalsContact ND1-CD2 3.34Å; H191-F254 WeakPolarHBondContact ND1-CD2 3.37Å; H191-F254 AromaticContact ND1-CE2 3.67Å; H191-F254 AromaticContact ND1-CG 3.66Å
192	R	87.6	Confident	92.4	Very high	107 Å²	107	46.6 Å²	46.6	40%	0.404	23%	0.234	S	C	.	.			trans	-136.2	73.3	-178.9	-68.8	-60.1	-61.4	-103.7	-4.5	109.8	I188 D194 L195 L221 F254	I188-R192 PolarHBondContact O-N 3.4Å; R192-D194 VanDerWaalsContact CA-OD1 3.24Å; R192-D194 WeakPolarHBondContact CA-OD1 3.49Å; R192-D194 WeakPolarHBondContact CB-OD1 3.09Å; R192-D194 IonicContact CZ-OD1 2.66Å; R192-D194 IonicContact CZ-OD2 2.63Å; R192-D194 IonicContact NE-OD1 2.61Å; R192-D194 PolarHBondContact NE-OD1 3.28Å; R192-D194 IonicContact NE-OD2 2.66Å; R192-D194 PolarHBondContact NE-OD2 3.26Å; R192-D194 IonicContact NH2-OD1 3.81Å; R192-D194 IonicContact NH2-OD2 3.41Å; R192-D194 PolarHBondContact NH2-OD2 3.31Å; R192-D194 PolarHBondContact O-N 2.84Å; R192-L195 HydrophobicContact CB-CB 4.44Å; R192-L195 HydrophobicContact CB-CD1 3.63Å; R192-L195 HydrophobicContact CB-CG 3.91Å; R192-L195 HydrophobicContact CG-CD1 4.1Å; R192-L195 PolarHBondContact O-N 3.3Å; R192-L195 VanDerWaalsContact O-N 3.14Å; R192-L221 HydrophobicContact CG-CD2 4.33Å; R192-F254 HydrophobicContact CG-CE1 4.34Å
193	P	87.7	Confident	92.1	Very high	80 Å²	80	52.9 Å²	52.9	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.2	-179.7	26.6	-34.7	0	0	0	112.8	H189 L195	H189-P193 VanDerWaalsContact CD2-CA 3.49Å; H189-P193 WeakPolarHBondContact CD2-CA 3.44Å; H189-P193 VanDerWaalsContact O-CA 3.28Å; H189-P193 WeakPolarHBondContact O-CA 3.31Å; H189-P193 WeakPolarHBondContact O-CB 3.38Å; H189-P193 WeakPolarHBondContact O-CD 3.43Å; P193-L195 PolarHBondContact O-N 3.02Å
194	D	87.9	Confident	91.9	Very high	101 Å²	101	59 Å²	59	54%	0.54	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-20.5	173.9	59.2	-59.4	0	0	0	114.3	R192	R192-D194 VanDerWaalsContact CA-OD1 3.24Å; R192-D194 WeakPolarHBondContact CA-OD1 3.49Å; R192-D194 WeakPolarHBondContact CB-OD1 3.09Å; R192-D194 IonicContact CZ-OD1 2.66Å; R192-D194 IonicContact CZ-OD2 2.63Å; R192-D194 IonicContact NE-OD1 2.61Å; R192-D194 PolarHBondContact NE-OD1 3.28Å; R192-D194 IonicContact NE-OD2 2.66Å; R192-D194 PolarHBondContact NE-OD2 3.26Å; R192-D194 IonicContact NH2-OD1 3.81Å; R192-D194 IonicContact NH2-OD2 3.41Å; R192-D194 PolarHBondContact NH2-OD2 3.31Å; R192-D194 PolarHBondContact O-N 2.84Å
195	L	91.8	Very high	91.8	Very high	27 Å²	27	62.4 Å²	62.4	14%	0.141	31%	0.312	C	S	.	.	S	Bend	trans	-97.8	-20.4	-172.4	-60.3	-179.9	0	0	0	114.8	I188 R192 P193 Y212 V216 H220 L221	I188-L195 HydrophobicContact CG2-CB 4.44Å; R192-L195 HydrophobicContact CB-CB 4.44Å; R192-L195 HydrophobicContact CB-CD1 3.63Å; R192-L195 HydrophobicContact CB-CG 3.91Å; R192-L195 HydrophobicContact CG-CD1 4.1Å; R192-L195 PolarHBondContact O-N 3.3Å; R192-L195 VanDerWaalsContact O-N 3.14Å; P193-L195 PolarHBondContact O-N 3.02Å; L195-Y212 PolarHBondContact O-OH 2.9Å; L195-V216 HydrophobicContact CB-CG1 3.75Å; L195-V216 HydrophobicContact CD1-CG1 4.16Å; L195-H220 HydrophobicContact CD1-CB 3.69Å; L195-H220 HydrophobicContact CD2-CB 3.95Å; L195-H220 HydrophobicContact CG-CB 4.47Å; L195-L221 HydrophobicContact CD1-CD2 4.01Å
196	I	91.9	Very high	91.6	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.021	32%	0.322	C	S	.	.			trans	-131.2	120.8	-174.3	-72	-167	0	0	0	111.3	C185 I188 H189 Y198 L201 Y212 V216	C185-I196 HydrophobicContact CB-CD1 4.12Å; C185-I196 HydrophobicContact CB-CG2 4.35Å; I188-I196 HydrophobicContact CB-CD1 3.7Å; I188-I196 HydrophobicContact CB-CG1 4.48Å; I188-I196 HydrophobicContact CD1-CD1 3.86Å; I188-I196 HydrophobicContact CG1-CD1 4.4Å; I188-I196 HydrophobicContact CG2-CD1 3.65Å; I188-I196 HydrophobicContact CG2-CG1 3.93Å; H189-I196 HydrophobicContact CB-CB 4.15Å; H189-I196 HydrophobicContact CB-CG2 4.15Å; H189-I196 PolarHBondContact CD2-O 2.79Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 HydrophobicContact CG2-CD2 4.38Å; I196-Y198 PolarHBondContact O-N 3.42Å; I196-L201 HydrophobicContact CG2-CD1 4.17Å; I196-Y212 WeakPolarHBondContact CA-OH 3.49Å; I196-Y212 HydrophobicContact CB-CE1 4.43Å; I196-Y212 HydrophobicContact CG1-CE1 4.19Å; I196-Y212 HydrophobicContact CG2-CE1 4.06Å; I196-V216 HydrophobicContact CD1-CG1 4.45Å; I196-V216 HydrophobicContact CG1-CG1 4.16Å; I196-V216 HydrophobicContact CG1-CG2 4.26Å
197	D	92.1	Very high	91.6	Very high	61 Å²	61	67 Å²	67	33%	0.326	34%	0.337	S	S	.	.			trans	-81.6	83.6	166.9	-172.2	-12.5	0	0	0	109.9	S199 K200 Y212	D197-S199 PolarHBondContact O-N 2.67Å; D197-S199 VanDerWaalsContact O-N 3.11Å; D197-S199 WeakPolarHBondContact OD1-CB 3.42Å; D197-S199 PolarHBondContact OD1-N 3.35Å; D197-S199 PolarHBondContact OD1-OG 3.07Å; D197-K200 HydrophobicContact CB-CD 4.28Å; D197-K200 PolarHBondContact O-N 3.04Å; D197-K200 VanDerWaalsContact OD2-CD 3.3Å; D197-K200 WeakPolarHBondContact OD2-CD 3.47Å; D197-K200 WeakPolarHBondContact OD2-CE 3.39Å; D197-K200 IonicContact OD2-NZ 2.67Å; D197-K200 PolarHBondContact OD2-NZ 3.36Å; D197-Y212 PolarHBondContact N-OH 2.96Å
198	Y	92.4	Very high	91.7	Very high	27 Å²	27	73 Å²	73	11%	0.106	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-62	-21.8	-175.5	-163.2	-88.6	0	0	0	112.8	Y166 N168 V169 C185 A186 H189 I196 K200 L201	Y166-Y198 AromaticContact CD1-CD1 3.8Å; Y166-Y198 HydrophobicContact CD1-CD1 3.8Å; Y166-Y198 HydrophobicContact CD1-CD2 4.21Å; Y166-Y198 AromaticContact CD1-CE1 3.49Å; Y166-Y198 HydrophobicContact CD1-CE1 3.49Å; Y166-Y198 VanDerWaalsContact CD1-CE1 3.49Å; Y166-Y198 AromaticContact CD1-CE2 3.95Å; Y166-Y198 HydrophobicContact CD1-CE2 3.95Å; Y166-Y198 HydrophobicContact CD1-CG 4.15Å; Y166-Y198 AromaticContact CD1-CZ 3.57Å; Y166-Y198 AromaticContact CE1-CD1 3.99Å; Y166-Y198 HydrophobicContact CE1-CD1 3.99Å; Y166-Y198 AromaticContact CE1-CD2 3.97Å; Y166-Y198 HydrophobicContact CE1-CD2 3.97Å; Y166-Y198 HydrophobicContact CE1-CE1 4.12Å; Y166-Y198 HydrophobicContact CE1-CE2 4.12Å; Y166-Y198 AromaticContact CE1-CG 3.92Å; Y166-Y198 HydrophobicContact CE1-CG 3.92Å; Y166-Y198 HydrophobicContact CG-CE1 4.48Å; N168-Y198 VanDerWaalsContact CG-OH 3.32Å; N168-Y198 PolarHBondContact ND2-OH 3.18Å; N168-Y198 VanDerWaalsContact ND2-OH 3.13Å; N168-Y198 WeakPolarHBondContact OD1-CE1 3.45Å; N168-Y198 PolarHBondContact OD1-OH 2.95Å; V169-Y198 WeakPolarHBondContact CG2-OH 3.5Å; C185-Y198 HydrophobicContact CB-CD2 4.07Å; C185-Y198 HydrophobicContact CB-CE2 3.92Å; A186-Y198 HydrophobicContact CB-CE2 3.71Å; H189-Y198 HydrophobicContact CB-CD2 4.38Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 HydrophobicContact CG2-CD2 4.38Å; I196-Y198 PolarHBondContact O-N 3.42Å; Y198-K200 PolarHBondContact O-N 3.47Å; Y198-L201 HydrophobicContact CD2-CD1 3.74Å; Y198-L201 HydrophobicContact CE2-CD1 4.04Å; Y198-L201 HydrophobicContact CG-CD1 4.28Å; Y198-L201 PolarHBondContact O-N 3.07Å
199	S	90.8	Very high	91.8	Very high	106 Å²	106	73.2 Å²	73.2	74%	0.741	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-68.1	-19.2	-178.1	77.5	0	0	0	0	114.2	D197	D197-S199 PolarHBondContact O-N 2.67Å; D197-S199 VanDerWaalsContact O-N 3.11Å; D197-S199 WeakPolarHBondContact OD1-CB 3.42Å; D197-S199 PolarHBondContact OD1-N 3.35Å; D197-S199 PolarHBondContact OD1-OG 3.07Å
200	K	91.4	Very high	91.9	Very high	166 Å²	166	70.7 Å²	70.7	72%	0.722	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-92.2	-5.4	-178.6	-69.9	174.4	177.9	141.4	0	114.2	D197 Y198	D197-K200 HydrophobicContact CB-CD 4.28Å; D197-K200 PolarHBondContact O-N 3.04Å; D197-K200 VanDerWaalsContact OD2-CD 3.3Å; D197-K200 WeakPolarHBondContact OD2-CD 3.47Å; D197-K200 WeakPolarHBondContact OD2-CE 3.39Å; D197-K200 IonicContact OD2-NZ 2.67Å; D197-K200 PolarHBondContact OD2-NZ 3.36Å; Y198-K200 PolarHBondContact O-N 3.47Å
201	L	92.2	Very high	92.2	Very high	27 Å²	27	67 Å²	67	14%	0.141	35%	0.345	C	S	.	.			trans	-88.3	134.8	-172.6	-53.2	178.6	0	0	0	111.1	L182 C185 I196 Y198 Y212	L182-L201 HydrophobicContact CD2-CB 3.79Å; C185-L201 HydrophobicContact CB-CD1 3.37Å; I196-L201 HydrophobicContact CG2-CD1 4.17Å; Y198-L201 HydrophobicContact CD2-CD1 3.74Å; Y198-L201 HydrophobicContact CE2-CD1 4.04Å; Y198-L201 HydrophobicContact CG-CD1 4.28Å; Y198-L201 PolarHBondContact O-N 3.07Å; L201-Y212 HydrophobicContact CD2-CD1 3.85Å; L201-Y212 HydrophobicContact CD2-CE1 4.16Å
202	S	91.2	Very high	92.7	Very high	42 Å²	42	68.7 Å²	68.7	29%	0.294	35%	0.35	S	S	.	.			trans	-126.4	148.6	172	-169	0	0	0	0	111.2	D204 N205 N209	S202-D204 PolarHBondContact O-N 3.33Å; S202-D204 PolarHBondContact OG-OD2 3.38Å; S202-N205 PolarHBondContact O-N 2.97Å; S202-N209 PolarHBondContact O-ND2 3.13Å
203	K	91.4	Very high	93.1	Very high	132 Å²	132	63.6 Å²	63.6	57%	0.574	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.4	175.4	-173.2	161.5	-176.2	139.5	0	113	D180 L182 N205	D180-K203 HydrophobicContact CB-CG 3.93Å; D180-K203 WeakPolarHBondContact OD2-CD 3.5Å; D180-K203 WeakPolarHBondContact OD2-CE 3.45Å; D180-K203 IonicContact OD2-NZ 3.89Å; D180-K203 PolarHBondContact OD2-NZ 3.38Å; L182-K203 HydrophobicContact CD1-CB 3.91Å; L182-K203 HydrophobicContact CD1-CG 4.41Å; K203-N205 PolarHBondContact O-N 3.09Å
204	D	92.2	Very high	93.5	Very high	130 Å²	130	59.8 Å²	59.8	70%	0.695	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-16.5	-178.5	-44.6	-60.1	0	0	0	113.8	S202 P206	S202-D204 PolarHBondContact O-N 3.33Å; S202-D204 PolarHBondContact OG-OD2 3.38Å; D204-P206 WeakPolarHBondContact O-CD 3.48Å
205	N	93.9	Very high	93.9	Very high	71 Å²	71	57.1 Å²	57.1	38%	0.38	29%	0.292	S	S	.	.			trans	-117.2	56	-175.2	-61.1	-57.7	0	0	0	112.3	S202 K203 I207 Q208 N209	S202-N205 PolarHBondContact O-N 2.97Å; K203-N205 PolarHBondContact O-N 3.09Å; N205-I207 PolarHBondContact O-N 3.05Å; N205-Q208 HydrophobicContact CB-CB 4.09Å; N205-Q208 HydrophobicContact CB-CG 4.25Å; N205-Q208 WeakPolarHBondContact O-CB 3.44Å; N205-Q208 PolarHBondContact O-N 3.46Å; N205-N209 PolarHBondContact O-N 3.36Å
206	P	94.1	Very high	94.1	Very high	31 Å²	31	56.2 Å²	56.2	20%	0.201	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-41.5	-167.9	28	-37.5	0	0	0	112.8	D204 Q208 N209 L210 V233	D204-P206 WeakPolarHBondContact O-CD 3.48Å; P206-Q208 VanDerWaalsContact C-N 3.28Å; P206-Q208 PolarHBondContact O-N 3.5Å; P206-N209 PolarHBondContact O-N 3.08Å; P206-L210 WeakPolarHBondContact O-CB 3.21Å; P206-L210 WeakPolarHBondContact O-CD1 3.23Å; P206-L210 VanDerWaalsContact O-CG 3.27Å; P206-L210 WeakPolarHBondContact O-CG 3.44Å; P206-L210 PolarHBondContact O-N 3.28Å; P206-V233 HydrophobicContact CB-CG2 3.8Å; P206-V233 HydrophobicContact CG-CG1 4.07Å; P206-V233 HydrophobicContact CG-CG2 3.98Å
207	I	95.3	Very high	94.2	Very high	64 Å²	64	56 Å²	56	33%	0.328	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-35.9	176.8	-60.8	177.3	0	0	0	111.3	N205 N211 A229 V233	N205-I207 PolarHBondContact O-N 3.05Å; I207-N211 WeakPolarHBondContact CG2-ND2 3.36Å; I207-N211 WeakPolarHBondContact O-CB 3.39Å; I207-N211 PolarHBondContact O-N 3.05Å; I207-N211 VanDerWaalsContact O-N 3.13Å; I207-N211 PolarHBondContact O-ND2 3.12Å; I207-A229 HydrophobicContact CG2-CB 4.23Å; I207-V233 HydrophobicContact CD1-CG1 4.49Å; I207-V233 HydrophobicContact CG1-CB 4.08Å; I207-V233 HydrophobicContact CG1-CG1 4.23Å; I207-V233 HydrophobicContact CG1-CG2 3.8Å
208	Q	95.8	Very high	94.3	Very high	127 Å²	127	57.2 Å²	57.2	59%	0.593	29%	0.29	S	S	*	.	H	α-helix	trans	-73.3	-43.6	178.2	-61.6	-179.8	-0.4	0	0	111.2	N205 P206 Y212	N205-Q208 HydrophobicContact CB-CB 4.09Å; N205-Q208 HydrophobicContact CB-CG 4.25Å; N205-Q208 WeakPolarHBondContact O-CB 3.44Å; N205-Q208 PolarHBondContact O-N 3.46Å; P206-Q208 VanDerWaalsContact C-N 3.28Å; P206-Q208 PolarHBondContact O-N 3.5Å; Q208-Y212 VanDerWaalsContact O-CB 3.27Å; Q208-Y212 WeakPolarHBondContact O-CB 3.39Å; Q208-Y212 PolarHBondContact O-N 3.33Å
209	N	96.7	Very high	94.3	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-48.4	177.1	-61	-23	0	0	0	111.3	D180 C185 S202 N205 P206 Y212 A213	D180-N209 WeakPolarHBondContact O-CB 3.48Å; D180-N209 PolarHBondContact O-ND2 2.93Å; C185-N209 PolarHBondContact SG-O 3.45Å; S202-N209 PolarHBondContact O-ND2 3.13Å; N205-N209 PolarHBondContact O-N 3.36Å; P206-N209 PolarHBondContact O-N 3.08Å; N209-Y212 PolarHBondContact O-N 2.71Å; N209-A213 PolarHBondContact O-N 2.94Å
210	L	96.4	Very high	94.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-54.3	178.3	-72	164.9	0	0	0	111.1	F184 P206 Y212 A213 F214 A229 M232 V233	F184-L210 HydrophobicContact CD2-CD2 3.87Å; F184-L210 HydrophobicContact CE2-CD2 4Å; P206-L210 WeakPolarHBondContact O-CB 3.21Å; P206-L210 WeakPolarHBondContact O-CD1 3.23Å; P206-L210 VanDerWaalsContact O-CG 3.27Å; P206-L210 WeakPolarHBondContact O-CG 3.44Å; P206-L210 PolarHBondContact O-N 3.28Å; L210-Y212 VanDerWaalsContact C-N 3.3Å; L210-Y212 PolarHBondContact O-N 3.01Å; L210-A213 PolarHBondContact O-N 3.37Å; L210-F214 HydrophobicContact CB-CE2 4.05Å; L210-F214 HydrophobicContact CB-CZ 4Å; L210-F214 HydrophobicContact CD2-CE1 4.1Å; L210-F214 HydrophobicContact CD2-CE2 4.46Å; L210-F214 HydrophobicContact CD2-CZ 3.65Å; L210-F214 HydrophobicContact CG-CZ 4.41Å; L210-F214 WeakPolarHBondContact O-CB 3.38Å; L210-F214 WeakPolarHBondContact O-CD1 3.36Å; L210-F214 WeakPolarHBondContact O-CD2 3.4Å; L210-F214 WeakPolarHBondContact O-CG 3.3Å; L210-F214 PolarHBondContact O-N 3.13Å; L210-A229 HydrophobicContact CB-CB 3.73Å; L210-A229 HydrophobicContact CD1-CB 4.29Å; L210-M232 HydrophobicContact CD1-CB 3.81Å; L210-V233 HydrophobicContact CD1-CG2 3.68Å
211	N	96.9	Very high	94.3	Very high	52 Å²	52	56.3 Å²	56.3	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-39.9	178.2	-80.7	-61.1	0	0	0	112.4	I207 F214 D215 R225 A229	I207-N211 WeakPolarHBondContact CG2-ND2 3.36Å; I207-N211 WeakPolarHBondContact O-CB 3.39Å; I207-N211 PolarHBondContact O-N 3.05Å; I207-N211 VanDerWaalsContact O-N 3.13Å; I207-N211 PolarHBondContact O-ND2 3.12Å; N211-F214 PolarHBondContact O-N 2.7Å; N211-D215 VanDerWaalsContact O-CB 3.27Å; N211-D215 WeakPolarHBondContact O-CB 3.23Å; N211-D215 PolarHBondContact O-N 2.85Å; N211-R225 PolarHBondContact OD1-NH2 2.81Å; N211-A229 VanDerWaalsContact ND2-CB 3.28Å; N211-A229 WeakPolarHBondContact ND2-CB 3.5Å
212	Y	96.4	Very high	94.1	Very high	84 Å²	84	59.8 Å²	59.8	33%	0.329	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-44.3	178	179.4	-138.8	0	0	0	112.3	L195 I196 D197 L201 Q208 N209 L210 F214 V216	L195-Y212 PolarHBondContact O-OH 2.9Å; I196-Y212 WeakPolarHBondContact CA-OH 3.49Å; I196-Y212 HydrophobicContact CB-CE1 4.43Å; I196-Y212 HydrophobicContact CG1-CE1 4.19Å; I196-Y212 HydrophobicContact CG2-CE1 4.06Å; D197-Y212 PolarHBondContact N-OH 2.96Å; L201-Y212 HydrophobicContact CD2-CD1 3.85Å; L201-Y212 HydrophobicContact CD2-CE1 4.16Å; Q208-Y212 VanDerWaalsContact O-CB 3.27Å; Q208-Y212 WeakPolarHBondContact O-CB 3.39Å; Q208-Y212 PolarHBondContact O-N 3.33Å; N209-Y212 PolarHBondContact O-N 2.71Å; L210-Y212 VanDerWaalsContact C-N 3.3Å; L210-Y212 PolarHBondContact O-N 3.01Å; Y212-F214 VanDerWaalsContact C-N 3.35Å; Y212-F214 PolarHBondContact O-N 3.39Å; Y212-V216 HydrophobicContact CD2-CG2 3.85Å; Y212-V216 HydrophobicContact CE2-CG2 3.54Å; Y212-V216 WeakPolarHBondContact O-CB 3.48Å; Y212-V216 VanDerWaalsContact O-CG2 3.29Å; Y212-V216 WeakPolarHBondContact O-CG2 3.39Å; Y212-V216 PolarHBondContact O-N 2.98Å
213	A	96.2	Very high	94.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.7	-45.9	174.1	0	0	0	0	0	111.8	F184 I188 N209 L210 V216 A217	F184-A213 HydrophobicContact CB-CB 3.66Å; I188-A213 HydrophobicContact CD1-CB 4.07Å; N209-A213 PolarHBondContact O-N 2.94Å; L210-A213 PolarHBondContact O-N 3.37Å; A213-V216 PolarHBondContact O-N 3.33Å; A213-A217 WeakPolarHBondContact O-CB 3.48Å; A213-A217 PolarHBondContact O-N 3.49Å
214	F	96.5	Very high	94.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-41.4	-176.8	-57	-10.4	0	0	0	111.7	F184 L210 N211 Y212 A217 E218 R225 L227 A229 Y246	F184-F214 AromaticContact CD2-CE1 3.98Å; F184-F214 HydrophobicContact CD2-CE1 3.98Å; F184-F214 HydrophobicContact CE2-CE1 4.07Å; F184-F214 HydrophobicContact CE2-CZ 4.42Å; F184-F214 HydrophobicContact CG-CE1 4.29Å; F184-F214 HydrophobicContact CZ-CE1 4.46Å; L210-F214 HydrophobicContact CB-CE2 4.05Å; L210-F214 HydrophobicContact CB-CZ 4Å; L210-F214 HydrophobicContact CD2-CE1 4.1Å; L210-F214 HydrophobicContact CD2-CE2 4.46Å; L210-F214 HydrophobicContact CD2-CZ 3.65Å; L210-F214 HydrophobicContact CG-CZ 4.41Å; L210-F214 WeakPolarHBondContact O-CB 3.38Å; L210-F214 WeakPolarHBondContact O-CD1 3.36Å; L210-F214 WeakPolarHBondContact O-CD2 3.4Å; L210-F214 WeakPolarHBondContact O-CG 3.3Å; L210-F214 PolarHBondContact O-N 3.13Å; N211-F214 PolarHBondContact O-N 2.7Å; Y212-F214 VanDerWaalsContact C-N 3.35Å; Y212-F214 PolarHBondContact O-N 3.39Å; F214-A217 PolarHBondContact O-N 2.95Å; F214-E218 WeakPolarHBondContact O-CB 3.35Å; F214-E218 PolarHBondContact O-N 3.3Å; F214-R225 HydrophobicContact CB-CG 4.2Å; F214-L227 WeakPolarHBondContact CD2-O 3.4Å; F214-L227 HydrophobicContact CE2-CB 3.79Å; F214-L227 VanDerWaalsContact CE2-O 3.28Å; F214-L227 WeakPolarHBondContact CE2-O 3.37Å; F214-L227 HydrophobicContact CZ-CB 3.69Å; F214-L227 HydrophobicContact CZ-CD1 4.23Å; F214-A229 HydrophobicContact CE2-CB 4.42Å; F214-Y246 AromaticContact CD1-CE1 3.49Å; F214-Y246 HydrophobicContact CD1-CE1 3.49Å; F214-Y246 VanDerWaalsContact CD1-CE1 3.49Å; F214-Y246 AromaticContact CD1-CZ 3.91Å; F214-Y246 HydrophobicContact CE1-CD1 4.23Å; F214-Y246 AromaticContact CE1-CE1 3.47Å; F214-Y246 HydrophobicContact CE1-CE1 3.47Å; F214-Y246 VanDerWaalsContact CE1-CE1 3.47Å; F214-Y246 HydrophobicContact CG-CE1 4.39Å; F214-Y246 HydrophobicContact CZ-CE1 4.32Å
215	D	95.8	Very high	94.2	Very high	44 Å²	44	51.1 Å²	51.1	24%	0.235	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-44	173.2	-95.4	41.5	0	0	0	112.3	N211 K219 R225	N211-D215 VanDerWaalsContact O-CB 3.27Å; N211-D215 WeakPolarHBondContact O-CB 3.23Å; N211-D215 PolarHBondContact O-N 2.85Å; D215-K219 VanDerWaalsContact O-CB 3.3Å; D215-K219 WeakPolarHBondContact O-CB 3.32Å; D215-K219 WeakPolarHBondContact O-CD 3.22Å; D215-K219 VanDerWaalsContact O-CG 3.24Å; D215-K219 WeakPolarHBondContact O-CG 3.49Å; D215-K219 PolarHBondContact O-N 2.89Å; D215-K219 IonicContact OD2-NZ 2.7Å; D215-K219 PolarHBondContact OD2-NZ 3.46Å; D215-R225 IonicContact OD1-CZ 2.94Å; D215-R225 IonicContact OD1-NH1 2.74Å; D215-R225 PolarHBondContact OD1-NH1 3.34Å; D215-R225 IonicContact OD1-NH2 2.81Å
216	V	95.9	Very high	94.2	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-42	179	167.1	0	0	0	0	110.8	I188 L195 I196 Y212 A213 H220	I188-V216 HydrophobicContact CD1-CG1 4.49Å; I188-V216 HydrophobicContact CG2-CG1 3.96Å; L195-V216 HydrophobicContact CB-CG1 3.75Å; L195-V216 HydrophobicContact CD1-CG1 4.16Å; I196-V216 HydrophobicContact CD1-CG1 4.45Å; I196-V216 HydrophobicContact CG1-CG1 4.16Å; I196-V216 HydrophobicContact CG1-CG2 4.26Å; Y212-V216 HydrophobicContact CD2-CG2 3.85Å; Y212-V216 HydrophobicContact CE2-CG2 3.54Å; Y212-V216 WeakPolarHBondContact O-CB 3.48Å; Y212-V216 VanDerWaalsContact O-CG2 3.29Å; Y212-V216 WeakPolarHBondContact O-CG2 3.39Å; Y212-V216 PolarHBondContact O-N 2.98Å; A213-V216 PolarHBondContact O-N 3.33Å; V216-H220 WeakPolarHBondContact O-CB 3.3Å; V216-H220 PolarHBondContact O-N 3.33Å
217	A	94.7	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-43.4	178.5	0	0	0	0	0	112.3	A213 F214 L221 D222 I223 Y250	A213-A217 WeakPolarHBondContact O-CB 3.48Å; A213-A217 PolarHBondContact O-N 3.49Å; F214-A217 PolarHBondContact O-N 2.95Å; A217-L221 HydrophobicContact CB-CD1 4.47Å; A217-L221 CarbonylContact O-C 3.59Å; A217-L221 WeakPolarHBondContact O-CA 3.42Å; A217-L221 WeakPolarHBondContact O-CB 3.5Å; A217-L221 PolarHBondContact O-N 2.94Å; A217-D222 PolarHBondContact O-N 3.12Å; A217-D222 VanDerWaalsContact O-N 3.16Å; A217-I223 CarbonylContact C-O 3.6Å; A217-I223 HydrophobicContact CB-CB 4.07Å; A217-I223 HydrophobicContact CB-CG2 4.46Å; A217-I223 PolarHBondContact O-N 3.19Å; A217-I223 VanDerWaalsContact O-N 3.14Å; A217-Y250 HydrophobicContact CB-CE1 3.73Å; A217-Y250 WeakPolarHBondContact CB-OH 3.46Å
218	E	94.4	Very high	94.1	Very high	86 Å²	86	46.6 Å²	46.6	40%	0.402	22%	0.221	S	C	.	.	H	α-helix	trans	-68.1	-45.2	177.9	-176.7	168.9	-112.3	0	0	112	F214 I223 R225	F214-E218 WeakPolarHBondContact O-CB 3.35Å; F214-E218 PolarHBondContact O-N 3.3Å; E218-I223 VanDerWaalsContact CA-O 3.22Å; E218-I223 WeakPolarHBondContact CA-O 3.41Å; E218-I223 PolarHBondContact N-O 2.9Å; E218-R225 HydrophobicContact CB-CG 4.16Å; E218-R225 WeakPolarHBondContact OE2-CD 3.32Å
219	K	93	Very high	94	Very high	135 Å²	135	40.6 Å²	40.6	59%	0.587	19%	0.194	S	C	*	.	H	α-helix	trans	-76	-29.7	-175.3	-69.8	166.3	-174.9	161.4	0	114.3	D215	D215-K219 VanDerWaalsContact O-CB 3.3Å; D215-K219 WeakPolarHBondContact O-CB 3.32Å; D215-K219 WeakPolarHBondContact O-CD 3.22Å; D215-K219 VanDerWaalsContact O-CG 3.24Å; D215-K219 WeakPolarHBondContact O-CG 3.49Å; D215-K219 PolarHBondContact O-N 2.89Å; D215-K219 IonicContact OD2-NZ 2.7Å; D215-K219 PolarHBondContact OD2-NZ 3.46Å
220	H	92	Very high	93.7	Very high	112 Å²	112	46 Å²	46	52%	0.519	22%	0.219	S	C	.	.	H	α-helix	trans	-125.8	-16	-168.3	-59.6	-64.8	0	0	0	115.1	L195 V216	L195-H220 HydrophobicContact CD1-CB 3.69Å; L195-H220 HydrophobicContact CD2-CB 3.95Å; L195-H220 HydrophobicContact CG-CB 4.47Å; V216-H220 WeakPolarHBondContact O-CB 3.3Å; V216-H220 PolarHBondContact O-N 3.33Å
221	L	89.4	Confident	93.4	Very high	32 Å²	32	47.1 Å²	47.1	17%	0.168	23%	0.225	C	C	.	.	H	α-helix	trans	-118.3	-1.9	-179.4	-51.4	177.2	0	0	0	113.3	I188 R192 L195 A217 I223 Y250 F254	I188-L221 HydrophobicContact CG1-CD1 4.25Å; I188-L221 HydrophobicContact CG2-CD1 4.44Å; R192-L221 HydrophobicContact CG-CD2 4.33Å; L195-L221 HydrophobicContact CD1-CD2 4.01Å; A217-L221 HydrophobicContact CB-CD1 4.47Å; A217-L221 CarbonylContact O-C 3.59Å; A217-L221 WeakPolarHBondContact O-CA 3.42Å; A217-L221 WeakPolarHBondContact O-CB 3.5Å; A217-L221 PolarHBondContact O-N 2.94Å; L221-I223 HydrophobicContact CB-CD1 3.87Å; L221-I223 HydrophobicContact CB-CG1 3.98Å; L221-I223 HydrophobicContact CD1-CD1 4.14Å; L221-I223 PolarHBondContact O-N 3.47Å; L221-Y250 HydrophobicContact CD1-CD1 4.33Å; L221-Y250 HydrophobicContact CD1-CE1 4.2Å; L221-F254 HydrophobicContact CD1-CE1 3.93Å; L221-F254 HydrophobicContact CD1-CZ 3.6Å; L221-F254 HydrophobicContact CD2-CE1 4.01Å
222	D	88.5	Confident	93.1	Very high	100 Å²	100	44.7 Å²	44.7	54%	0.535	21%	0.211	S	C	.	.			trans	54.6	27.7	-172.7	-167.2	35.8	0	0	0	114.2	R51 A217 P224	R51-D222 IonicContact CZ-OD1 3.66Å; R51-D222 IonicContact CZ-OD2 3.85Å; R51-D222 IonicContact NH1-OD1 3.33Å; R51-D222 PolarHBondContact NH1-OD1 3.36Å; R51-D222 IonicContact NH1-OD2 2.73Å; R51-D222 PolarHBondContact NH2-O 3.03Å; R51-D222 IonicContact NH2-OD1 3.53Å; R51-D222 PolarHBondContact NH2-OD1 2.88Å; R51-D222 VanDerWaalsContact NH2-OD1 3.1Å; R51-D222 IonicContact NH2-OD2 3.43Å; R51-D222 PolarHBondContact NH2-OD2 2.79Å; A217-D222 PolarHBondContact O-N 3.12Å; A217-D222 VanDerWaalsContact O-N 3.16Å; D222-P224 WeakPolarHBondContact O-CD 3.34Å
223	I	91.4	Very high	92.8	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.041	21%	0.205	C	C	.	.			trans	-95.6	105.9	174.5	-58.9	170.8	0	0	0	107.7	A217 E218 L221 Y246 A249 Y250 A253	A217-I223 CarbonylContact C-O 3.6Å; A217-I223 HydrophobicContact CB-CB 4.07Å; A217-I223 HydrophobicContact CB-CG2 4.46Å; A217-I223 PolarHBondContact O-N 3.19Å; A217-I223 VanDerWaalsContact O-N 3.14Å; E218-I223 VanDerWaalsContact CA-O 3.22Å; E218-I223 WeakPolarHBondContact CA-O 3.41Å; E218-I223 PolarHBondContact N-O 2.9Å; L221-I223 HydrophobicContact CB-CD1 3.87Å; L221-I223 HydrophobicContact CB-CG1 3.98Å; L221-I223 HydrophobicContact CD1-CD1 4.14Å; L221-I223 PolarHBondContact O-N 3.47Å; I223-Y246 HydrophobicContact CG2-CD2 4.34Å; I223-Y246 HydrophobicContact CG2-CE2 3.67Å; I223-A249 HydrophobicContact CG2-CB 3.92Å; I223-Y250 HydrophobicContact CD1-CD1 3.51Å; I223-Y250 HydrophobicContact CD1-CD2 4.5Å; I223-Y250 HydrophobicContact CD1-CE1 3.84Å; I223-Y250 HydrophobicContact CD1-CG 3.89Å; I223-A253 HydrophobicContact CD1-CB 3.81Å; I223-A253 HydrophobicContact CG1-CB 4.22Å
224	P	92	Very high	92.3	Very high	27 Å²	27	47.9 Å²	47.9	18%	0.175	24%	0.236	C	C	.	.			trans	-69.7	157.8	-174.7	28.3	-33.5	0	0	0	111.8	S48 D222 M226 Y246	S48-P224 VanDerWaalsContact CB-CG 3.49Å; D222-P224 WeakPolarHBondContact O-CD 3.34Å; P224-M226 HydrophobicContact CG-CE 3.9Å; P224-M226 WeakPolarHBondContact O-CG 3.47Å; P224-M226 PolarHBondContact O-N 3.09Å; P224-Y246 VanDerWaalsContact O-CE2 3.29Å; P224-Y246 WeakPolarHBondContact O-CE2 3.39Å
225	R	94	Very high	91.8	Very high	88 Å²	88	48.3 Å²	48.3	33%	0.332	24%	0.238	S	C	.	.			trans	-71	99.2	-178.3	-59	175.9	65.6	146.2	11.2	111.1	N211 F214 D215 E218	N211-R225 PolarHBondContact OD1-NH2 2.81Å; F214-R225 HydrophobicContact CB-CG 4.2Å; D215-R225 IonicContact OD1-CZ 2.94Å; D215-R225 IonicContact OD1-NH1 2.74Å; D215-R225 PolarHBondContact OD1-NH1 3.34Å; D215-R225 IonicContact OD1-NH2 2.81Å; E218-R225 HydrophobicContact CB-CG 4.16Å; E218-R225 WeakPolarHBondContact OE2-CD 3.32Å
226	M	93.4	Very high	91.2	Very high	7 Å²	7	49.9 Å²	49.9	3%	0.034	25%	0.249	C	C	.	.			trans	-92.9	-28	178.5	-51.8	-178.3	-174.5	0	0	113	T41 A44 W45 P224 T245 Y246 A249	T41-M226 VanDerWaalsContact CA-O 3.25Å; T41-M226 WeakPolarHBondContact CA-O 3.4Å; T41-M226 HydrophobicContact CG2-CB 3.77Å; T41-M226 PolarHBondContact OG1-O 3.14Å; A44-M226 HydrophobicContact CB-CB 4.09Å; A44-M226 HydrophobicContact CB-CG 4.02Å; W45-M226 HydrophobicContact CB-CE 4.27Å; W45-M226 HydrophobicContact CB-SD 3.85Å; W45-M226 HydrophobicContact CG-SD 4.4Å; P224-M226 HydrophobicContact CG-CE 3.9Å; P224-M226 WeakPolarHBondContact O-CG 3.47Å; P224-M226 PolarHBondContact O-N 3.09Å; M226-T245 HydrophobicContact SD-CG2 4.25Å; M226-Y246 HydrophobicContact CB-CD2 3.67Å; M226-Y246 HydrophobicContact CB-CE2 4.23Å; M226-Y246 HydrophobicContact CB-CG 4.33Å; M226-Y246 HydrophobicContact CG-CD2 3.76Å; M226-Y246 HydrophobicContact CG-CE2 4.18Å; M226-Y246 HydrophobicContact SD-CD2 3.95Å; M226-A249 HydrophobicContact CE-CB 4.46Å
227	L	94	Very high	90.7	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.042	26%	0.255	C	S	.	.	S	Bend	trans	-102.8	145.4	178.8	-62.6	177.7	0	0	0	111.6	T41 F184 F214 M232 V243 Y246	T41-L227 HydrophobicContact CG2-CD2 4Å; F184-L227 HydrophobicContact CE2-CD1 4.27Å; F184-L227 HydrophobicContact CZ-CD1 3.77Å; F214-L227 WeakPolarHBondContact CD2-O 3.4Å; F214-L227 HydrophobicContact CE2-CB 3.79Å; F214-L227 VanDerWaalsContact CE2-O 3.28Å; F214-L227 WeakPolarHBondContact CE2-O 3.37Å; F214-L227 HydrophobicContact CZ-CB 3.69Å; F214-L227 HydrophobicContact CZ-CD1 4.23Å; L227-M232 HydrophobicContact CB-CG 4.37Å; L227-M232 HydrophobicContact CD1-SD 3.99Å; L227-M232 HydrophobicContact CD2-SD 4.41Å; L227-V243 HydrophobicContact CD1-CG2 4.29Å; L227-Y246 HydrophobicContact CD1-CD1 3.56Å; L227-Y246 HydrophobicContact CD1-CE1 4.41Å; L227-Y246 HydrophobicContact CD1-CG 4.08Å; L227-Y246 HydrophobicContact CG-CD1 3.9Å; L227-Y246 HydrophobicContact CG-CG 4.07Å
228	D	92.5	Very high	90.6	Very high	55 Å²	55	51.9 Å²	51.9	29%	0.294	26%	0.256	S	S	.	.			trans	-94.7	131.8	170.4	-168.9	-48.9	0	0	0	109.7	K40 E230 D231 M232	K40-D228 HydrophobicContact CD-CB 4.14Å; K40-D228 IonicContact NZ-OD2 3.13Å; K40-D228 PolarHBondContact NZ-OD2 3.1Å; D228-E230 VanDerWaalsContact C-N 3.34Å; D228-E230 WeakPolarHBondContact OD1-CB 3.42Å; D228-E230 PolarHBondContact OD1-N 3.33Å; D228-D231 HydrophobicContact CB-CB 4.01Å; D228-M232 WeakPolarHBondContact O-CB 3.28Å; D228-M232 WeakPolarHBondContact O-CG 3.25Å; D228-M232 PolarHBondContact O-N 3.19Å; D228-M232 VanDerWaalsContact O-N 3.13Å
229	A	93.5	Very high	90.5	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-72.4	-27.4	-177.1	0	0	0	0	0	113	I207 L210 N211 F214 V233	I207-A229 HydrophobicContact CG2-CB 4.23Å; L210-A229 HydrophobicContact CB-CB 3.73Å; L210-A229 HydrophobicContact CD1-CB 4.29Å; N211-A229 VanDerWaalsContact ND2-CB 3.28Å; N211-A229 WeakPolarHBondContact ND2-CB 3.5Å; F214-A229 HydrophobicContact CE2-CB 4.42Å; A229-V233 WeakPolarHBondContact O-CG2 3.42Å; A229-V233 PolarHBondContact O-N 3.18Å
230	E	91.1	Very high	90.5	Very high	118 Å²	118	44.8 Å²	44.8	55%	0.551	23%	0.225	S	C	*	.	H	α-helix	trans	-76.4	-46.6	176.6	-62.3	-173.6	-172.8	0	0	110.1	D228 M232 V233 N234	D228-E230 VanDerWaalsContact C-N 3.34Å; D228-E230 WeakPolarHBondContact OD1-CB 3.42Å; D228-E230 PolarHBondContact OD1-N 3.33Å; E230-M232 VanDerWaalsContact C-N 3.32Å; E230-M232 PolarHBondContact O-N 3.34Å; E230-V233 PolarHBondContact O-N 2.96Å; E230-V233 VanDerWaalsContact O-N 3.16Å; E230-N234 VanDerWaalsContact O-CB 3.24Å; E230-N234 WeakPolarHBondContact O-CB 3.49Å; E230-N234 PolarHBondContact O-N 3.43Å; E230-N234 PolarHBondContact O-ND2 3.05Å
231	D	89.2	Confident	90.6	Very high	23 Å²	23	44 Å²	44	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-44.5	176.1	-63.6	-1	0	0	0	111.5	K40 D228 V233 T235	K40-D231 VanDerWaalsContact CD-OD2 3.25Å; K40-D231 WeakPolarHBondContact CD-OD2 3.46Å; K40-D231 VanDerWaalsContact CE-OD2 3.25Å; K40-D231 WeakPolarHBondContact CE-OD2 3.47Å; K40-D231 IonicContact NZ-OD1 2.7Å; K40-D231 PolarHBondContact NZ-OD1 3.1Å; K40-D231 IonicContact NZ-OD2 3.02Å; K40-D231 PolarHBondContact NZ-OD2 2.94Å; D228-D231 HydrophobicContact CB-CB 4.01Å; D231-V233 VanDerWaalsContact C-N 3.29Å; D231-V233 PolarHBondContact O-N 3.11Å; D231-T235 VanDerWaalsContact O-CB 3.26Å; D231-T235 WeakPolarHBondContact O-CB 3.36Å; D231-T235 PolarHBondContact O-N 2.9Å; D231-T235 VanDerWaalsContact O-N 3.1Å; D231-T235 PolarHBondContact O-OG1 3.46Å
232	M	90.6	Very high	90.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-38.3	177.9	-78.7	-69.2	-62.3	0	0	112.8	Q37 W178 K179 L210 L227 D228 E230 P238 V243	Q37-M232 PolarHBondContact NE2-SD 3.11Å; W178-M232 HydrophobicContact CB-CE 4.27Å; K179-M232 VanDerWaalsContact CE-O 3.26Å; K179-M232 WeakPolarHBondContact CE-O 3.46Å; K179-M232 WeakPolarHBondContact CG-O 3.41Å; L210-M232 HydrophobicContact CD1-CB 3.81Å; L227-M232 HydrophobicContact CB-CG 4.37Å; L227-M232 HydrophobicContact CD1-SD 3.99Å; L227-M232 HydrophobicContact CD2-SD 4.41Å; D228-M232 WeakPolarHBondContact O-CB 3.28Å; D228-M232 WeakPolarHBondContact O-CG 3.25Å; D228-M232 PolarHBondContact O-N 3.19Å; D228-M232 VanDerWaalsContact O-N 3.13Å; E230-M232 VanDerWaalsContact C-N 3.32Å; E230-M232 PolarHBondContact O-N 3.34Å; M232-P238 HydrophobicContact CE-CB 3.95Å; M232-P238 HydrophobicContact CE-CG 4.05Å; M232-P238 HydrophobicContact SD-CB 3.79Å; M232-P238 HydrophobicContact SD-CG 4.32Å; M232-V243 HydrophobicContact CE-CG2 4Å; M232-V243 HydrophobicContact SD-CG2 3.97Å
233	V	90.7	Very high	91.1	Very high	33 Å²	33	37.7 Å²	37.7	20%	0.2	18%	0.184	C	C	.	.	H	α-helix	trans	-88.1	-40.3	-175.4	174.1	0	0	0	0	111.8	K179 P206 I207 L210 A229 E230 D231	K179-V233 WeakPolarHBondContact CE-O 3.46Å; K179-V233 PolarHBondContact NZ-O 3.46Å; P206-V233 HydrophobicContact CB-CG2 3.8Å; P206-V233 HydrophobicContact CG-CG1 4.07Å; P206-V233 HydrophobicContact CG-CG2 3.98Å; I207-V233 HydrophobicContact CD1-CG1 4.49Å; I207-V233 HydrophobicContact CG1-CB 4.08Å; I207-V233 HydrophobicContact CG1-CG1 4.23Å; I207-V233 HydrophobicContact CG1-CG2 3.8Å; L210-V233 HydrophobicContact CD1-CG2 3.68Å; A229-V233 WeakPolarHBondContact O-CG2 3.42Å; A229-V233 PolarHBondContact O-N 3.18Å; E230-V233 PolarHBondContact O-N 2.96Å; E230-V233 VanDerWaalsContact O-N 3.16Å; D231-V233 VanDerWaalsContact C-N 3.29Å; D231-V233 PolarHBondContact O-N 3.11Å
234	N	86.6	Confident	91.3	Very high	119 Å²	119	37.5 Å²	37.5	64%	0.636	18%	0.183	S	C	*	.	H	α-helix	trans	-77.3	-34.2	-174.2	-65.7	-27.2	0	0	0	113.1	E230	E230-N234 VanDerWaalsContact O-CB 3.24Å; E230-N234 WeakPolarHBondContact O-CB 3.49Å; E230-N234 PolarHBondContact O-N 3.43Å; E230-N234 PolarHBondContact O-ND2 3.05Å
235	T	84.2	Confident	91.4	Very high	9 Å²	9	36.2 Å²	36.2	6%	0.055	18%	0.175	C	C	.	.	S	Bend	trans	-67.1	140.3	176.2	-49.6	0	0	0	0	109.9	M33 K179 D231 R237	M33-T235 HydrophobicContact CB-CG2 3.91Å; K179-T235 WeakPolarHBondContact CE-O 3.32Å; K179-T235 PolarHBondContact NZ-O 3.24Å; D231-T235 VanDerWaalsContact O-CB 3.26Å; D231-T235 WeakPolarHBondContact O-CB 3.36Å; D231-T235 PolarHBondContact O-N 2.9Å; D231-T235 VanDerWaalsContact O-N 3.1Å; D231-T235 PolarHBondContact O-OG1 3.46Å; T235-R237 WeakPolarHBondContact CG2-O 3.23Å; T235-R237 PolarHBondContact O-N 2.77Å
236	V	84	Confident	91.5	Very high	76 Å²	76	32 Å²	32	46%	0.461	16%	0.159	S	C	.	.	S	Bend	trans	-55.9	-55.4	179.9	177.8	0	0	0	0	110.6	K179	K179-V236 PolarHBondContact NZ-O 3.33Å
237	R	86.3	Confident	91.6	Very high	50 Å²	50	31.7 Å²	31.7	19%	0.189	16%	0.158	C	C	.	.	S	Bend	trans	-122.1	116.4	175.8	-179.7	179.4	-178.9	-166.7	5.4	109	D25 H175 T235	D25-R237 IonicContact OD1-CZ 3.47Å; D25-R237 IonicContact OD1-NH1 3.29Å; D25-R237 PolarHBondContact OD1-NH1 2.97Å; H175-R237 HydrophobicContact CB-CG 4.05Å; H175-R237 PolarHBondContact NE2-NH2 3.23Å; T235-R237 WeakPolarHBondContact CG2-O 3.23Å; T235-R237 PolarHBondContact O-N 2.77Å
238	P	91	Very high	91.5	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	16%	0.156	C	C	.	.			trans	-57.8	144.7	172.7	-25.1	34.7	0	0	0	111.8	H175 K179 M232 E240 V243	H175-P238 WeakPolarHBondContact CB-O 3.44Å; K179-P238 HydrophobicContact CB-CG 4.3Å; K179-P238 HydrophobicContact CD-CG 4.2Å; K179-P238 HydrophobicContact CG-CG 4.24Å; M232-P238 HydrophobicContact CE-CB 3.95Å; M232-P238 HydrophobicContact CE-CG 4.05Å; M232-P238 HydrophobicContact SD-CB 3.79Å; M232-P238 HydrophobicContact SD-CG 4.32Å; P238-E240 PolarHBondContact O-N 3.09Å; P238-V243 HydrophobicContact CB-CG2 4.41Å
239	D	92.2	Very high	91.5	Very high	20 Å²	20	29.9 Å²	29.9	11%	0.107	15%	0.151	C	C	.	.			trans	-65.8	123.6	179.5	171.8	66.4	0	0	0	112.2	Q37 Q38 R241 S242 V243	Q37-D239 HydrophobicContact CB-CB 4.43Å; Q37-D239 HydrophobicContact CG-CB 4.43Å; Q38-D239 WeakPolarHBondContact CG-OD2 3.09Å; Q38-D239 VanDerWaalsContact NE2-CG 3.33Å; Q38-D239 PolarHBondContact NE2-OD1 3.28Å; Q38-D239 PolarHBondContact NE2-OD2 3.16Å; D239-R241 VanDerWaalsContact C-N 3.32Å; D239-R241 PolarHBondContact O-N 3.11Å; D239-R241 WeakPolarHBondContact OD2-CB 3.34Å; D239-R241 PolarHBondContact OD2-N 3.02Å; D239-S242 PolarHBondContact O-N 3.24Å; D239-S242 WeakPolarHBondContact OD2-CB 3.49Å; D239-S242 PolarHBondContact OD2-N 2.91Å; D239-S242 PolarHBondContact OD2-OG 2.97Å; D239-V243 PolarHBondContact O-N 3.05Å
240	E	93.2	Very high	91.5	Very high	53 Å²	53	29.8 Å²	29.8	25%	0.248	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-41.3	-174.8	-162.6	-166.1	171.2	0	0	111.9	K152 F174 P238 S242 V243 M244	K152-E240 WeakPolarHBondContact CE-OE1 3.47Å; K152-E240 IonicContact NZ-OE1 3.03Å; K152-E240 PolarHBondContact NZ-OE1 2.94Å; K152-E240 IonicContact NZ-OE2 3.99Å; K152-E240 PolarHBondContact NZ-OE2 3.48Å; F174-E240 HydrophobicContact CB-CG 3.61Å; F174-E240 WeakPolarHBondContact O-CA 3.16Å; P238-E240 PolarHBondContact O-N 3.09Å; E240-S242 PolarHBondContact O-N 3.43Å; E240-V243 PolarHBondContact O-N 3.05Å; E240-M244 HydrophobicContact CG-CG 4.45Å; E240-M244 HydrophobicContact CG-SD 4.25Å; E240-M244 WeakPolarHBondContact O-CB 3.46Å; E240-M244 VanDerWaalsContact O-CG 3.32Å; E240-M244 WeakPolarHBondContact O-CG 3.46Å; E240-M244 PolarHBondContact O-N 3.47Å
241	R	94.2	Very high	91.5	Very high	94 Å²	94	25.9 Å²	25.9	36%	0.355	13%	0.131	S	C	.	.	H	α-helix	trans	-65.6	-42.6	-177.1	-63.8	-177.4	177.7	176.9	0.6	111.4	F42 W133 D239 M244 T245	F42-R241 HydrophobicContact CE1-CB 4.48Å; F42-R241 HydrophobicContact CZ-CB 4.05Å; W133-R241 HydrophobicContact CD2-CB 4.03Å; W133-R241 HydrophobicContact CD2-CG 3.78Å; W133-R241 HydrophobicContact CE3-CB 3.61Å; W133-R241 HydrophobicContact CE3-CG 3.89Å; W133-R241 HydrophobicContact CG-CG 4.43Å; W133-R241 HydrophobicContact CH2-CB 4.02Å; W133-R241 HydrophobicContact CH2-CG 3.95Å; W133-R241 HydrophobicContact CZ2-CB 4.42Å; W133-R241 HydrophobicContact CZ2-CG 3.87Å; W133-R241 HydrophobicContact CZ3-CB 3.6Å; W133-R241 HydrophobicContact CZ3-CG 3.97Å; W133-R241 WeakPolarHBondContact CZ3-O 3.4Å; D239-R241 VanDerWaalsContact C-N 3.32Å; D239-R241 PolarHBondContact O-N 3.11Å; D239-R241 WeakPolarHBondContact OD2-CB 3.34Å; D239-R241 PolarHBondContact OD2-N 3.02Å; R241-M244 PolarHBondContact O-N 3.39Å; R241-T245 WeakPolarHBondContact O-CB 3.27Å; R241-T245 PolarHBondContact O-N 3.43Å; R241-T245 PolarHBondContact O-OG1 3.31Å
242	S	94.5	Very high	91.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-46.4	178.1	-62.8	0	0	0	0	111.2	Q38 T41 D239 E240 T245 Y246	Q38-S242 WeakPolarHBondContact CA-OG 3.47Å; T41-S242 WeakPolarHBondContact OG1-CB 3.39Å; T41-S242 PolarHBondContact OG1-OG 3.2Å; D239-S242 PolarHBondContact O-N 3.24Å; D239-S242 WeakPolarHBondContact OD2-CB 3.49Å; D239-S242 PolarHBondContact OD2-N 2.91Å; D239-S242 PolarHBondContact OD2-OG 2.97Å; E240-S242 PolarHBondContact O-N 3.43Å; S242-T245 WeakPolarHBondContact O-CB 3.36Å; S242-T245 PolarHBondContact O-N 3.46Å; S242-Y246 PolarHBondContact O-N 3.05Å; S242-Y246 VanDerWaalsContact O-N 3.14Å
243	V	95.5	Very high	91.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-45	176.8	175.2	0	0	0	0	111.3	F174 W178 F184 L227 M232 P238 D239 E240 T245 Y246 V247	F174-V243 HydrophobicContact CB-CB 4.47Å; F174-V243 HydrophobicContact CB-CG1 4.18Å; F174-V243 HydrophobicContact CD1-CG1 4.45Å; F174-V243 WeakPolarHBondContact O-CB 2.85Å; F174-V243 WeakPolarHBondContact O-CG1 3.15Å; W178-V243 HydrophobicContact CB-CG1 4.15Å; W178-V243 HydrophobicContact CD2-CG1 4.15Å; W178-V243 HydrophobicContact CG-CG1 3.73Å; F184-V243 HydrophobicContact CZ-CG1 4.45Å; L227-V243 HydrophobicContact CD1-CG2 4.29Å; M232-V243 HydrophobicContact CE-CG2 4Å; M232-V243 HydrophobicContact SD-CG2 3.97Å; P238-V243 HydrophobicContact CB-CG2 4.41Å; D239-V243 PolarHBondContact O-N 3.05Å; E240-V243 PolarHBondContact O-N 3.05Å; V243-T245 VanDerWaalsContact C-N 3.32Å; V243-T245 PolarHBondContact O-N 3.42Å; V243-Y246 PolarHBondContact O-N 3.34Å; V243-V247 HydrophobicContact CG1-CG2 3.99Å; V243-V247 WeakPolarHBondContact O-CB 3.41Å; V243-V247 VanDerWaalsContact O-CG2 3.28Å; V243-V247 WeakPolarHBondContact O-CG2 3.28Å; V243-V247 PolarHBondContact O-N 2.98Å
244	M	94.4	Very high	90.8	Very high	5 Å²	5	30 Å²	30	3%	0.025	16%	0.155	C	C	.	.	H	α-helix	trans	-56.2	-45.2	175.1	-78.2	-177.9	68.5	0	0	112.1	W133 I141 K152 F174 E240 R241 Y246 V247 S248	W133-M244 HydrophobicContact CH2-CB 4.13Å; W133-M244 HydrophobicContact CH2-CE 4.14Å; W133-M244 HydrophobicContact CH2-SD 4.03Å; W133-M244 HydrophobicContact CZ3-CB 4.45Å; I141-M244 HydrophobicContact CD1-CB 4.13Å; I141-M244 HydrophobicContact CD1-CE 4.03Å; I141-M244 HydrophobicContact CG2-CE 4.26Å; K152-M244 HydrophobicContact CB-CE 3.97Å; K152-M244 HydrophobicContact CD-CE 4.09Å; K152-M244 HydrophobicContact CD-SD 4.18Å; K152-M244 HydrophobicContact CG-CE 3.81Å; K152-M244 HydrophobicContact CG-SD 4.35Å; F174-M244 HydrophobicContact CB-CG 3.6Å; F174-M244 HydrophobicContact CD1-CG 3.9Å; F174-M244 HydrophobicContact CD2-CG 3.44Å; F174-M244 VanDerWaalsContact CD2-CG 3.44Å; F174-M244 HydrophobicContact CD2-SD 3.87Å; F174-M244 HydrophobicContact CE1-CG 4.4Å; F174-M244 HydrophobicContact CE2-CE 4.46Å; F174-M244 HydrophobicContact CE2-CG 4Å; F174-M244 HydrophobicContact CE2-SD 4.34Å; F174-M244 HydrophobicContact CG-CG 3.38Å; F174-M244 HydrophobicContact CG-SD 4.37Å; F174-M244 HydrophobicContact CZ-CG 4.44Å; E240-M244 HydrophobicContact CG-CG 4.45Å; E240-M244 HydrophobicContact CG-SD 4.25Å; E240-M244 WeakPolarHBondContact O-CB 3.46Å; E240-M244 VanDerWaalsContact O-CG 3.32Å; E240-M244 WeakPolarHBondContact O-CG 3.46Å; E240-M244 PolarHBondContact O-N 3.47Å; R241-M244 PolarHBondContact O-N 3.39Å; M244-Y246 VanDerWaalsContact C-N 3.34Å; M244-Y246 PolarHBondContact O-N 3.3Å; M244-V247 PolarHBondContact O-N 3.47Å; M244-S248 WeakPolarHBondContact O-CB 3.37Å; M244-S248 PolarHBondContact O-N 2.91Å
245	T	94.6	Very high	90.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-54.3	-51.9	175.4	-55.5	0	0	0	0	110.5	T41 W45 I136 M226 R241 S242 V243 S248 A249	T41-T245 HydrophobicContact CG2-CG2 4.5Å; W45-T245 HydrophobicContact CB-CG2 4Å; W45-T245 HydrophobicContact CG-CG2 3.78Å; I136-T245 HydrophobicContact CD1-CG2 3.94Å; I136-T245 HydrophobicContact CG1-CG2 4.45Å; I136-T245 HydrophobicContact CG2-CG2 4.05Å; M226-T245 HydrophobicContact SD-CG2 4.25Å; R241-T245 WeakPolarHBondContact O-CB 3.27Å; R241-T245 PolarHBondContact O-N 3.43Å; R241-T245 PolarHBondContact O-OG1 3.31Å; S242-T245 WeakPolarHBondContact O-CB 3.36Å; S242-T245 PolarHBondContact O-N 3.46Å; V243-T245 VanDerWaalsContact C-N 3.32Å; V243-T245 PolarHBondContact O-N 3.42Å; T245-S248 PolarHBondContact O-N 2.73Å; T245-S248 PolarHBondContact O-OG 2.9Å; T245-A249 PolarHBondContact O-N 2.96Å
246	Y	95.9	Very high	89.3	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-70.1	-40.3	-176.1	-167.3	-128.2	0	0	0	112.9	F184 F214 I223 P224 M226 L227 S242 V243 M244 S248 A249 Y250	F184-Y246 HydrophobicContact CD1-CD1 4.3Å; F184-Y246 HydrophobicContact CD1-CE1 4.29Å; F184-Y246 AromaticContact CE1-CD1 3.55Å; F184-Y246 HydrophobicContact CE1-CD1 3.55Å; F184-Y246 AromaticContact CE1-CE1 3.98Å; F184-Y246 HydrophobicContact CE1-CE1 3.98Å; F184-Y246 AromaticContact CZ-CD1 3.86Å; F184-Y246 HydrophobicContact CZ-CD1 3.86Å; F184-Y246 HydrophobicContact CZ-CE1 4.41Å; F214-Y246 AromaticContact CD1-CE1 3.49Å; F214-Y246 HydrophobicContact CD1-CE1 3.49Å; F214-Y246 VanDerWaalsContact CD1-CE1 3.49Å; F214-Y246 AromaticContact CD1-CZ 3.91Å; F214-Y246 HydrophobicContact CE1-CD1 4.23Å; F214-Y246 AromaticContact CE1-CE1 3.47Å; F214-Y246 HydrophobicContact CE1-CE1 3.47Å; F214-Y246 VanDerWaalsContact CE1-CE1 3.47Å; F214-Y246 HydrophobicContact CG-CE1 4.39Å; F214-Y246 HydrophobicContact CZ-CE1 4.32Å; I223-Y246 HydrophobicContact CG2-CD2 4.34Å; I223-Y246 HydrophobicContact CG2-CE2 3.67Å; P224-Y246 VanDerWaalsContact O-CE2 3.29Å; P224-Y246 WeakPolarHBondContact O-CE2 3.39Å; M226-Y246 HydrophobicContact CB-CD2 3.67Å; M226-Y246 HydrophobicContact CB-CE2 4.23Å; M226-Y246 HydrophobicContact CB-CG 4.33Å; M226-Y246 HydrophobicContact CG-CD2 3.76Å; M226-Y246 HydrophobicContact CG-CE2 4.18Å; M226-Y246 HydrophobicContact SD-CD2 3.95Å; L227-Y246 HydrophobicContact CD1-CD1 3.56Å; L227-Y246 HydrophobicContact CD1-CE1 4.41Å; L227-Y246 HydrophobicContact CD1-CG 4.08Å; L227-Y246 HydrophobicContact CG-CD1 3.9Å; L227-Y246 HydrophobicContact CG-CG 4.07Å; S242-Y246 PolarHBondContact O-N 3.05Å; S242-Y246 VanDerWaalsContact O-N 3.14Å; V243-Y246 PolarHBondContact O-N 3.34Å; M244-Y246 VanDerWaalsContact C-N 3.34Å; M244-Y246 PolarHBondContact O-N 3.3Å; Y246-S248 VanDerWaalsContact C-N 3.33Å; Y246-S248 PolarHBondContact O-N 2.7Å; Y246-A249 WeakPolarHBondContact O-CB 3.47Å; Y246-A249 PolarHBondContact O-N 2.94Å; Y246-Y250 AromaticContact CD1-CE2 3.86Å; Y246-Y250 HydrophobicContact CD1-CE2 3.86Å; Y246-Y250 AromaticContact CE1-CE2 3.51Å; Y246-Y250 HydrophobicContact CE1-CE2 3.51Å; Y246-Y250 HydrophobicContact CE2-CE2 4.21Å; Y246-Y250 HydrophobicContact CG-CE2 4.36Å; Y246-Y250 AromaticContact CZ-CE2 3.69Å; Y246-Y250 AromaticContact CZ-CZ 3.97Å; Y246-Y250 VanDerWaalsContact O-CD2 3.31Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.43Å; Y246-Y250 PolarHBondContact OH-OH 3.09Å
247	V	95.1	Very high	88.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-35	175.9	175.4	0	0	0	0	111.8	L155 C159 F174 W178 F184 V243 M244 A249 Y250 Y251	L155-V247 HydrophobicContact CD1-CG1 4.21Å; L155-V247 HydrophobicContact CG-CG1 4.39Å; C159-V247 WeakPolarHBondContact SG-CG1 3.45Å; F174-V247 HydrophobicContact CE1-CB 4.42Å; F174-V247 HydrophobicContact CE1-CG1 4.07Å; W178-V247 HydrophobicContact CD2-CG2 4.13Å; W178-V247 HydrophobicContact CE3-CG2 3.98Å; W178-V247 HydrophobicContact CH2-CB 4.44Å; W178-V247 HydrophobicContact CH2-CG1 3.85Å; W178-V247 HydrophobicContact CH2-CG2 3.6Å; W178-V247 HydrophobicContact CZ2-CG1 4.06Å; W178-V247 HydrophobicContact CZ2-CG2 3.76Å; W178-V247 HydrophobicContact CZ3-CG2 3.72Å; F184-V247 HydrophobicContact CE1-CG2 3.71Å; F184-V247 HydrophobicContact CZ-CG2 4.24Å; V243-V247 HydrophobicContact CG1-CG2 3.99Å; V243-V247 WeakPolarHBondContact O-CB 3.41Å; V243-V247 VanDerWaalsContact O-CG2 3.28Å; V243-V247 WeakPolarHBondContact O-CG2 3.28Å; V243-V247 PolarHBondContact O-N 2.98Å; M244-V247 PolarHBondContact O-N 3.47Å; V247-A249 VanDerWaalsContact C-N 3.27Å; V247-A249 PolarHBondContact O-N 3.22Å; V247-Y250 PolarHBondContact O-N 3.04Å; V247-Y251 PolarHBondContact O-N 2.97Å
248	S	92.7	Very high	87.2	Confident	2 Å²	2	29 Å²	29	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-32.3	174.5	79.4	0	0	0	0	112.7	M244 T245 Y246 Y251 H252	M244-S248 WeakPolarHBondContact O-CB 3.37Å; M244-S248 PolarHBondContact O-N 2.91Å; T245-S248 PolarHBondContact O-N 2.73Å; T245-S248 PolarHBondContact O-OG 2.9Å; Y246-S248 VanDerWaalsContact C-N 3.33Å; Y246-S248 PolarHBondContact O-N 2.7Å; S248-Y251 WeakPolarHBondContact O-CB 3.45Å; S248-Y251 PolarHBondContact O-N 3.42Å; S248-H252 PolarHBondContact O-CD2 3.29Å; S248-H252 PolarHBondContact O-N 3.23Å
249	A	92.3	Very high	86.1	Confident	23 Å²	23	36 Å²	36	19%	0.19	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-39	175.2	0	0	0	0	0	112	I223 M226 T245 Y246 V247 A253	I223-A249 HydrophobicContact CG2-CB 3.92Å; M226-A249 HydrophobicContact CE-CB 4.46Å; T245-A249 PolarHBondContact O-N 2.96Å; Y246-A249 WeakPolarHBondContact O-CB 3.47Å; Y246-A249 PolarHBondContact O-N 2.94Å; V247-A249 VanDerWaalsContact C-N 3.27Å; V247-A249 PolarHBondContact O-N 3.22Å; A249-A253 WeakPolarHBondContact O-CB 3.3Å; A249-A253 PolarHBondContact O-N 3.43Å; A249-A253 VanDerWaalsContact O-N 3.09Å
250	Y	93	Very high	85	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-38.6	171	-70.3	-84.5	0	0	0	112.5	F184 L187 I188 A217 L221 I223 Y246 V247 A253 F254	F184-Y250 HydrophobicContact CD1-CD2 4.46Å; F184-Y250 AromaticContact CD1-CE2 3.86Å; F184-Y250 HydrophobicContact CD1-CE2 3.86Å; F184-Y250 HydrophobicContact CE1-CE2 4.15Å; L187-Y250 HydrophobicContact CD2-CG 4.14Å; I188-Y250 HydrophobicContact CD1-CE1 3.69Å; I188-Y250 HydrophobicContact CG1-CD1 4.09Å; I188-Y250 HydrophobicContact CG1-CE1 3.55Å; A217-Y250 HydrophobicContact CB-CE1 3.73Å; A217-Y250 WeakPolarHBondContact CB-OH 3.46Å; L221-Y250 HydrophobicContact CD1-CD1 4.33Å; L221-Y250 HydrophobicContact CD1-CE1 4.2Å; I223-Y250 HydrophobicContact CD1-CD1 3.51Å; I223-Y250 HydrophobicContact CD1-CD2 4.5Å; I223-Y250 HydrophobicContact CD1-CE1 3.84Å; I223-Y250 HydrophobicContact CD1-CG 3.89Å; Y246-Y250 AromaticContact CD1-CE2 3.86Å; Y246-Y250 HydrophobicContact CD1-CE2 3.86Å; Y246-Y250 AromaticContact CE1-CE2 3.51Å; Y246-Y250 HydrophobicContact CE1-CE2 3.51Å; Y246-Y250 HydrophobicContact CE2-CE2 4.21Å; Y246-Y250 HydrophobicContact CG-CE2 4.36Å; Y246-Y250 AromaticContact CZ-CE2 3.69Å; Y246-Y250 AromaticContact CZ-CZ 3.97Å; Y246-Y250 VanDerWaalsContact O-CD2 3.31Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.43Å; Y246-Y250 PolarHBondContact OH-OH 3.09Å; V247-Y250 PolarHBondContact O-N 3.04Å; Y250-A253 PolarHBondContact O-N 3.49Å; Y250-F254 AromaticContact CD1-CE2 3.86Å; Y250-F254 HydrophobicContact CD1-CE2 3.86Å; Y250-F254 HydrophobicContact CD1-CZ 4.27Å; Y250-F254 HydrophobicContact CG-CE2 4.49Å; Y250-F254 WeakPolarHBondContact O-CB 3.43Å; Y250-F254 WeakPolarHBondContact O-CD2 3.31Å; Y250-F254 WeakPolarHBondContact O-CG 3.45Å; Y250-F254 PolarHBondContact O-N 2.77Å
251	Y	90.9	Very high	83.9	Confident	35 Å²	35	39.1 Å²	39.1	14%	0.137	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-52.3	175.7	178.5	-88.7	0	0	0	110.9	I144 V146 L155 W158 V247 S248 A253 F254 A255	I144-Y251 HydrophobicContact CB-CE1 4.25Å; I144-Y251 HydrophobicContact CD1-CD1 3.62Å; I144-Y251 HydrophobicContact CD1-CE1 4.1Å; I144-Y251 HydrophobicContact CD1-CG 3.96Å; I144-Y251 HydrophobicContact CG1-CD1 3.77Å; I144-Y251 HydrophobicContact CG1-CE1 3.72Å; I144-Y251 HydrophobicContact CG1-CG 4.48Å; I144-Y251 HydrophobicContact CG2-CD1 4.27Å; I144-Y251 HydrophobicContact CG2-CD2 4.24Å; I144-Y251 HydrophobicContact CG2-CE1 3.85Å; I144-Y251 HydrophobicContact CG2-CE2 3.83Å; I144-Y251 HydrophobicContact CG2-CG 4.46Å; V146-Y251 HydrophobicContact CG2-CE2 4.24Å; L155-Y251 HydrophobicContact CD1-CD2 4Å; L155-Y251 HydrophobicContact CD1-CG 4.02Å; W158-Y251 HydrophobicContact CB-CD2 4.41Å; W158-Y251 HydrophobicContact CB-CE2 4.36Å; W158-Y251 AromaticContact CD1-CD2 3.94Å; W158-Y251 AromaticContact CD1-CE2 3.7Å; W158-Y251 AromaticContact CD2-CD2 3.53Å; W158-Y251 HydrophobicContact CD2-CD2 3.53Å; W158-Y251 HydrophobicContact CD2-CE2 4.09Å; W158-Y251 AromaticContact CE2-CD2 3.62Å; W158-Y251 AromaticContact CE3-CD2 3.86Å; W158-Y251 HydrophobicContact CE3-CD2 3.86Å; W158-Y251 AromaticContact CG-CD2 3.76Å; W158-Y251 HydrophobicContact CG-CD2 3.76Å; W158-Y251 AromaticContact CG-CE2 3.84Å; W158-Y251 HydrophobicContact CG-CE2 3.84Å; W158-Y251 HydrophobicContact CH2-CD2 4.37Å; W158-Y251 HydrophobicContact CZ2-CD2 4.09Å; W158-Y251 HydrophobicContact CZ3-CD2 4.25Å; W158-Y251 AromaticContact NE1-CD2 3.84Å; W158-Y251 AromaticContact NE1-CE2 3.86Å; V247-Y251 PolarHBondContact O-N 2.97Å; S248-Y251 WeakPolarHBondContact O-CB 3.45Å; S248-Y251 PolarHBondContact O-N 3.42Å; Y251-A253 PolarHBondContact O-N 3.38Å; Y251-F254 PolarHBondContact O-N 3.49Å; Y251-A255 HydrophobicContact CD1-CB 4.36Å; Y251-A255 HydrophobicContact CE1-CB 4.02Å; Y251-A255 WeakPolarHBondContact O-CB 3.32Å; Y251-A255 PolarHBondContact O-N 2.91Å
252	H	86.4	Confident	82.7	Confident	82 Å²	82	37.8 Å²	37.8	38%	0.38	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-42.5	-179.3	-70.5	-55.4	0	0	0	112.9	C140 S248 F254	C140-H252 PolarHBondContact O-NE2 3.16Å; S248-H252 PolarHBondContact O-CD2 3.29Å; S248-H252 PolarHBondContact O-N 3.23Å; H252-F254 VanDerWaalsContact C-N 3.32Å; H252-F254 PolarHBondContact O-N 2.95Å
253	A	84.7	Confident	81.9	Confident	47 Å²	47	38 Å²	38	39%	0.388	22%	0.224	S	C	.	.	H	α-helix	trans	-60.8	-38.1	177.1	0	0	0	0	0	112.9	I223 A249 Y250 Y251	I223-A253 HydrophobicContact CD1-CB 3.81Å; I223-A253 HydrophobicContact CG1-CB 4.22Å; A249-A253 WeakPolarHBondContact O-CB 3.3Å; A249-A253 PolarHBondContact O-N 3.43Å; A249-A253 VanDerWaalsContact O-N 3.09Å; Y250-A253 PolarHBondContact O-N 3.49Å; Y251-A253 PolarHBondContact O-N 3.38Å
254	F	85.4	Confident	81	Confident	15 Å²	15	38.4 Å²	38.4	7%	0.066	23%	0.227	C	C	.	.	H	α-helix	trans	-90.1	-25.8	-179.1	-63.2	-42.4	0	0	0	114.3	W158 L187 I188 H191 R192 L221 Y250 Y251 H252 G256 A257	W158-F254 HydrophobicContact CH2-CD2 4.08Å; W158-F254 HydrophobicContact CZ2-CB 4.18Å; W158-F254 HydrophobicContact CZ2-CD2 4.23Å; L187-F254 HydrophobicContact CG-CE2 4.35Å; I188-F254 HydrophobicContact CG1-CZ 4.45Å; H191-F254 HydrophobicContact CB-CD1 3.54Å; H191-F254 HydrophobicContact CB-CD2 4.21Å; H191-F254 HydrophobicContact CB-CE1 3.62Å; H191-F254 HydrophobicContact CB-CE2 4.27Å; H191-F254 HydrophobicContact CB-CG 3.87Å; H191-F254 HydrophobicContact CB-CZ 4Å; H191-F254 AromaticContact CD2-CG 3.91Å; H191-F254 AromaticContact CE1-CD2 3.71Å; H191-F254 AromaticContact CG-CD1 3.8Å; H191-F254 AromaticContact CG-CD2 3.75Å; H191-F254 AromaticContact CG-CG 3.56Å; H191-F254 AromaticContact ND1-CD2 3.34Å; H191-F254 VanDerWaalsContact ND1-CD2 3.34Å; H191-F254 WeakPolarHBondContact ND1-CD2 3.37Å; H191-F254 AromaticContact ND1-CE2 3.67Å; H191-F254 AromaticContact ND1-CG 3.66Å; R192-F254 HydrophobicContact CG-CE1 4.34Å; L221-F254 HydrophobicContact CD1-CE1 3.93Å; L221-F254 HydrophobicContact CD1-CZ 3.6Å; L221-F254 HydrophobicContact CD2-CE1 4.01Å; Y250-F254 AromaticContact CD1-CE2 3.86Å; Y250-F254 HydrophobicContact CD1-CE2 3.86Å; Y250-F254 HydrophobicContact CD1-CZ 4.27Å; Y250-F254 HydrophobicContact CG-CE2 4.49Å; Y250-F254 WeakPolarHBondContact O-CB 3.43Å; Y250-F254 WeakPolarHBondContact O-CD2 3.31Å; Y250-F254 WeakPolarHBondContact O-CG 3.45Å; Y250-F254 PolarHBondContact O-N 2.77Å; Y251-F254 PolarHBondContact O-N 3.49Å; H252-F254 VanDerWaalsContact C-N 3.32Å; H252-F254 PolarHBondContact O-N 2.95Å; F254-G256 VanDerWaalsContact C-N 3.29Å; F254-G256 PolarHBondContact O-N 2.83Å; F254-A257 PolarHBondContact O-N 3.27Å
255	A	73.3	Confident	80	Confident	20 Å²	20	42.8 Å²	42.8	17%	0.165	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-30	178.8	0	0	0	0	0	112.9	Y251 A257 Q258 K259	Y251-A255 HydrophobicContact CD1-CB 4.36Å; Y251-A255 HydrophobicContact CE1-CB 4.02Å; Y251-A255 WeakPolarHBondContact O-CB 3.32Å; Y251-A255 PolarHBondContact O-N 2.91Å; A255-A257 VanDerWaalsContact C-N 3.35Å; A255-A257 PolarHBondContact O-N 3.11Å; A255-Q258 PolarHBondContact O-N 3.02Å; A255-K259 PolarHBondContact O-N 2.7Å
256	G	65.7	Low	79.3	Confident	44 Å²	44	47.8 Å²	47.8	45%	0.454	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-41.9	175.2	0	0	0	0	0	113.3	F254 Q258 K259 A260	F254-G256 VanDerWaalsContact C-N 3.29Å; F254-G256 PolarHBondContact O-N 2.83Å; G256-Q258 PolarHBondContact O-N 2.98Å; G256-K259 PolarHBondContact O-N 3Å; G256-A260 PolarHBondContact O-N 2.99Å
257	A	62.6	Low	78.7	Confident	67 Å²	67	47.8 Å²	47.8	55%	0.554	27%	0.269	S	S	*	.	H	α-helix	trans	-65.1	-39.1	-178.8	0	0	0	0	0	112.9	F254 A255 K259 A260 E261	F254-A257 PolarHBondContact O-N 3.27Å; A255-A257 VanDerWaalsContact C-N 3.35Å; A255-A257 PolarHBondContact O-N 3.11Å; A257-K259 VanDerWaalsContact C-N 3.28Å; A257-K259 PolarHBondContact O-N 3.31Å; A257-A260 PolarHBondContact O-N 3.32Å; A257-E261 PolarHBondContact O-N 3.5Å; A257-E261 VanDerWaalsContact O-N 3.12Å
258	Q	63.6	Low	78	Confident	102 Å²	102	48.8 Å²	48.8	48%	0.477	28%	0.276	S	S	.	.	H	α-helix	trans	-67.3	-28.7	-179.7	-171.1	173.8	-22.5	0	0	112.6	A255 G256 S262	A255-Q258 PolarHBondContact O-N 3.02Å; G256-Q258 PolarHBondContact O-N 2.98Å; Q258-S262 WeakPolarHBondContact O-CB 3.22Å; Q258-S262 PolarHBondContact O-N 3.49Å; Q258-S262 VanDerWaalsContact O-N 3.15Å; Q258-S262 PolarHBondContact O-OG 3.38Å
259	K	67.7	Low	77.3	Confident	146 Å²	146	56 Å²	56	64%	0.635	31%	0.306	S	S	*	.	H	α-helix	trans	-67.4	-43.1	172.8	-67.9	-179.3	179.3	179.2	0	111.5	A255 G256 A257 S262 A263 T841	A255-K259 PolarHBondContact O-N 2.7Å; G256-K259 PolarHBondContact O-N 3Å; A257-K259 VanDerWaalsContact C-N 3.28Å; A257-K259 PolarHBondContact O-N 3.31Å; K259-S262 PolarHBondContact O-N 3.13Å; K259-A263 WeakPolarHBondContact O-CB 3.23Å; K259-A263 PolarHBondContact O-N 3.48Å; K259-T841 HydrophobicContact CB-CG2 4.08Å
260	A	69.8	Low	76.9	Confident	17 Å²	17	55 Å²	55	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-47.8	177	0	0	0	0	0	112	G256 A257 S262 A263 A264 L842	G256-A260 PolarHBondContact O-N 2.99Å; A257-A260 PolarHBondContact O-N 3.32Å; A260-S262 VanDerWaalsContact C-N 3.31Å; A260-S262 PolarHBondContact O-N 3.18Å; A260-A263 WeakPolarHBondContact O-CB 3.08Å; A260-A263 PolarHBondContact O-N 3.2Å; A260-A263 VanDerWaalsContact O-N 3.13Å; A260-A264 PolarHBondContact O-N 3.46Å; A260-L842 HydrophobicContact CB-CD2 4.32Å; A260-L842 WeakPolarHBondContact O-CD2 3.41Å
261	E	69.3	Low	76.5	Confident	123 Å²	123	55 Å²	55	58%	0.575	30%	0.299	S	S	*	.	H	α-helix	trans	-57.8	-42.3	175.8	-176.3	-178.2	-170.2	0	0	112.2	A257 A263 A264 N265	A257-E261 PolarHBondContact O-N 3.5Å; A257-E261 VanDerWaalsContact O-N 3.12Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 3.38Å; E261-A264 PolarHBondContact O-N 2.9Å; E261-N265 WeakPolarHBondContact O-CB 3.25Å; E261-N265 PolarHBondContact O-N 3.05Å; E261-N265 PolarHBondContact O-ND2 2.92Å
262	S	69.7	Low	76.1	Confident	66 Å²	66	57.1 Å²	57.1	46%	0.462	31%	0.308	S	S	.	.	H	α-helix	trans	-65.2	-38	177.4	-57.9	0	0	0	0	112.3	Q258 K259 A260 R266	Q258-S262 WeakPolarHBondContact O-CB 3.22Å; Q258-S262 PolarHBondContact O-N 3.49Å; Q258-S262 VanDerWaalsContact O-N 3.15Å; Q258-S262 PolarHBondContact O-OG 3.38Å; K259-S262 PolarHBondContact O-N 3.13Å; A260-S262 VanDerWaalsContact C-N 3.31Å; A260-S262 PolarHBondContact O-N 3.18Å; S262-R266 PolarHBondContact O-N 2.77Å
263	A	76.9	Confident	75.8	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.033	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-43.5	175.8	0	0	0	0	0	112.4	K259 A260 E261 N265 R266 I267 S838 T841 L842	K259-A263 WeakPolarHBondContact O-CB 3.23Å; K259-A263 PolarHBondContact O-N 3.48Å; A260-A263 WeakPolarHBondContact O-CB 3.08Å; A260-A263 PolarHBondContact O-N 3.2Å; A260-A263 VanDerWaalsContact O-N 3.13Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 3.38Å; A263-N265 PolarHBondContact O-N 2.94Å; A263-R266 PolarHBondContact O-N 2.91Å; A263-I267 WeakPolarHBondContact O-CG1 3.43Å; A263-I267 PolarHBondContact O-N 2.96Å; A263-S838 WeakPolarHBondContact CB-O 3.39Å; A263-T841 HydrophobicContact CB-CG2 3.99Å; A263-L842 HydrophobicContact CB-CD2 4.16Å; A263-L842 HydrophobicContact CB-CG 4.34Å
264	A	76.3	Confident	75.8	Confident	9 Å²	9	54.2 Å²	54.2	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-43.9	175.3	0	0	0	0	0	112	A260 E261 I267 T268 L842 E857 L858	A260-A264 PolarHBondContact O-N 3.46Å; E261-A264 PolarHBondContact O-N 2.9Å; A264-I267 PolarHBondContact O-N 3.06Å; A264-T268 VanDerWaalsContact O-CB 3.29Å; A264-T268 WeakPolarHBondContact O-CB 3.32Å; A264-T268 PolarHBondContact O-N 3.42Å; A264-T268 PolarHBondContact O-OG1 3.31Å; A264-L842 HydrophobicContact CB-CD2 4.07Å; A264-E857 WeakPolarHBondContact CB-O 3.33Å; A264-L858 HydrophobicContact CB-CD2 4.16Å
265	N	73.5	Confident	75.8	Confident	97 Å²	97	56.1 Å²	56.1	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-40.7	176.2	-80.7	-50.7	0	0	0	112.6	E261 A263 K269	E261-N265 WeakPolarHBondContact O-CB 3.25Å; E261-N265 PolarHBondContact O-N 3.05Å; E261-N265 PolarHBondContact O-ND2 2.92Å; A263-N265 PolarHBondContact O-N 2.94Å; N265-K269 PolarHBondContact O-N 3.26Å; N265-K269 VanDerWaalsContact O-N 3.15Å
266	R	79.7	Confident	76.4	Confident	104 Å²	104	59.3 Å²	59.3	39%	0.392	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-52.2	174.7	-168.5	-177	-65.7	127.8	-6	110.6	S262 A263 T268 K269 V270 S838	S262-R266 PolarHBondContact O-N 2.77Å; A263-R266 PolarHBondContact O-N 2.91Å; R266-T268 VanDerWaalsContact C-N 3.32Å; R266-T268 PolarHBondContact O-N 3.45Å; R266-K269 WeakPolarHBondContact O-CB 3.45Å; R266-K269 PolarHBondContact O-N 2.79Å; R266-K269 VanDerWaalsContact O-N 3.1Å; R266-V270 WeakPolarHBondContact O-CG2 3.43Å; R266-V270 PolarHBondContact O-N 2.95Å; R266-V270 VanDerWaalsContact O-N 3.17Å; R266-S838 WeakPolarHBondContact CD-OG 3.44Å; R266-S838 PolarHBondContact NH1-OG 3.39Å
267	I	84.3	Confident	77.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-56.2	-46.4	178.9	-73.1	161.4	0	0	0	111.1	A263 A264 K269 V270 L271 M835 F839 L842 L858	A263-I267 WeakPolarHBondContact O-CG1 3.43Å; A263-I267 PolarHBondContact O-N 2.96Å; A264-I267 PolarHBondContact O-N 3.06Å; I267-K269 VanDerWaalsContact C-N 3.3Å; I267-K269 PolarHBondContact O-N 3.35Å; I267-V270 PolarHBondContact O-N 3.26Å; I267-L271 HydrophobicContact CG2-CD1 3.56Å; I267-L271 HydrophobicContact CG2-CG 4.1Å; I267-L271 VanDerWaalsContact O-CG 3.29Å; I267-L271 WeakPolarHBondContact O-CG 3.41Å; I267-L271 PolarHBondContact O-N 2.87Å; I267-M835 HydrophobicContact CB-CE 4.09Å; I267-M835 HydrophobicContact CG1-CE 3.84Å; I267-M835 HydrophobicContact CG1-SD 3.87Å; I267-M835 HydrophobicContact CG2-CE 3.92Å; I267-F839 HydrophobicContact CD1-CD1 3.57Å; I267-F839 HydrophobicContact CD1-CD2 4.3Å; I267-F839 HydrophobicContact CD1-CE1 3.75Å; I267-F839 HydrophobicContact CD1-CE2 4.48Å; I267-F839 HydrophobicContact CD1-CG 3.85Å; I267-F839 HydrophobicContact CD1-CZ 4.21Å; I267-F839 HydrophobicContact CG1-CD1 4.45Å; I267-F839 HydrophobicContact CG1-CE1 4.27Å; I267-F839 HydrophobicContact CG1-CE2 4.42Å; I267-F839 HydrophobicContact CG1-CZ 4.25Å; I267-F839 HydrophobicContact CG2-CE1 3.96Å; I267-F839 HydrophobicContact CG2-CZ 3.88Å; I267-L842 HydrophobicContact CD1-CD1 3.46Å; I267-L842 VanDerWaalsContact CD1-CD1 3.46Å; I267-L842 HydrophobicContact CD1-CG 4.17Å; I267-L858 HydrophobicContact CB-CD2 4.4Å; I267-L858 HydrophobicContact CG2-CD1 4.1Å; I267-L858 HydrophobicContact CG2-CD2 3.98Å
268	T	80.3	Confident	78.6	Confident	22 Å²	22	56.2 Å²	56.2	14%	0.135	28%	0.279	C	S	.	.	H	α-helix	trans	-54.7	-42.9	176.8	-68.8	0	0	0	0	112.6	A264 R266 K272 L862	A264-T268 VanDerWaalsContact O-CB 3.29Å; A264-T268 WeakPolarHBondContact O-CB 3.32Å; A264-T268 PolarHBondContact O-N 3.42Å; A264-T268 PolarHBondContact O-OG1 3.31Å; R266-T268 VanDerWaalsContact C-N 3.32Å; R266-T268 PolarHBondContact O-N 3.45Å; T268-K272 HydrophobicContact CG2-CD 4.02Å; T268-K272 WeakPolarHBondContact O-CB 3.47Å; T268-K272 WeakPolarHBondContact O-CG 3.38Å; T268-K272 PolarHBondContact O-N 2.88Å; T268-L862 HydrophobicContact CG2-CD1 3.73Å
269	K	78.3	Confident	79.9	Confident	152 Å²	152	56.4 Å²	56.4	66%	0.661	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-46.3	177.4	-169.4	-174.9	179.5	-173.3	0	112.1	N265 R266 I267 S273	N265-K269 PolarHBondContact O-N 3.26Å; N265-K269 VanDerWaalsContact O-N 3.15Å; R266-K269 WeakPolarHBondContact O-CB 3.45Å; R266-K269 PolarHBondContact O-N 2.79Å; R266-K269 VanDerWaalsContact O-N 3.1Å; I267-K269 VanDerWaalsContact C-N 3.3Å; I267-K269 PolarHBondContact O-N 3.35Å; K269-S273 WeakPolarHBondContact O-CB 3.43Å; K269-S273 PolarHBondContact O-N 2.8Å; K269-S273 VanDerWaalsContact O-N 3.11Å
270	V	82.9	Confident	80.9	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-43.7	-179.7	-178.4	0	0	0	0	111.4	R266 I267 S273 N274 D830 M835 L893 Y894	R266-V270 WeakPolarHBondContact O-CG2 3.43Å; R266-V270 PolarHBondContact O-N 2.95Å; R266-V270 VanDerWaalsContact O-N 3.17Å; I267-V270 PolarHBondContact O-N 3.26Å; V270-S273 PolarHBondContact O-N 2.82Å; V270-N274 WeakPolarHBondContact O-CB 3.49Å; V270-N274 PolarHBondContact O-N 3.5Å; V270-D830 VanDerWaalsContact CG2-OD1 3.28Å; V270-D830 WeakPolarHBondContact CG2-OD1 3.48Å; V270-D830 WeakPolarHBondContact CG2-OD2 3.31Å; V270-M835 HydrophobicContact CB-CE 3.84Å; V270-M835 HydrophobicContact CB-SD 3.96Å; V270-M835 HydrophobicContact CG1-CE 3.88Å; V270-M835 HydrophobicContact CG1-SD 4.04Å; V270-M835 HydrophobicContact CG2-CE 4.39Å; V270-M835 HydrophobicContact CG2-SD 3.85Å; V270-L893 HydrophobicContact CG1-CD1 4.47Å; V270-Y894 WeakPolarHBondContact CG1-OH 3.33Å
271	L	85	Confident	81.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-46.6	-179.2	-65.1	175	0	0	0	112.1	I267 S273 N274 Q275 M835 L862 Y865 C866 F889 L893	I267-L271 HydrophobicContact CG2-CD1 3.56Å; I267-L271 HydrophobicContact CG2-CG 4.1Å; I267-L271 VanDerWaalsContact O-CG 3.29Å; I267-L271 WeakPolarHBondContact O-CG 3.41Å; I267-L271 PolarHBondContact O-N 2.87Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 3.23Å; L271-N274 PolarHBondContact O-N 2.85Å; L271-N274 VanDerWaalsContact O-N 3.11Å; L271-Q275 WeakPolarHBondContact O-CG 3.47Å; L271-Q275 PolarHBondContact O-N 3.16Å; L271-M835 HydrophobicContact CD2-CE 4.44Å; L271-M835 HydrophobicContact CG-CE 4.43Å; L271-L862 HydrophobicContact CB-CD2 3.92Å; L271-L862 HydrophobicContact CD1-CB 4.29Å; L271-L862 HydrophobicContact CD1-CD2 4.46Å; L271-Y865 HydrophobicContact CD2-CD1 4.1Å; L271-Y865 HydrophobicContact CD2-CE1 4.02Å; L271-C866 VanDerWaalsContact CD1-SG 3.51Å; L271-F889 HydrophobicContact CD2-CE1 3.92Å; L271-F889 HydrophobicContact CD2-CZ 3.76Å; L271-L893 HydrophobicContact CD2-CD1 4.29Å
272	K	82.3	Confident	83	Confident	79 Å²	79	54.5 Å²	54.5	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-37.8	176.4	-74.3	178.7	174.7	172.2	0	111.7	T268 N276 E859 L862	T268-K272 HydrophobicContact CG2-CD 4.02Å; T268-K272 WeakPolarHBondContact O-CB 3.47Å; T268-K272 WeakPolarHBondContact O-CG 3.38Å; T268-K272 PolarHBondContact O-N 2.88Å; K272-N276 VanDerWaalsContact O-CG 3.29Å; K272-N276 PolarHBondContact O-N 3.44Å; K272-N276 PolarHBondContact O-ND2 2.83Å; K272-N276 VanDerWaalsContact O-ND2 3.16Å; K272-E859 WeakPolarHBondContact CE-OE2 3.48Å; K272-E859 IonicContact NZ-OE1 3.63Å; K272-E859 PolarHBondContact NZ-OE1 3.33Å; K272-E859 IonicContact NZ-OE2 2.73Å; K272-E859 PolarHBondContact NZ-OE2 3.43Å; K272-L862 HydrophobicContact CG-CD1 4.29Å; K272-L862 HydrophobicContact CG-CD2 4.22Å
273	S	81.2	Confident	84.1	Confident	51 Å²	51	54.5 Å²	54.5	36%	0.357	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-43.4	173	-172.4	0	0	0	0	112.5	K269 V270 L271 N276 N277	K269-S273 WeakPolarHBondContact O-CB 3.43Å; K269-S273 PolarHBondContact O-N 2.8Å; K269-S273 VanDerWaalsContact O-N 3.11Å; V270-S273 PolarHBondContact O-N 2.82Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 3.23Å; S273-N276 PolarHBondContact O-N 3.19Å; S273-N277 PolarHBondContact O-N 3.41Å
274	N	84.2	Confident	84.9	Confident	17 Å²	17	54.3 Å²	54.3	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-47.1	178.7	-176.3	-123.3	0	0	0	112.4	V270 L271 N276 N277 E278 R355 Y865 L893	V270-N274 WeakPolarHBondContact O-CB 3.49Å; V270-N274 PolarHBondContact O-N 3.5Å; L271-N274 PolarHBondContact O-N 2.85Å; L271-N274 VanDerWaalsContact O-N 3.11Å; N274-N276 VanDerWaalsContact C-N 3.28Å; N274-N276 PolarHBondContact O-N 2.9Å; N274-N277 PolarHBondContact O-N 2.69Å; N274-E278 WeakPolarHBondContact O-CG 3.48Å; N274-E278 PolarHBondContact O-N 3Å; N274-R355 PolarHBondContact ND2-NH1 3.15Å; N274-R355 VanDerWaalsContact ND2-NH1 3.14Å; N274-Y865 PolarHBondContact OD1-OH 3.49Å; N274-L893 HydrophobicContact CB-CD2 4.24Å; N274-L893 WeakPolarHBondContact OD1-CD2 3.37Å
275	Q	85.2	Confident	85.7	Confident	54 Å²	54	55.7 Å²	55.7	25%	0.252	26%	0.259	S	S	.	.	H	α-helix	trans	-56.6	-39.4	175.6	-73.3	178	-27.4	0	0	112.8	L271 E278 K279 Y865	L271-Q275 WeakPolarHBondContact O-CG 3.47Å; L271-Q275 PolarHBondContact O-N 3.16Å; Q275-E278 PolarHBondContact O-N 3.41Å; Q275-K279 PolarHBondContact O-N 2.94Å; Q275-Y865 HydrophobicContact CG-CD2 4.02Å; Q275-Y865 HydrophobicContact CG-CE1 4.16Å; Q275-Y865 HydrophobicContact CG-CE2 3.61Å; Q275-Y865 HydrophobicContact CG-CG 4.43Å; Q275-Y865 VanDerWaalsContact NE2-CG 3.32Å
276	N	85.8	Confident	86.7	Confident	87 Å²	87	58 Å²	58	47%	0.465	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-40.1	175.6	-76.9	-28.6	0	0	0	112.5	K272 S273 N274 K279 L280	K272-N276 VanDerWaalsContact O-CG 3.29Å; K272-N276 PolarHBondContact O-N 3.44Å; K272-N276 PolarHBondContact O-ND2 2.83Å; K272-N276 VanDerWaalsContact O-ND2 3.16Å; S273-N276 PolarHBondContact O-N 3.19Å; N274-N276 VanDerWaalsContact C-N 3.28Å; N274-N276 PolarHBondContact O-N 2.9Å; N276-K279 WeakPolarHBondContact O-CB 3.24Å; N276-K279 PolarHBondContact O-N 3.35Å; N276-L280 PolarHBondContact O-N 3.12Å
277	N	87.1	Confident	87.4	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-39.9	176.1	-66.6	-15.5	0	0	0	111.3	S273 N274 K279 L280 M281 L346 L350	S273-N277 PolarHBondContact O-N 3.41Å; N274-N277 PolarHBondContact O-N 2.69Å; N277-K279 VanDerWaalsContact C-N 3.28Å; N277-K279 PolarHBondContact O-N 2.91Å; N277-L280 PolarHBondContact O-N 3.24Å; N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.27Å; N277-M281 PolarHBondContact O-N 3.46Å; N277-L346 HydrophobicContact CB-CD1 4.01Å; N277-L350 HydrophobicContact CB-CD2 4.4Å
278	E	87.9	Confident	88	Confident	44 Å²	44	54.9 Å²	54.9	21%	0.206	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-23.8	175.5	-64.7	-174.1	140.4	0	0	114	N274 Q275 M281 R282 Y865 R869	N274-E278 WeakPolarHBondContact O-CG 3.48Å; N274-E278 PolarHBondContact O-N 3Å; Q275-E278 PolarHBondContact O-N 3.41Å; E278-M281 HydrophobicContact CG-SD 4.48Å; E278-R282 WeakPolarHBondContact O-CG 3.45Å; E278-R282 PolarHBondContact O-N 3.48Å; E278-R282 PolarHBondContact O-NE 3.26Å; E278-R282 VanDerWaalsContact O-NE 3.08Å; E278-Y865 PolarHBondContact OE2-OH 3.34Å; E278-R869 IonicContact OE1-CZ 2.72Å; E278-R869 IonicContact OE1-NH1 2.79Å; E278-R869 PolarHBondContact OE1-NH1 3.38Å; E278-R869 IonicContact OE1-NH2 3.67Å; E278-R869 PolarHBondContact OE1-NH2 3.12Å; E278-R869 IonicContact OE2-CZ 3.37Å; E278-R869 IonicContact OE2-NH1 3.1Å; E278-R869 IonicContact OE2-NH2 3.99Å; E278-R869 PolarHBondContact OE2-NH2 3.42Å
279	K	89.9	Confident	88.7	Confident	105 Å²	105	56.4 Å²	56.4	46%	0.457	27%	0.269	S	S	.	.	H	α-helix	trans	-68.8	-50.2	169.3	-168.8	-176.4	-177.9	-99.1	0	110.2	Q275 N276 N277 M281 R282 E283	Q275-K279 PolarHBondContact O-N 2.94Å; N276-K279 WeakPolarHBondContact O-CB 3.24Å; N276-K279 PolarHBondContact O-N 3.35Å; N277-K279 VanDerWaalsContact C-N 3.28Å; N277-K279 PolarHBondContact O-N 2.91Å; K279-M281 VanDerWaalsContact C-N 3.32Å; K279-M281 PolarHBondContact O-N 3.02Å; K279-R282 PolarHBondContact O-N 2.89Å; K279-R282 VanDerWaalsContact O-N 3.15Å; K279-E283 VanDerWaalsContact CE-OE1 3.29Å; K279-E283 WeakPolarHBondContact CE-OE1 3.41Å; K279-E283 IonicContact NZ-OE1 3.78Å; K279-E283 PolarHBondContact NZ-OE1 2.99Å; K279-E283 IonicContact NZ-OE2 2.8Å; K279-E283 WeakPolarHBondContact O-CG 3.35Å; K279-E283 PolarHBondContact O-N 2.96Å
280	L	89.5	Confident	89.5	Confident	28 Å²	28	52.8 Å²	52.8	15%	0.147	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-38.2	177.5	-68	170.5	0	0	0	112.6	N276 N277 E283 Y284 T342 L346	N276-L280 PolarHBondContact O-N 3.12Å; N277-L280 PolarHBondContact O-N 3.24Å; L280-E283 PolarHBondContact O-N 3.46Å; L280-Y284 WeakPolarHBondContact O-CB 3.49Å; L280-Y284 PolarHBondContact O-N 3.37Å; L280-T342 HydrophobicContact CB-CG2 4.44Å; L280-T342 HydrophobicContact CD2-CG2 4.2Å; L280-L346 HydrophobicContact CB-CD1 4.18Å
281	M	91.6	Very high	90.2	Very high	50 Å²	50	52.7 Å²	52.7	25%	0.246	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-46.8	173.5	-71.7	167	177.8	0	0	112	N277 E278 K279 Y284 E285 L346 L350 F358	N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.27Å; N277-M281 PolarHBondContact O-N 3.46Å; E278-M281 HydrophobicContact CG-SD 4.48Å; K279-M281 VanDerWaalsContact C-N 3.32Å; K279-M281 PolarHBondContact O-N 3.02Å; M281-Y284 PolarHBondContact O-N 3.48Å; M281-E285 WeakPolarHBondContact O-CG 3.27Å; M281-E285 PolarHBondContact O-N 3.31Å; M281-E285 VanDerWaalsContact O-N 3.09Å; M281-L346 HydrophobicContact CB-CD2 4.37Å; M281-L346 HydrophobicContact CE-CD1 4.27Å; M281-L346 HydrophobicContact CG-CD1 4.22Å; M281-L346 HydrophobicContact CG-CD2 3.55Å; M281-L346 HydrophobicContact CG-CG 4.48Å; M281-L350 HydrophobicContact CE-CD1 3.89Å; M281-L350 HydrophobicContact CE-CD2 4.17Å; M281-F358 HydrophobicContact CB-CD2 4.43Å; M281-F358 HydrophobicContact CB-CE2 4.13Å; M281-F358 HydrophobicContact CE-CB 4.35Å; M281-F358 HydrophobicContact CE-CD2 4.22Å; M281-F358 HydrophobicContact CG-CD2 3.73Å; M281-F358 HydrophobicContact CG-CE2 3.93Å; M281-F358 HydrophobicContact CG-CG 4.23Å; M281-F358 HydrophobicContact SD-CD2 4.32Å
282	R	91.9	Very high	90.7	Very high	168 Å²	168	54.2 Å²	54.2	63%	0.634	26%	0.264	S	S	*	.	H	α-helix	trans	-69.4	-37.6	178.8	-73.4	178.8	-69.1	149.2	-4.2	112.7	E278 K279 E285 Q286	E278-R282 WeakPolarHBondContact O-CG 3.45Å; E278-R282 PolarHBondContact O-N 3.48Å; E278-R282 PolarHBondContact O-NE 3.26Å; E278-R282 VanDerWaalsContact O-NE 3.08Å; K279-R282 PolarHBondContact O-N 2.89Å; K279-R282 VanDerWaalsContact O-N 3.15Å; R282-E285 PolarHBondContact O-N 2.92Å; R282-Q286 VanDerWaalsContact O-CB 3.32Å; R282-Q286 WeakPolarHBondContact O-CB 3.48Å; R282-Q286 PolarHBondContact O-N 2.75Å
283	E	92.4	Very high	91.3	Very high	66 Å²	66	52.9 Å²	52.9	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-42.2	175.1	-73.2	170.1	167.9	0	0	110.9	K279 L280 L287	K279-E283 VanDerWaalsContact CE-OE1 3.29Å; K279-E283 WeakPolarHBondContact CE-OE1 3.41Å; K279-E283 IonicContact NZ-OE1 3.78Å; K279-E283 PolarHBondContact NZ-OE1 2.99Å; K279-E283 IonicContact NZ-OE2 2.8Å; K279-E283 WeakPolarHBondContact O-CG 3.35Å; K279-E283 PolarHBondContact O-N 2.96Å; L280-E283 PolarHBondContact O-N 3.46Å; E283-L287 WeakPolarHBondContact O-CB 3.37Å; E283-L287 VanDerWaalsContact O-CG 3.26Å; E283-L287 WeakPolarHBondContact O-CG 3.25Å; E283-L287 PolarHBondContact O-N 2.95Å
284	Y	94.9	Very high	92	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-53.7	172.7	179.7	-82.4	0	0	0	112.3	L280 M281 Q286 L287 A288 L339 Y343 F358 P360 H364 I366	L280-Y284 WeakPolarHBondContact O-CB 3.49Å; L280-Y284 PolarHBondContact O-N 3.37Å; M281-Y284 PolarHBondContact O-N 3.48Å; Y284-Q286 VanDerWaalsContact C-N 3.31Å; Y284-Q286 PolarHBondContact O-N 3.27Å; Y284-L287 PolarHBondContact O-N 3.12Å; Y284-A288 HydrophobicContact CE1-CB 4.29Å; Y284-A288 WeakPolarHBondContact O-CB 3.44Å; Y284-A288 PolarHBondContact O-N 2.94Å; Y284-L339 HydrophobicContact CD2-CD2 4.18Å; Y284-L339 HydrophobicContact CD2-CG 3.91Å; Y284-L339 HydrophobicContact CE2-CD1 4.49Å; Y284-L339 HydrophobicContact CE2-CD2 3.42Å; Y284-L339 VanDerWaalsContact CE2-CD2 3.42Å; Y284-L339 HydrophobicContact CE2-CG 3.66Å; Y284-Y343 HydrophobicContact CD2-CD2 4.32Å; Y284-Y343 AromaticContact CE2-CD2 3.84Å; Y284-Y343 HydrophobicContact CE2-CD2 3.84Å; Y284-Y343 HydrophobicContact CE2-CG 4.13Å; Y284-F358 AromaticContact CD1-CE1 3.58Å; Y284-F358 HydrophobicContact CD1-CE1 3.58Å; Y284-F358 AromaticContact CD1-CZ 3.95Å; Y284-F358 HydrophobicContact CD1-CZ 3.95Å; Y284-F358 HydrophobicContact CE1-CE1 4.08Å; Y284-F358 AromaticContact CG-CE1 3.9Å; Y284-F358 HydrophobicContact CG-CE1 3.9Å; Y284-P360 HydrophobicContact CD1-CG 4.38Å; Y284-P360 HydrophobicContact CE1-CB 3.76Å; Y284-P360 HydrophobicContact CE1-CG 3.57Å; Y284-H364 WeakPolarHBondContact CE1-O 3.36Å; Y284-H364 PolarHBondContact OH-O 3.02Å; Y284-I366 HydrophobicContact CE2-CG1 4.46Å
285	E	92.9	Very high	92.5	Very high	38 Å²	38	50.6 Å²	50.6	18%	0.178	25%	0.25	C	S	.	.	H	α-helix	trans	-61	-38.9	-177.8	-72.6	-69.3	161.5	0	0	112.4	M281 R282 S289 F358 P360 T361 H364	M281-E285 WeakPolarHBondContact O-CG 3.27Å; M281-E285 PolarHBondContact O-N 3.31Å; M281-E285 VanDerWaalsContact O-N 3.09Å; R282-E285 PolarHBondContact O-N 2.92Å; E285-S289 WeakPolarHBondContact O-CB 3.49Å; E285-S289 PolarHBondContact O-N 2.76Å; E285-S289 PolarHBondContact O-OG 3.36Å; E285-F358 HydrophobicContact CG-CZ 4.27Å; E285-P360 VanDerWaalsContact OE1-CA 3.31Å; E285-P360 WeakPolarHBondContact OE1-CA 3.46Å; E285-T361 VanDerWaalsContact CD-OG1 3.23Å; E285-T361 PolarHBondContact OE1-N 3.46Å; E285-T361 PolarHBondContact OE1-OG1 3.13Å; E285-T361 WeakPolarHBondContact OE2-CB 3.37Å; E285-T361 PolarHBondContact OE2-OG1 3.21Å; E285-H364 IonicContact OE2-CE1 2.69Å; E285-H364 IonicContact OE2-CG 3.56Å; E285-H364 IonicContact OE2-ND1 3.88Å; E285-H364 PolarHBondContact OE2-ND1 2.69Å
286	Q	94.2	Very high	93	Very high	146 Å²	146	55 Å²	55	68%	0.682	27%	0.271	S	S	*	.	H	α-helix	trans	-67	-45	177.1	-176.1	176.4	-9.3	0	0	111.9	R282 Y284 S289 D290	R282-Q286 VanDerWaalsContact O-CB 3.32Å; R282-Q286 WeakPolarHBondContact O-CB 3.48Å; R282-Q286 PolarHBondContact O-N 2.75Å; Y284-Q286 VanDerWaalsContact C-N 3.31Å; Y284-Q286 PolarHBondContact O-N 3.27Å; Q286-S289 PolarHBondContact O-N 2.87Å; Q286-D290 PolarHBondContact O-N 2.79Å; Q286-D290 VanDerWaalsContact O-N 3.1Å
287	L	94.3	Very high	93.5	Very high	39 Å²	39	57.7 Å²	57.7	20%	0.204	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-39.9	176.9	-72.5	169.2	0	0	0	111.6	E283 Y284 L291 E335 L338 L339	E283-L287 WeakPolarHBondContact O-CB 3.37Å; E283-L287 VanDerWaalsContact O-CG 3.26Å; E283-L287 WeakPolarHBondContact O-CG 3.25Å; E283-L287 PolarHBondContact O-N 2.95Å; Y284-L287 PolarHBondContact O-N 3.12Å; L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 PolarHBondContact O-N 3.21Å; L287-E335 HydrophobicContact CD2-CG 4.49Å; L287-L338 HydrophobicContact CD1-CD2 4.06Å; L287-L338 HydrophobicContact CD1-CG 4.19Å; L287-L339 HydrophobicContact CB-CD1 4.05Å
288	A	95.4	Very high	93.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-48.2	177.1	0	0	0	0	0	111.2	Y284 L292 L339 H364 I369	Y284-A288 HydrophobicContact CE1-CB 4.29Å; Y284-A288 WeakPolarHBondContact O-CB 3.44Å; Y284-A288 PolarHBondContact O-N 2.94Å; A288-L292 WeakPolarHBondContact O-CB 3.42Å; A288-L292 VanDerWaalsContact O-CG 3.3Å; A288-L292 WeakPolarHBondContact O-CG 3.43Å; A288-L292 PolarHBondContact O-N 3.42Å; A288-L339 VanDerWaalsContact CA-CD1 3.48Å; A288-L339 HydrophobicContact CB-CD1 3.83Å; A288-H364 HydrophobicContact CB-CB 3.93Å; A288-I369 HydrophobicContact CB-CD1 4.08Å
289	S	95.7	Very high	94.1	Very high	53 Å²	53	57.5 Å²	57.5	37%	0.371	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-47	179.9	-56.9	0	0	0	0	112.4	E285 Q286 A293 H364	E285-S289 WeakPolarHBondContact O-CB 3.49Å; E285-S289 PolarHBondContact O-N 2.76Å; E285-S289 PolarHBondContact O-OG 3.36Å; Q286-S289 PolarHBondContact O-N 2.87Å; S289-A293 VanDerWaalsContact O-CB 3.28Å; S289-A293 WeakPolarHBondContact O-CB 3.43Å; S289-A293 PolarHBondContact O-N 3.42Å; S289-H364 PolarHBondContact OG-CE1 3.37Å
290	D	96.2	Very high	94.3	Very high	77 Å²	77	56.6 Å²	56.6	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-68.5	-39.8	-178.6	-169.9	58.9	0	0	0	112	Q286 W294 R332	Q286-D290 PolarHBondContact O-N 2.79Å; Q286-D290 VanDerWaalsContact O-N 3.1Å; D290-W294 WeakPolarHBondContact O-CB 3.43Å; D290-W294 PolarHBondContact O-N 2.91Å; D290-R332 IonicContact OD1-NH2 3.23Å; D290-R332 IonicContact OD2-CZ 3.63Å; D290-R332 VanDerWaalsContact OD2-CZ 3.24Å; D290-R332 IonicContact OD2-NH1 2.71Å; D290-R332 PolarHBondContact OD2-NH1 3.49Å; D290-R332 IonicContact OD2-NH2 3.73Å; D290-R332 PolarHBondContact OD2-NH2 3.3Å
291	L	95.7	Very high	94.5	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-66.2	-45.5	178.4	-175.4	62.6	0	0	0	111.8	L287 W294 I295 R332 K336 I369 W373	L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 PolarHBondContact O-N 3.21Å; L291-W294 HydrophobicContact CD1-CE3 4.49Å; L291-W294 PolarHBondContact O-N 3.44Å; L291-I295 HydrophobicContact CG-CD1 4.36Å; L291-I295 VanDerWaalsContact O-CG1 3.3Å; L291-I295 WeakPolarHBondContact O-CG1 3.3Å; L291-I295 PolarHBondContact O-N 3.3Å; L291-R332 HydrophobicContact CD1-CB 4.11Å; L291-K336 HydrophobicContact CD2-CB 3.81Å; L291-K336 HydrophobicContact CD2-CG 4.15Å; L291-I369 HydrophobicContact CD2-CG2 3.71Å; L291-W373 HydrophobicContact CD1-CE3 4.45Å; L291-W373 HydrophobicContact CD1-CZ3 4.06Å
292	L	95.8	Very high	94.6	Very high	32 Å²	32	55.5 Å²	55.5	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-45.5	177.4	-72	168.3	0	0	0	111.6	A288 W294 I295 E296 G363 I369 A372	A288-L292 WeakPolarHBondContact O-CB 3.42Å; A288-L292 VanDerWaalsContact O-CG 3.3Å; A288-L292 WeakPolarHBondContact O-CG 3.43Å; A288-L292 PolarHBondContact O-N 3.42Å; L292-W294 VanDerWaalsContact C-N 3.29Å; L292-W294 PolarHBondContact O-N 3.5Å; L292-I295 PolarHBondContact O-N 3.34Å; L292-I295 VanDerWaalsContact O-N 3.15Å; L292-E296 PolarHBondContact O-N 3.31Å; L292-G363 WeakPolarHBondContact CD1-O 3.4Å; L292-I369 HydrophobicContact CD1-CG1 4.34Å; L292-I369 HydrophobicContact CD2-CG1 4.16Å; L292-I369 HydrophobicContact CG-CG1 4.27Å; L292-A372 HydrophobicContact CD2-CB 3.91Å
293	A	95.5	Very high	94.6	Very high	52 Å²	52	53.4 Å²	53.4	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-39	176	0	0	0	0	0	112.3	S289 Q297	S289-A293 VanDerWaalsContact O-CB 3.28Å; S289-A293 WeakPolarHBondContact O-CB 3.43Å; S289-A293 PolarHBondContact O-N 3.42Å; A293-Q297 WeakPolarHBondContact O-CB 3.32Å; A293-Q297 PolarHBondContact O-N 3.48Å
294	W	96.5	Very high	94.7	Very high	17 Å²	17	53 Å²	53	6%	0.064	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-42.9	173.9	178.1	84.8	0	0	0	112.3	D290 L291 L292 E296 Q297 Q298 Y324 K329 R332 W373 L376	D290-W294 WeakPolarHBondContact O-CB 3.43Å; D290-W294 PolarHBondContact O-N 2.91Å; L291-W294 HydrophobicContact CD1-CE3 4.49Å; L291-W294 PolarHBondContact O-N 3.44Å; L292-W294 VanDerWaalsContact C-N 3.29Å; L292-W294 PolarHBondContact O-N 3.5Å; W294-E296 PolarHBondContact O-N 3.36Å; W294-Q297 PolarHBondContact O-N 2.9Å; W294-Q298 HydrophobicContact CD2-CG 4.09Å; W294-Q298 HydrophobicContact CG-CG 4.48Å; W294-Q298 HydrophobicContact CZ2-CG 3.98Å; W294-Q298 VanDerWaalsContact O-CG 3.25Å; W294-Q298 WeakPolarHBondContact O-CG 3.4Å; W294-Q298 PolarHBondContact O-N 2.81Å; W294-Q298 VanDerWaalsContact O-N 3.15Å; W294-Y324 AromaticContact CH2-CE2 3.91Å; W294-Y324 HydrophobicContact CH2-CE2 3.91Å; W294-Y324 HydrophobicContact CZ2-CD2 4.4Å; W294-Y324 AromaticContact CZ2-CE2 3.55Å; W294-Y324 HydrophobicContact CZ2-CE2 3.55Å; W294-K329 HydrophobicContact CH2-CB 4.14Å; W294-K329 HydrophobicContact CH2-CG 4.25Å; W294-K329 HydrophobicContact CZ2-CB 4.44Å; W294-R332 HydrophobicContact CD2-CB 4.41Å; W294-R332 HydrophobicContact CD2-CG 3.72Å; W294-R332 HydrophobicContact CE3-CB 4.09Å; W294-R332 HydrophobicContact CE3-CG 3.92Å; W294-R332 HydrophobicContact CG-CG 4.29Å; W294-R332 HydrophobicContact CH2-CB 4.04Å; W294-R332 HydrophobicContact CH2-CG 4.01Å; W294-R332 HydrophobicContact CZ2-CB 4.34Å; W294-R332 HydrophobicContact CZ2-CG 3.8Å; W294-R332 HydrophobicContact CZ3-CB 3.91Å; W294-R332 HydrophobicContact CZ3-CG 4.07Å; W294-W373 HydrophobicContact CZ3-CH2 4.41Å; W294-W373 AromaticContact CZ3-CZ3 3.9Å; W294-W373 HydrophobicContact CZ3-CZ3 3.9Å; W294-L376 HydrophobicContact CH2-CD2 4Å; W294-L376 HydrophobicContact CZ3-CD2 3.62Å
295	I	95.3	Very high	94.5	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-48.5	175.8	-66.9	166.8	0	0	0	110.3	L291 L292 Q297 Q298 I299 A372 W373 L376	L291-I295 HydrophobicContact CG-CD1 4.36Å; L291-I295 VanDerWaalsContact O-CG1 3.3Å; L291-I295 WeakPolarHBondContact O-CG1 3.3Å; L291-I295 PolarHBondContact O-N 3.3Å; L292-I295 PolarHBondContact O-N 3.34Å; L292-I295 VanDerWaalsContact O-N 3.15Å; I295-Q297 VanDerWaalsContact C-N 3.29Å; I295-Q297 PolarHBondContact O-N 3.11Å; I295-Q298 PolarHBondContact O-N 3.42Å; I295-Q298 VanDerWaalsContact O-N 3.16Å; I295-I299 HydrophobicContact CG2-CD1 3.79Å; I295-I299 HydrophobicContact CG2-CG1 4.37Å; I295-I299 WeakPolarHBondContact O-CG1 3.43Å; I295-I299 PolarHBondContact O-N 3.49Å; I295-I299 VanDerWaalsContact O-N 3.15Å; I295-A372 HydrophobicContact CD1-CB 3.89Å; I295-A372 HydrophobicContact CG2-CB 4.24Å; I295-W373 HydrophobicContact CD1-CE3 4.22Å; I295-L376 HydrophobicContact CG1-CD2 4.47Å; I295-L376 HydrophobicContact CG2-CB 4.37Å; I295-L376 HydrophobicContact CG2-CD1 4.43Å
296	E	94.8	Very high	94.4	Very high	147 Å²	147	59.4 Å²	59.4	69%	0.687	31%	0.306	S	S	*	.	H	α-helix	trans	-59.9	-37.5	178.2	-71.4	-169.4	162.4	0	0	112.7	L292 W294 Q298 P300	L292-E296 PolarHBondContact O-N 3.31Å; W294-E296 PolarHBondContact O-N 3.36Å; E296-Q298 PolarHBondContact O-N 2.91Å; E296-P300 WeakPolarHBondContact O-CD 3.33Å
297	Q	95.4	Very high	94.1	Very high	142 Å²	142	54.5 Å²	54.5	66%	0.664	29%	0.286	S	S	*	.	H	α-helix	trans	-66.5	-33.6	176.9	-175.7	-179.2	-12.4	0	0	113	A293 W294 I295	A293-Q297 WeakPolarHBondContact O-CB 3.32Å; A293-Q297 PolarHBondContact O-N 3.48Å; W294-Q297 PolarHBondContact O-N 2.9Å; I295-Q297 VanDerWaalsContact C-N 3.29Å; I295-Q297 PolarHBondContact O-N 3.11Å
298	Q	94.2	Very high	93.7	Very high	19 Å²	19	57.6 Å²	57.6	9%	0.089	30%	0.303	C	S	.	.	H	α-helix	trans	-86.4	-30.1	-174.2	-63.2	-68.7	-12.3	0	0	113.3	W294 I295 E296 F301 L302 Y324 E328 L376	W294-Q298 HydrophobicContact CD2-CG 4.09Å; W294-Q298 HydrophobicContact CG-CG 4.48Å; W294-Q298 HydrophobicContact CZ2-CG 3.98Å; W294-Q298 VanDerWaalsContact O-CG 3.25Å; W294-Q298 WeakPolarHBondContact O-CG 3.4Å; W294-Q298 PolarHBondContact O-N 2.81Å; W294-Q298 VanDerWaalsContact O-N 3.15Å; I295-Q298 PolarHBondContact O-N 3.42Å; I295-Q298 VanDerWaalsContact O-N 3.16Å; E296-Q298 PolarHBondContact O-N 2.91Å; Q298-F301 PolarHBondContact O-N 3.14Å; Q298-L302 HydrophobicContact CB-CD1 4.35Å; Q298-L302 PolarHBondContact O-N 3.31Å; Q298-L302 VanDerWaalsContact O-N 3.1Å; Q298-Y324 HydrophobicContact CB-CE2 4.24Å; Q298-Y324 HydrophobicContact CG-CE2 3.85Å; Q298-E328 PolarHBondContact NE2-OE2 3.36Å; Q298-L376 HydrophobicContact CB-CD1 3.99Å
299	I	93.7	Very high	93.1	Very high	25 Å²	25	59 Å²	59	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-52.6	-45.1	-179.8	-76.1	165.9	0	0	0	113.5	I295 F301 L302 K303 L376 Y379	I295-I299 HydrophobicContact CG2-CD1 3.79Å; I295-I299 HydrophobicContact CG2-CG1 4.37Å; I295-I299 WeakPolarHBondContact O-CG1 3.43Å; I295-I299 PolarHBondContact O-N 3.49Å; I295-I299 VanDerWaalsContact O-N 3.15Å; I299-F301 PolarHBondContact O-N 3.02Å; I299-L302 PolarHBondContact O-N 3.27Å; I299-K303 WeakPolarHBondContact O-CB 3.33Å; I299-K303 PolarHBondContact O-N 3.37Å; I299-L376 HydrophobicContact CG1-CD1 4.32Å; I299-Y379 HydrophobicContact CG1-CD2 4.14Å; I299-Y379 HydrophobicContact CG1-CE2 4.36Å; I299-Y379 HydrophobicContact CG2-CD2 4.09Å; I299-Y379 HydrophobicContact CG2-CE2 3.75Å
300	P	94.4	Very high	92.8	Very high	86 Å²	86	59.3 Å²	59.3	56%	0.558	32%	0.317	S	S	*	.	H	α-helix	trans	-57	-43.8	178.2	-28.2	35.6	0	0	0	114.1	E296 K303 D304	E296-P300 WeakPolarHBondContact O-CD 3.33Å; P300-K303 PolarHBondContact O-N 2.85Å; P300-D304 PolarHBondContact O-N 3.3Å; P300-D304 VanDerWaalsContact O-N 3.15Å
301	F	93.7	Very high	92.4	Very high	55 Å²	55	57 Å²	57	24%	0.241	30%	0.304	C	S	.	.	H	α-helix	trans	-66	-47.4	176.9	173.5	-103.5	0	0	0	111.1	Q298 I299 K303 D304 K317 H320 Y321 F383	Q298-F301 PolarHBondContact O-N 3.14Å; I299-F301 PolarHBondContact O-N 3.02Å; F301-K303 PolarHBondContact O-N 3.42Å; F301-D304 PolarHBondContact O-N 3.22Å; F301-K317 HydrophobicContact CE2-CG 4.43Å; F301-K317 HydrophobicContact CZ-CG 4.49Å; F301-H320 HydrophobicContact CZ-CB 4.23Å; F301-Y321 HydrophobicContact CE1-CD2 4.46Å; F301-F383 HydrophobicContact CE1-CE1 4.45Å; F301-F383 HydrophobicContact CE1-CE2 4.23Å; F301-F383 AromaticContact CE1-CZ 3.86Å; F301-F383 HydrophobicContact CE1-CZ 3.86Å; F301-F383 HydrophobicContact CE2-CZ 4.39Å; F301-F383 HydrophobicContact CZ-CE2 4.29Å; F301-F383 AromaticContact CZ-CZ 3.73Å; F301-F383 HydrophobicContact CZ-CZ 3.73Å; F301-F383 WeakPolarHBondContact O-CE2 3.22Å
302	L	93.5	Very high	92.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-69.5	-14.3	179.7	-64.5	171.1	0	0	0	113.7	Q298 I299 R305 Y321 Y324 L376 E380 F383	Q298-L302 HydrophobicContact CB-CD1 4.35Å; Q298-L302 PolarHBondContact O-N 3.31Å; Q298-L302 VanDerWaalsContact O-N 3.1Å; I299-L302 PolarHBondContact O-N 3.27Å; L302-R305 VanDerWaalsContact O-CZ 3.26Å; L302-R305 PolarHBondContact O-NH1 2.83Å; L302-R305 PolarHBondContact O-NH2 3.29Å; L302-Y321 HydrophobicContact CD2-CD2 3.88Å; L302-Y321 HydrophobicContact CD2-CE2 3.71Å; L302-Y324 HydrophobicContact CD1-CE1 4.24Å; L302-Y324 HydrophobicContact CD2-CE1 4.17Å; L302-L376 HydrophobicContact CD1-CD1 3.46Å; L302-L376 VanDerWaalsContact CD1-CD1 3.46Å; L302-L376 HydrophobicContact CD1-CG 4.2Å; L302-E380 HydrophobicContact CD1-CG 3.83Å; L302-E380 HydrophobicContact CD2-CG 4.12Å; L302-F383 HydrophobicContact CD2-CG 4.36Å
303	K	93	Very high	91.8	Very high	124 Å²	124	60.7 Å²	60.7	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-94.1	-19.9	174.3	-174.7	171.6	178.1	177.8	0	113.5	I299 P300 F301 R305 Y379	I299-K303 WeakPolarHBondContact O-CB 3.33Å; I299-K303 PolarHBondContact O-N 3.37Å; P300-K303 PolarHBondContact O-N 2.85Å; F301-K303 PolarHBondContact O-N 3.42Å; K303-R305 PolarHBondContact O-N 2.93Å; K303-R305 PolarHBondContact O-NH1 3.25Å; K303-Y379 HydrophobicContact CB-CD1 4.34Å; K303-Y379 HydrophobicContact CB-CE1 4.29Å; K303-Y379 HydrophobicContact CD-CE1 4.16Å; K303-Y379 HydrophobicContact CG-CE1 4.11Å
304	D	92.8	Very high	91.6	Very high	58 Å²	58	58.2 Å²	58.2	31%	0.31	32%	0.315	S	S	.	.			trans	-71.2	111.9	179.6	171	28.6	0	0	0	112	P300 F301 T306 K317	P300-D304 PolarHBondContact O-N 3.3Å; P300-D304 VanDerWaalsContact O-N 3.15Å; F301-D304 PolarHBondContact O-N 3.22Å; D304-T306 WeakPolarHBondContact OD1-CB 3.3Å; D304-T306 PolarHBondContact OD1-N 3.35Å; D304-T306 PolarHBondContact OD1-OG1 2.9Å; D304-K317 PolarHBondContact O-NZ 3.06Å; D304-K317 IonicContact OD1-NZ 3.16Å; D304-K317 IonicContact OD2-NZ 3.45Å; D304-K317 PolarHBondContact OD2-NZ 2.99Å
305	R	92.4	Very high	91.2	Very high	80 Å²	80	62.9 Å²	62.9	30%	0.302	33%	0.333	S	S	.	.			trans	-102.7	31.6	178.3	-61.4	-71.9	169.7	-74.1	-2.9	112.6	L302 K303 Y379 G382 W386	L302-R305 VanDerWaalsContact O-CZ 3.26Å; L302-R305 PolarHBondContact O-NH1 2.83Å; L302-R305 PolarHBondContact O-NH2 3.29Å; K303-R305 PolarHBondContact O-N 2.93Å; K303-R305 PolarHBondContact O-NH1 3.25Å; R305-Y379 PolarHBondContact NH2-O 3.24Å; R305-G382 PolarHBondContact NE-O 2.86Å; R305-G382 PolarHBondContact NH2-O 3.24Å; R305-W386 HydrophobicContact CB-CD2 4.23Å; R305-W386 HydrophobicContact CB-CZ2 4.36Å; R305-W386 HydrophobicContact CG-CD2 4.42Å; R305-W386 WeakPolarHBondContact O-CZ2 3.16Å
306	T	90.4	Very high	91	Very high	92 Å²	92	66.3 Å²	66.3	56%	0.564	36%	0.357	S	S	*	.			trans	-111.8	153.9	176.9	68.8	0	0	0	0	113.3	D304 K317 W386	D304-T306 WeakPolarHBondContact OD1-CB 3.3Å; D304-T306 PolarHBondContact OD1-N 3.35Å; D304-T306 PolarHBondContact OD1-OG1 2.9Å; T306-K317 PolarHBondContact O-NZ 3.28Å; T306-W386 WeakPolarHBondContact O-CH2 3.38Å
307	T	87.2	Confident	90.9	Very high	42 Å²	42	60.5 Å²	60.5	26%	0.258	33%	0.33	S	S	.	.			trans	-132.9	173.1	171.4	59.9	0	0	0	0	108.8	G309 A314 W386 E390	T307-G309 PolarHBondContact O-N 3.48Å; T307-G309 PolarHBondContact OG1-N 3.4Å; T307-A314 HydrophobicContact CG2-CB 4.11Å; T307-W386 HydrophobicContact CG2-CH2 3.7Å; T307-W386 HydrophobicContact CG2-CZ2 3.91Å; T307-E390 HydrophobicContact CG2-CG 3.78Å; T307-E390 PolarHBondContact OG1-OE1 3.45Å
308	D	86.3	Confident	90.6	Very high	105 Å²	105	54.2 Å²	54.2	56%	0.561	30%	0.301	S	S	*	.			trans	-82.2	12	172.8	65.1	-1.9	0	0	0	113.6	T310 G313	D308-T310 VanDerWaalsContact CG-OG1 3.24Å; D308-T310 PolarHBondContact O-N 3.01Å; D308-T310 WeakPolarHBondContact OD1-CA 3.46Å; D308-T310 WeakPolarHBondContact OD1-CB 3.36Å; D308-T310 PolarHBondContact OD1-N 3.12Å; D308-T310 PolarHBondContact OD1-OG1 2.82Å; D308-T310 PolarHBondContact OD2-OG1 3.12Å; D308-T310 VanDerWaalsContact OD2-OG1 3.12Å; D308-G313 WeakPolarHBondContact OD1-CA 3.32Å; D308-G313 WeakPolarHBondContact OD2-CA 3.06Å
309	G	82.9	Confident	90.2	Very high	28 Å²	28	57.3 Å²	57.3	29%	0.289	32%	0.318	S	S	.	.	S	Bend	trans	75	1.2	-172.8	0	0	0	0	0	114.5	T307 L394	T307-G309 PolarHBondContact O-N 3.48Å; T307-G309 PolarHBondContact OG1-N 3.4Å; G309-L394 WeakPolarHBondContact O-CD2 3.5Å
310	T	88.1	Confident	90.1	Very high	60 Å²	60	62.2 Å²	62.2	37%	0.368	34%	0.34	S	S	.	.	S	Bend	trans	-112.2	145.9	-177.3	83	0	0	0	0	112.9	D308 S312 G313 A314	D308-T310 VanDerWaalsContact CG-OG1 3.24Å; D308-T310 PolarHBondContact O-N 3.01Å; D308-T310 WeakPolarHBondContact OD1-CA 3.46Å; D308-T310 WeakPolarHBondContact OD1-CB 3.36Å; D308-T310 PolarHBondContact OD1-N 3.12Å; D308-T310 PolarHBondContact OD1-OG1 2.82Å; D308-T310 PolarHBondContact OD2-OG1 3.12Å; D308-T310 VanDerWaalsContact OD2-OG1 3.12Å; T310-S312 PolarHBondContact O-N 2.85Å; T310-S312 PolarHBondContact OG1-N 2.67Å; T310-G313 PolarHBondContact O-N 3.32Å; T310-G313 PolarHBondContact OG1-N 3.33Å; T310-A314 WeakPolarHBondContact O-CB 3.33Å; T310-A314 PolarHBondContact O-N 2.95Å
311	I	88.2	Confident	90	Very high	28 Å²	28	58.3 Å²	58.3	14%	0.144	31%	0.314	C	S	.	.	H	α-helix	trans	-59.9	-32.8	172.9	-59.7	162.3	0	0	0	110.4	R315 L394 E395 E398	I311-R315 HydrophobicContact CG2-CG 4.27Å; I311-R315 VanDerWaalsContact CG2-NE 3.34Å; I311-R315 WeakPolarHBondContact O-CB 3.34Å; I311-R315 VanDerWaalsContact O-CG 3.22Å; I311-R315 WeakPolarHBondContact O-CG 3.19Å; I311-R315 PolarHBondContact O-N 2.79Å; I311-L394 HydrophobicContact CG1-CB 3.58Å; I311-E395 HydrophobicContact CD1-CB 4.42Å; I311-E395 HydrophobicContact CD1-CG 3.69Å; I311-E395 HydrophobicContact CG1-CG 4.1Å; I311-E395 HydrophobicContact CG2-CG 4.29Å; I311-E398 HydrophobicContact CD1-CB 4.23Å; I311-E398 WeakPolarHBondContact CD1-OE2 3.29Å
312	S	89.4	Confident	89.6	Confident	95 Å²	95	58.5 Å²	58.5	66%	0.664	31%	0.313	S	S	*	.	H	α-helix	trans	-65.6	-47.8	178.3	-170.5	0	0	0	0	112.1	T310 R315 S316	T310-S312 PolarHBondContact O-N 2.85Å; T310-S312 PolarHBondContact OG1-N 2.67Å; S312-R315 PolarHBondContact O-N 3.33Å; S312-S316 WeakPolarHBondContact O-CB 3.45Å; S312-S316 PolarHBondContact O-N 2.96Å
313	G	89.2	Confident	89.3	Confident	17 Å²	17	59.6 Å²	59.6	18%	0.175	33%	0.325	C	S	.	.	H	α-helix	trans	-65.6	-42.9	176.6	0	0	0	0	0	112.3	D308 T310 R315 S316 K317	D308-G313 WeakPolarHBondContact OD1-CA 3.32Å; D308-G313 WeakPolarHBondContact OD2-CA 3.06Å; T310-G313 PolarHBondContact O-N 3.32Å; T310-G313 PolarHBondContact OG1-N 3.33Å; G313-R315 PolarHBondContact O-N 3.49Å; G313-S316 PolarHBondContact O-N 3.15Å; G313-K317 PolarHBondContact O-N 2.98Å
314	A	91.5	Very high	89.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-42.2	175.6	0	0	0	0	0	112.5	T307 T310 K317 L318 L387 I391 L394	T307-A314 HydrophobicContact CG2-CB 4.11Å; T310-A314 WeakPolarHBondContact O-CB 3.33Å; T310-A314 PolarHBondContact O-N 2.95Å; A314-K317 PolarHBondContact O-N 3.24Å; A314-L318 PolarHBondContact O-N 3.5Å; A314-L387 HydrophobicContact CB-CD1 4.36Å; A314-I391 HydrophobicContact CB-CD1 4.48Å; A314-I391 HydrophobicContact CB-CG1 3.66Å; A314-L394 HydrophobicContact CB-CD1 4.01Å
315	R	88.7	Confident	88.9	Confident	114 Å²	114	52 Å²	52	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-40.5	174.2	-73.7	175.5	-178.3	-171.3	2.8	112.4	I311 S312 G313 K317 L318 D319 I391 E395	I311-R315 HydrophobicContact CG2-CG 4.27Å; I311-R315 VanDerWaalsContact CG2-NE 3.34Å; I311-R315 WeakPolarHBondContact O-CB 3.34Å; I311-R315 VanDerWaalsContact O-CG 3.22Å; I311-R315 WeakPolarHBondContact O-CG 3.19Å; I311-R315 PolarHBondContact O-N 2.79Å; S312-R315 PolarHBondContact O-N 3.33Å; G313-R315 PolarHBondContact O-N 3.49Å; R315-K317 VanDerWaalsContact C-N 3.33Å; R315-K317 PolarHBondContact O-N 3.47Å; R315-L318 WeakPolarHBondContact O-CB 3.49Å; R315-L318 PolarHBondContact O-N 3.03Å; R315-L318 VanDerWaalsContact O-N 3.13Å; R315-D319 PolarHBondContact O-N 2.96Å; R315-I391 HydrophobicContact CG-CD1 4.38Å; R315-E395 IonicContact CZ-OE1 2.71Å; R315-E395 IonicContact NE-OE1 2.62Å; R315-E395 IonicContact NH2-OE1 3.43Å; R315-E395 PolarHBondContact NH2-OE1 3.02Å
316	S	90.9	Very high	88.4	Confident	76 Å²	76	50.2 Å²	50.2	53%	0.531	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-41	174.1	-173.1	0	0	0	0	112.3	S312 G313 L318 D319 H320	S312-S316 WeakPolarHBondContact O-CB 3.45Å; S312-S316 PolarHBondContact O-N 2.96Å; G313-S316 PolarHBondContact O-N 3.15Å; S316-L318 VanDerWaalsContact C-N 3.31Å; S316-L318 PolarHBondContact O-N 3.03Å; S316-D319 PolarHBondContact O-N 2.9Å; S316-H320 PolarHBondContact O-N 3.13Å
317	K	92.3	Very high	88.1	Confident	24 Å²	24	53.9 Å²	53.9	10%	0.104	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-34.1	174.6	-170.9	163.8	177.2	175.4	0	112.2	F301 D304 T306 G313 A314 R315 Y321 F383 W386 L387	F301-K317 HydrophobicContact CE2-CG 4.43Å; F301-K317 HydrophobicContact CZ-CG 4.49Å; D304-K317 PolarHBondContact O-NZ 3.06Å; D304-K317 IonicContact OD1-NZ 3.16Å; D304-K317 IonicContact OD2-NZ 3.45Å; D304-K317 PolarHBondContact OD2-NZ 2.99Å; T306-K317 PolarHBondContact O-NZ 3.28Å; G313-K317 PolarHBondContact O-N 2.98Å; A314-K317 PolarHBondContact O-N 3.24Å; R315-K317 VanDerWaalsContact C-N 3.33Å; R315-K317 PolarHBondContact O-N 3.47Å; K317-Y321 PolarHBondContact O-N 3.44Å; K317-Y321 VanDerWaalsContact O-N 3.13Å; K317-F383 HydrophobicContact CD-CZ 4.36Å; K317-F383 HydrophobicContact CG-CZ 3.96Å; K317-W386 HydrophobicContact CD-CH2 4.41Å; K317-W386 HydrophobicContact CD-CZ3 4.4Å; K317-L387 HydrophobicContact CB-CD1 4.42Å; K317-L387 HydrophobicContact CB-CD2 4.39Å; K317-L387 HydrophobicContact CG-CD1 4.49Å; K317-L387 HydrophobicContact CG-CD2 4.19Å
318	L	89.7	Confident	88.3	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-68.7	-41.3	174.3	-178.8	65.3	0	0	0	111.6	A314 R315 S316 H320 Y321 R322 L387 I391	A314-L318 PolarHBondContact O-N 3.5Å; R315-L318 WeakPolarHBondContact O-CB 3.49Å; R315-L318 PolarHBondContact O-N 3.03Å; R315-L318 VanDerWaalsContact O-N 3.13Å; S316-L318 VanDerWaalsContact C-N 3.31Å; S316-L318 PolarHBondContact O-N 3.03Å; L318-H320 VanDerWaalsContact C-N 3.34Å; L318-H320 PolarHBondContact O-N 3.05Å; L318-Y321 PolarHBondContact O-N 3.4Å; L318-R322 WeakPolarHBondContact O-CG 3.44Å; L318-R322 PolarHBondContact O-N 3.3Å; L318-L387 HydrophobicContact CB-CD2 3.82Å; L318-L387 HydrophobicContact CB-CG 4.37Å; L318-L387 HydrophobicContact CD1-CD2 4.06Å; L318-I391 HydrophobicContact CB-CD1 4.33Å; L318-I391 HydrophobicContact CD2-CD1 3.92Å
319	D	86.7	Confident	88.5	Confident	83 Å²	83	51.1 Å²	51.1	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-65.6	-35.3	175.8	-73.9	-32.1	0	0	0	112.6	R315 S316 R322 G323	R315-D319 PolarHBondContact O-N 2.96Å; S316-D319 PolarHBondContact O-N 2.9Å; D319-R322 PolarHBondContact O-N 3.29Å; D319-R322 IonicContact OD1-CZ 3.14Å; D319-R322 IonicContact OD1-NE 3.89Å; D319-R322 IonicContact OD1-NH1 2.62Å; D319-R322 PolarHBondContact OD1-NH1 3.38Å; D319-G323 PolarHBondContact O-N 3.45Å
320	H	91	Very high	88.7	Confident	129 Å²	129	52 Å²	52	60%	0.597	29%	0.285	S	S	*	.	H	α-helix	trans	-62.6	-46.6	171.6	-133.8	76.9	0	0	0	111.8	F301 S316 L318 R322 G323 Y324	F301-H320 HydrophobicContact CZ-CB 4.23Å; S316-H320 PolarHBondContact O-N 3.13Å; L318-H320 VanDerWaalsContact C-N 3.34Å; L318-H320 PolarHBondContact O-N 3.05Å; H320-R322 VanDerWaalsContact C-N 3.33Å; H320-R322 PolarHBondContact O-N 2.93Å; H320-G323 PolarHBondContact O-N 3.47Å; H320-G323 VanDerWaalsContact O-N 3.11Å; H320-Y324 PolarHBondContact O-N 3.27Å
321	Y	91.6	Very high	88.9	Confident	3 Å²	3	52 Å²	52	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-33.6	177.1	177.6	-105.4	0	0	0	113.1	F301 L302 K317 L318 Y324 R325 F383 E384	F301-Y321 HydrophobicContact CE1-CD2 4.46Å; L302-Y321 HydrophobicContact CD2-CD2 3.88Å; L302-Y321 HydrophobicContact CD2-CE2 3.71Å; K317-Y321 PolarHBondContact O-N 3.44Å; K317-Y321 VanDerWaalsContact O-N 3.13Å; L318-Y321 PolarHBondContact O-N 3.4Å; Y321-Y324 HydrophobicContact CD2-CD1 4.01Å; Y321-Y324 HydrophobicContact CE2-CD1 4.09Å; Y321-Y324 HydrophobicContact CE2-CE1 4.35Å; Y321-Y324 PolarHBondContact O-N 2.74Å; Y321-R325 HydrophobicContact CD1-CG 4.32Å; Y321-R325 HydrophobicContact CD2-CG 4.39Å; Y321-R325 HydrophobicContact CE1-CG 3.85Å; Y321-R325 HydrophobicContact CE2-CG 3.92Å; Y321-R325 WeakPolarHBondContact O-CG 3.4Å; Y321-R325 PolarHBondContact O-N 3.39Å; Y321-R325 PolarHBondContact OH-NH1 3.49Å; Y321-F383 HydrophobicContact CD1-CD1 4.26Å; Y321-F383 HydrophobicContact CD1-CE1 4.25Å; Y321-F383 AromaticContact CD2-CD1 3.63Å; Y321-F383 HydrophobicContact CD2-CD1 3.63Å; Y321-F383 AromaticContact CD2-CE1 3.67Å; Y321-F383 HydrophobicContact CD2-CE1 3.67Å; Y321-F383 HydrophobicContact CE1-CD1 4.49Å; Y321-F383 AromaticContact CE2-CD1 3.9Å; Y321-F383 HydrophobicContact CE2-CD1 3.9Å; Y321-F383 HydrophobicContact CE2-CE1 4.41Å; Y321-F383 AromaticContact CG-CD1 3.82Å; Y321-F383 HydrophobicContact CG-CD1 3.82Å; Y321-F383 AromaticContact CG-CE1 3.57Å; Y321-F383 HydrophobicContact CG-CE1 3.57Å; Y321-E384 HydrophobicContact CE1-CB 3.77Å; Y321-E384 HydrophobicContact CE1-CG 3.93Å; Y321-E384 WeakPolarHBondContact CE1-OE2 3.43Å; Y321-E384 PolarHBondContact OH-OE2 2.96Å
322	R	85.7	Confident	89.1	Confident	59 Å²	59	52.7 Å²	52.7	22%	0.223	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-41.1	169.6	-72.7	166.6	174.7	168.3	-4.7	112	L318 D319 H320 G326 Q702	L318-R322 WeakPolarHBondContact O-CG 3.44Å; L318-R322 PolarHBondContact O-N 3.3Å; D319-R322 PolarHBondContact O-N 3.29Å; D319-R322 IonicContact OD1-CZ 3.14Å; D319-R322 IonicContact OD1-NE 3.89Å; D319-R322 IonicContact OD1-NH1 2.62Å; D319-R322 PolarHBondContact OD1-NH1 3.38Å; H320-R322 VanDerWaalsContact C-N 3.33Å; H320-R322 PolarHBondContact O-N 2.93Å; R322-G326 PolarHBondContact O-N 3.1Å; R322-Q702 VanDerWaalsContact CZ-OE1 3.32Å; R322-Q702 VanDerWaalsContact NH2-CB 3.29Å
323	G	86.7	Confident	89.2	Confident	24 Å²	24	49 Å²	49	25%	0.247	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-49.4	173.9	0	0	0	0	0	112	D319 H320 G326 F327	D319-G323 PolarHBondContact O-N 3.45Å; H320-G323 PolarHBondContact O-N 3.47Å; H320-G323 VanDerWaalsContact O-N 3.11Å; G323-G326 PolarHBondContact O-N 3.3Å; G323-F327 PolarHBondContact O-N 3.43Å
324	Y	91.2	Very high	89.2	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.012	27%	0.267	C	S	.	.	I	π-helix	trans	-55.4	-54.3	174.6	166.1	-99.4	0	0	0	112.6	W294 Q298 L302 H320 Y321 G326 E328 K329 E380	W294-Y324 AromaticContact CH2-CE2 3.91Å; W294-Y324 HydrophobicContact CH2-CE2 3.91Å; W294-Y324 HydrophobicContact CZ2-CD2 4.4Å; W294-Y324 AromaticContact CZ2-CE2 3.55Å; W294-Y324 HydrophobicContact CZ2-CE2 3.55Å; Q298-Y324 HydrophobicContact CB-CE2 4.24Å; Q298-Y324 HydrophobicContact CG-CE2 3.85Å; L302-Y324 HydrophobicContact CD1-CE1 4.24Å; L302-Y324 HydrophobicContact CD2-CE1 4.17Å; H320-Y324 PolarHBondContact O-N 3.27Å; Y321-Y324 HydrophobicContact CD2-CD1 4.01Å; Y321-Y324 HydrophobicContact CE2-CD1 4.09Å; Y321-Y324 HydrophobicContact CE2-CE1 4.35Å; Y321-Y324 PolarHBondContact O-N 2.74Å; Y324-G326 PolarHBondContact O-N 2.94Å; Y324-E328 HydrophobicContact CD2-CB 4.18Å; Y324-E328 PolarHBondContact O-N 3.37Å; Y324-E328 VanDerWaalsContact O-N 3.12Å; Y324-K329 HydrophobicContact CE1-CB 4.49Å; Y324-K329 HydrophobicContact CE1-CD 4.5Å; Y324-K329 HydrophobicContact CE2-CB 4.48Å; Y324-K329 PolarHBondContact O-N 3.19Å; Y324-E380 HydrophobicContact CE1-CG 4.2Å; Y324-E380 WeakPolarHBondContact CE1-OE1 3.26Å
325	R	87.4	Confident	89.3	Confident	19 Å²	19	53.7 Å²	53.7	7%	0.072	28%	0.279	C	S	.	.	I	π-helix	trans	-65.2	-34.6	179.5	-70.8	-67.1	-64.8	-89.8	9.5	113	Y321 P330 E380 E384 E717	Y321-R325 HydrophobicContact CD1-CG 4.32Å; Y321-R325 HydrophobicContact CD2-CG 4.39Å; Y321-R325 HydrophobicContact CE1-CG 3.85Å; Y321-R325 HydrophobicContact CE2-CG 3.92Å; Y321-R325 WeakPolarHBondContact O-CG 3.4Å; Y321-R325 PolarHBondContact O-N 3.39Å; Y321-R325 PolarHBondContact OH-NH1 3.49Å; R325-P330 WeakPolarHBondContact O-CD 3.1Å; R325-P330 WeakPolarHBondContact O-CG 3.19Å; R325-E380 WeakPolarHBondContact CD-OE1 3.33Å; R325-E380 IonicContact NE-OE1 3.73Å; R325-E384 IonicContact NH1-OE2 2.79Å; R325-E384 PolarHBondContact NH1-OE2 3.25Å; R325-E717 IonicContact CZ-OE1 3.12Å; R325-E717 IonicContact CZ-OE2 3.26Å; R325-E717 IonicContact NH1-OE1 2.69Å; R325-E717 IonicContact NH1-OE2 2.87Å; R325-E717 PolarHBondContact NH1-OE2 3.16Å; R325-E717 VanDerWaalsContact NH2-CD 3.33Å; R325-E717 IonicContact NH2-OE1 2.66Å; R325-E717 PolarHBondContact NH2-OE1 2.81Å; R325-E717 IonicContact NH2-OE2 3.62Å; R325-E717 PolarHBondContact NH2-OE2 2.78Å
326	G	80.8	Confident	89.5	Confident	43 Å²	43	48.8 Å²	48.8	44%	0.443	26%	0.261	S	S	.	.	I	π-helix	trans	-86.3	-28.7	-173.2	0	0	0	0	0	115.4	R322 G323 Y324	R322-G326 PolarHBondContact O-N 3.1Å; G323-G326 PolarHBondContact O-N 3.3Å; Y324-G326 PolarHBondContact O-N 2.94Å
327	F	85.4	Confident	89.6	Confident	168 Å²	168	45.4 Å²	45.4	74%	0.737	24%	0.237	S	C	*	.	I	π-helix	trans	-130.4	-35.8	-172.5	-57.5	-74.5	0	0	0	114.4	G323 P331	G323-F327 PolarHBondContact O-N 3.43Å; F327-P331 VanDerWaalsContact O-CD 3.28Å; F327-P331 WeakPolarHBondContact O-CD 3.15Å
328	E	90.4	Very high	89.5	Confident	84 Å²	84	48.6 Å²	48.6	39%	0.393	25%	0.254	S	S	.	.	I	π-helix	trans	-86.6	-47.7	-175	-62.4	179.5	-143.7	0	0	113	Q298 Y324 P331 R332	Q298-E328 PolarHBondContact NE2-OE2 3.36Å; Y324-E328 HydrophobicContact CD2-CB 4.18Å; Y324-E328 PolarHBondContact O-N 3.37Å; Y324-E328 VanDerWaalsContact O-N 3.12Å; E328-P331 WeakPolarHBondContact O-CD 3.49Å; E328-P331 WeakPolarHBondContact O-CG 3.24Å; E328-R332 WeakPolarHBondContact O-CG 3.4Å
329	K	91.5	Very high	89.7	Confident	5 Å²	5	48.1 Å²	48.1	2%	0.022	25%	0.252	C	S	.	.	H	α-helix	trans	-68.4	-42.5	-179.1	178.3	173.9	173.4	-177.4	0	114.5	W294 Y324 R332 L333 W373 E380	W294-K329 HydrophobicContact CH2-CB 4.14Å; W294-K329 HydrophobicContact CH2-CG 4.25Å; W294-K329 HydrophobicContact CZ2-CB 4.44Å; Y324-K329 HydrophobicContact CE1-CB 4.49Å; Y324-K329 HydrophobicContact CE1-CD 4.5Å; Y324-K329 HydrophobicContact CE2-CB 4.48Å; Y324-K329 PolarHBondContact O-N 3.19Å; K329-R332 WeakPolarHBondContact O-CB 3.44Å; K329-R332 PolarHBondContact O-N 3.25Å; K329-L333 PolarHBondContact O-N 3.11Å; K329-W373 HydrophobicContact CG-CH2 4.31Å; K329-E380 WeakPolarHBondContact CD-OE1 3.16Å; K329-E380 IonicContact NZ-OE1 3.58Å; K329-E380 PolarHBondContact NZ-OE1 3.35Å; K329-E380 IonicContact NZ-OE2 2.82Å; K329-E380 PolarHBondContact NZ-OE2 3.01Å
330	P	86.9	Confident	89.9	Confident	47 Å²	47	44.6 Å²	44.6	31%	0.305	23%	0.233	S	C	.	.	H	α-helix	trans	-55	-45.1	-175.1	-28.2	36.9	0	0	0	116.1	R325 R332 L333 D334	R325-P330 WeakPolarHBondContact O-CD 3.1Å; R325-P330 WeakPolarHBondContact O-CG 3.19Å; P330-R332 VanDerWaalsContact C-N 3.31Å; P330-R332 PolarHBondContact O-N 2.96Å; P330-L333 PolarHBondContact O-N 2.94Å; P330-D334 PolarHBondContact O-N 3.3Å
331	P	91.3	Very high	89.8	Confident	59 Å²	59	39.3 Å²	39.3	38%	0.383	21%	0.209	S	C	.	.	H	α-helix	trans	-66.5	-30.6	175.8	25.9	-34.6	0	0	0	113	F327 E328 L333 D334 E335	F327-P331 VanDerWaalsContact O-CD 3.28Å; F327-P331 WeakPolarHBondContact O-CD 3.15Å; E328-P331 WeakPolarHBondContact O-CD 3.49Å; E328-P331 WeakPolarHBondContact O-CG 3.24Å; P331-L333 VanDerWaalsContact C-N 3.32Å; P331-L333 PolarHBondContact O-N 2.83Å; P331-D334 WeakPolarHBondContact O-CB 3.46Å; P331-D334 PolarHBondContact O-N 3.34Å; P331-D334 VanDerWaalsContact O-N 3.17Å; P331-E335 WeakPolarHBondContact O-CG 3.44Å; P331-E335 PolarHBondContact O-N 2.81Å
332	R	93.6	Very high	89.7	Confident	43 Å²	43	39.9 Å²	39.9	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-69.1	-29.2	177.9	-58.5	-54.2	-157.5	177	15.7	112.9	D290 L291 W294 E328 K329 P330 E335 K336 W373	D290-R332 IonicContact OD1-NH2 3.23Å; D290-R332 IonicContact OD2-CZ 3.63Å; D290-R332 VanDerWaalsContact OD2-CZ 3.24Å; D290-R332 IonicContact OD2-NH1 2.71Å; D290-R332 PolarHBondContact OD2-NH1 3.49Å; D290-R332 IonicContact OD2-NH2 3.73Å; D290-R332 PolarHBondContact OD2-NH2 3.3Å; L291-R332 HydrophobicContact CD1-CB 4.11Å; W294-R332 HydrophobicContact CD2-CB 4.41Å; W294-R332 HydrophobicContact CD2-CG 3.72Å; W294-R332 HydrophobicContact CE3-CB 4.09Å; W294-R332 HydrophobicContact CE3-CG 3.92Å; W294-R332 HydrophobicContact CG-CG 4.29Å; W294-R332 HydrophobicContact CH2-CB 4.04Å; W294-R332 HydrophobicContact CH2-CG 4.01Å; W294-R332 HydrophobicContact CZ2-CB 4.34Å; W294-R332 HydrophobicContact CZ2-CG 3.8Å; W294-R332 HydrophobicContact CZ3-CB 3.91Å; W294-R332 HydrophobicContact CZ3-CG 4.07Å; E328-R332 WeakPolarHBondContact O-CG 3.4Å; K329-R332 WeakPolarHBondContact O-CB 3.44Å; K329-R332 PolarHBondContact O-N 3.25Å; P330-R332 VanDerWaalsContact C-N 3.31Å; P330-R332 PolarHBondContact O-N 2.96Å; R332-E335 WeakPolarHBondContact CD-OE2 3.38Å; R332-E335 IonicContact CZ-OE2 3.3Å; R332-E335 IonicContact NE-OE2 3.4Å; R332-E335 VanDerWaalsContact NH1-CD 3.32Å; R332-E335 IonicContact NH1-OE1 2.66Å; R332-E335 PolarHBondContact NH1-OE1 3.5Å; R332-E335 IonicContact NH1-OE2 2.71Å; R332-E335 PolarHBondContact NH1-OE2 3.15Å; R332-K336 WeakPolarHBondContact O-CB 3.35Å; R332-K336 PolarHBondContact O-N 3.14Å; R332-W373 HydrophobicContact CB-CH2 4.31Å; R332-W373 HydrophobicContact CB-CZ3 4.23Å
333	L	91.7	Very high	89.9	Confident	18 Å²	18	39.2 Å²	39.2	9%	0.094	21%	0.211	C	C	.	.	H	α-helix	trans	-68.2	-38.4	170.3	178.6	65.9	0	0	0	111.9	K329 P330 P331 K336 T337 W373 E724	K329-L333 PolarHBondContact O-N 3.11Å; P330-L333 PolarHBondContact O-N 2.94Å; P331-L333 VanDerWaalsContact C-N 3.32Å; P331-L333 PolarHBondContact O-N 2.83Å; L333-K336 PolarHBondContact O-N 3.43Å; L333-T337 PolarHBondContact O-N 2.85Å; L333-T337 PolarHBondContact O-OG1 2.76Å; L333-W373 HydrophobicContact CB-CH2 4.06Å; L333-W373 HydrophobicContact CB-CZ2 4.09Å; L333-W373 HydrophobicContact CD1-CH2 4.5Å; L333-W373 HydrophobicContact CD1-CZ2 3.86Å; L333-E724 HydrophobicContact CD2-CB 3.57Å; L333-E724 HydrophobicContact CD2-CG 3.55Å
334	D	88.9	Confident	90	Very high	64 Å²	64	41.4 Å²	41.4	34%	0.342	22%	0.217	S	C	.	.	H	α-helix	trans	-65.1	-41.4	174.8	-70.7	-17.8	0	0	0	111	P330 P331 T337 L338 K727	P330-D334 PolarHBondContact O-N 3.3Å; P331-D334 WeakPolarHBondContact O-CB 3.46Å; P331-D334 PolarHBondContact O-N 3.34Å; P331-D334 VanDerWaalsContact O-N 3.17Å; D334-T337 PolarHBondContact O-N 2.95Å; D334-L338 WeakPolarHBondContact O-CB 3.32Å; D334-L338 PolarHBondContact O-N 3.28Å; D334-K727 WeakPolarHBondContact OD1-CE 3.14Å; D334-K727 IonicContact OD1-NZ 3.54Å; D334-K727 PolarHBondContact OD1-NZ 3.14Å; D334-K727 IonicContact OD2-NZ 2.67Å; D334-K727 PolarHBondContact OD2-NZ 3.12Å
335	E	92.9	Very high	89.7	Confident	51 Å²	51	42.3 Å²	42.3	24%	0.238	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-42.7	174.4	-71.6	166.4	-177.9	0	0	112.7	L287 P331 R332 T337 L338 L339	L287-E335 HydrophobicContact CD2-CG 4.49Å; P331-E335 WeakPolarHBondContact O-CG 3.44Å; P331-E335 PolarHBondContact O-N 2.81Å; R332-E335 WeakPolarHBondContact CD-OE2 3.38Å; R332-E335 IonicContact CZ-OE2 3.3Å; R332-E335 IonicContact NE-OE2 3.4Å; R332-E335 VanDerWaalsContact NH1-CD 3.32Å; R332-E335 IonicContact NH1-OE1 2.66Å; R332-E335 PolarHBondContact NH1-OE1 3.5Å; R332-E335 IonicContact NH1-OE2 2.71Å; R332-E335 PolarHBondContact NH1-OE2 3.15Å; E335-T337 VanDerWaalsContact C-N 3.29Å; E335-T337 PolarHBondContact O-N 2.75Å; E335-L338 PolarHBondContact O-N 3.16Å; E335-L339 WeakPolarHBondContact O-CB 3.08Å; E335-L339 PolarHBondContact O-N 2.95Å
336	K	93.9	Very high	89.7	Confident	12 Å²	12	41.4 Å²	41.4	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-44.8	172.4	-176.1	-177.8	-176.1	-65.8	0	111.5	L291 R332 L333 L339 E340 I369 D370 W373	L291-K336 HydrophobicContact CD2-CB 3.81Å; L291-K336 HydrophobicContact CD2-CG 4.15Å; R332-K336 WeakPolarHBondContact O-CB 3.35Å; R332-K336 PolarHBondContact O-N 3.14Å; L333-K336 PolarHBondContact O-N 3.43Å; K336-L339 PolarHBondContact O-N 3.48Å; K336-E340 IonicContact NZ-OE1 2.65Å; K336-E340 PolarHBondContact NZ-OE1 3Å; K336-E340 WeakPolarHBondContact O-CG 3.37Å; K336-E340 PolarHBondContact O-N 3.43Å; K336-I369 HydrophobicContact CG-CG2 4.39Å; K336-D370 WeakPolarHBondContact CE-OD1 3.3Å; K336-D370 IonicContact NZ-OD1 3.81Å; K336-D370 PolarHBondContact NZ-OD1 2.91Å; K336-W373 HydrophobicContact CD-CB 4.27Å; K336-W373 HydrophobicContact CD-CD2 3.68Å; K336-W373 HydrophobicContact CD-CE3 3.93Å; K336-W373 HydrophobicContact CD-CG 3.82Å
337	T	91.1	Very high	89.9	Confident	5 Å²	5	41 Å²	41	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-39.2	178.7	-52.4	0	0	0	0	111.6	L333 D334 E335 N341 T728 K731	L333-T337 PolarHBondContact O-N 2.85Å; L333-T337 PolarHBondContact O-OG1 2.76Å; D334-T337 PolarHBondContact O-N 2.95Å; E335-T337 VanDerWaalsContact C-N 3.29Å; E335-T337 PolarHBondContact O-N 2.75Å; T337-N341 WeakPolarHBondContact O-CB 3.37Å; T337-N341 PolarHBondContact O-N 2.92Å; T337-T728 HydrophobicContact CG2-CG2 4.19Å; T337-K731 HydrophobicContact CG2-CB 3.59Å; T337-K731 HydrophobicContact CG2-CG 4.44Å
338	L	91.5	Very high	89.5	Confident	90 Å²	90	33.7 Å²	33.7	47%	0.471	17%	0.174	S	C	.	.	H	α-helix	trans	-63.5	-39.5	175.1	177.3	62	0	0	0	112	L287 D334 E335 N341 T342	L287-L338 HydrophobicContact CD1-CD2 4.06Å; L287-L338 HydrophobicContact CD1-CG 4.19Å; D334-L338 WeakPolarHBondContact O-CB 3.32Å; D334-L338 PolarHBondContact O-N 3.28Å; E335-L338 PolarHBondContact O-N 3.16Å; L338-N341 PolarHBondContact O-N 2.8Å; L338-T342 VanDerWaalsContact O-CB 3.31Å; L338-T342 WeakPolarHBondContact O-CB 3.37Å; L338-T342 PolarHBondContact O-N 3.1Å; L338-T342 PolarHBondContact O-OG1 3.29Å
339	L	92.6	Very high	89.1	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-48.2	177.9	178.7	152.1	0	0	0	111.6	Y284 L287 A288 E335 K336 N341 T342 Y343 I366 I369	Y284-L339 HydrophobicContact CD2-CD2 4.18Å; Y284-L339 HydrophobicContact CD2-CG 3.91Å; Y284-L339 HydrophobicContact CE2-CD1 4.49Å; Y284-L339 HydrophobicContact CE2-CD2 3.42Å; Y284-L339 VanDerWaalsContact CE2-CD2 3.42Å; Y284-L339 HydrophobicContact CE2-CG 3.66Å; L287-L339 HydrophobicContact CB-CD1 4.05Å; A288-L339 VanDerWaalsContact CA-CD1 3.48Å; A288-L339 HydrophobicContact CB-CD1 3.83Å; E335-L339 WeakPolarHBondContact O-CB 3.08Å; E335-L339 PolarHBondContact O-N 2.95Å; K336-L339 PolarHBondContact O-N 3.48Å; L339-N341 PolarHBondContact O-N 3.46Å; L339-T342 PolarHBondContact O-N 2.93Å; L339-Y343 PolarHBondContact O-N 2.84Å; L339-I366 HydrophobicContact CD2-CG1 4.28Å; L339-I369 HydrophobicContact CD1-CD1 3.64Å; L339-I369 HydrophobicContact CD2-CD1 3.59Å; L339-I369 HydrophobicContact CG-CD1 4.3Å
340	E	91.5	Very high	88.6	Confident	9 Å²	9	34.1 Å²	34.1	4%	0.042	17%	0.173	C	C	.	.	H	α-helix	trans	-60	-45.7	175.1	-67.2	168.8	-171.7	0	0	111.7	K336 T342 Y343 N344 I366 R732	K336-E340 IonicContact NZ-OE1 2.65Å; K336-E340 PolarHBondContact NZ-OE1 3Å; K336-E340 WeakPolarHBondContact O-CG 3.37Å; K336-E340 PolarHBondContact O-N 3.43Å; E340-T342 VanDerWaalsContact C-N 3.35Å; E340-T342 PolarHBondContact O-N 3.42Å; E340-Y343 PolarHBondContact O-N 3.36Å; E340-N344 WeakPolarHBondContact O-CB 3.38Å; E340-N344 VanDerWaalsContact O-CG 3.29Å; E340-N344 PolarHBondContact O-N 2.88Å; E340-N344 PolarHBondContact O-ND2 3.43Å; E340-I366 HydrophobicContact CG-CD1 4.45Å; E340-I366 HydrophobicContact CG-CG2 4.2Å; E340-R732 IonicContact OE1-NH2 2.79Å; E340-R732 PolarHBondContact OE1-NH2 3.26Å; E340-R732 IonicContact OE2-CZ 2.7Å; E340-R732 IonicContact OE2-NE 3.95Å; E340-R732 PolarHBondContact OE2-NE 2.59Å; E340-R732 IonicContact OE2-NH2 2.7Å; E340-R732 PolarHBondContact OE2-NH2 2.86Å
341	N	89.1	Confident	88.1	Confident	19 Å²	19	39.7 Å²	39.7	10%	0.102	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-40.8	176.6	-78.4	-3	0	0	0	111.9	T337 L338 L339 N344 T345 K731 N735	T337-N341 WeakPolarHBondContact O-CB 3.37Å; T337-N341 PolarHBondContact O-N 2.92Å; L338-N341 PolarHBondContact O-N 2.8Å; L339-N341 PolarHBondContact O-N 3.46Å; N341-N344 PolarHBondContact O-N 3.42Å; N341-T345 VanDerWaalsContact O-CB 3.32Å; N341-T345 WeakPolarHBondContact O-CB 3.36Å; N341-T345 PolarHBondContact O-N 3.3Å; N341-T345 PolarHBondContact O-OG1 2.8Å; N341-K731 PolarHBondContact ND2-O 3.28Å; N341-N735 HydrophobicContact CB-CB 4.03Å; N341-N735 VanDerWaalsContact CG-CB 3.43Å; N341-N735 PolarHBondContact O-OD1 3.47Å; N341-N735 WeakPolarHBondContact OD1-CB 3.26Å
342	T	89.5	Confident	87.2	Confident	15 Å²	15	38.4 Å²	38.4	9%	0.092	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-45.4	177.7	-60.3	0	0	0	0	110.6	L280 L338 L339 E340 T345 L346	L280-T342 HydrophobicContact CB-CG2 4.44Å; L280-T342 HydrophobicContact CD2-CG2 4.2Å; L338-T342 VanDerWaalsContact O-CB 3.31Å; L338-T342 WeakPolarHBondContact O-CB 3.37Å; L338-T342 PolarHBondContact O-N 3.1Å; L338-T342 PolarHBondContact O-OG1 3.29Å; L339-T342 PolarHBondContact O-N 2.93Å; E340-T342 VanDerWaalsContact C-N 3.35Å; E340-T342 PolarHBondContact O-N 3.42Å; T342-T345 PolarHBondContact O-N 3Å; T342-L346 VanDerWaalsContact O-CB 3.25Å; T342-L346 WeakPolarHBondContact O-CB 3.49Å; T342-L346 PolarHBondContact O-N 2.66Å
343	Y	91	Very high	86.1	Confident	45 Å²	45	36.7 Å²	36.7	18%	0.176	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-50.5	175.2	-177	-95	0	0	0	112.6	Y284 L339 E340 T345 L346 Q347 F358 P360 I366	Y284-Y343 HydrophobicContact CD2-CD2 4.32Å; Y284-Y343 AromaticContact CE2-CD2 3.84Å; Y284-Y343 HydrophobicContact CE2-CD2 3.84Å; Y284-Y343 HydrophobicContact CE2-CG 4.13Å; L339-Y343 PolarHBondContact O-N 2.84Å; E340-Y343 PolarHBondContact O-N 3.36Å; Y343-T345 VanDerWaalsContact C-N 3.26Å; Y343-T345 PolarHBondContact O-N 3.11Å; Y343-L346 PolarHBondContact O-N 2.92Å; Y343-L346 VanDerWaalsContact O-N 3.16Å; Y343-Q347 HydrophobicContact CD1-CG 3.97Å; Y343-Q347 HydrophobicContact CE1-CG 3.7Å; Y343-Q347 HydrophobicContact CE2-CG 4.27Å; Y343-Q347 VanDerWaalsContact CE2-NE2 3.33Å; Y343-Q347 HydrophobicContact CG-CG 4.39Å; Y343-Q347 WeakPolarHBondContact O-CG 3.5Å; Y343-Q347 PolarHBondContact O-N 2.82Å; Y343-Q347 PolarHBondContact OH-NE2 3.19Å; Y343-Q347 VanDerWaalsContact OH-NE2 3.14Å; Y343-F358 HydrophobicContact CD2-CD1 4.06Å; Y343-F358 HydrophobicContact CD2-CE1 4.41Å; Y343-F358 HydrophobicContact CE2-CD1 4.17Å; Y343-P360 HydrophobicContact CD2-CG 4.41Å; Y343-P360 HydrophobicContact CE2-CG 4Å; Y343-I366 HydrophobicContact CD1-CD1 3.39Å; Y343-I366 HydrophobicContact CD1-CG1 4.45Å; Y343-I366 HydrophobicContact CD2-CD1 4.39Å; Y343-I366 HydrophobicContact CE1-CD1 3.97Å; Y343-I366 HydrophobicContact CG-CD1 3.62Å; Y343-I366 HydrophobicContact CG-CG1 4.4Å
344	N	87.1	Confident	85.1	Confident	70 Å²	70	41.4 Å²	41.4	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-59.5	-39.4	179.8	-72.9	-28.7	0	0	0	112	E340 N341 T348	E340-N344 WeakPolarHBondContact O-CB 3.38Å; E340-N344 VanDerWaalsContact O-CG 3.29Å; E340-N344 PolarHBondContact O-N 2.88Å; E340-N344 PolarHBondContact O-ND2 3.43Å; N341-N344 PolarHBondContact O-N 3.42Å; N344-T348 WeakPolarHBondContact O-CB 3.19Å; N344-T348 PolarHBondContact O-N 3.1Å; N344-T348 PolarHBondContact O-OG1 3.4Å
345	T	86.5	Confident	84.4	Confident	21 Å²	21	39.2 Å²	39.2	13%	0.129	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-47.6	174.9	-52.3	0	0	0	0	111.7	N341 T342 Y343 T348 R349 N735 N739	N341-T345 VanDerWaalsContact O-CB 3.32Å; N341-T345 WeakPolarHBondContact O-CB 3.36Å; N341-T345 PolarHBondContact O-N 3.3Å; N341-T345 PolarHBondContact O-OG1 2.8Å; T342-T345 PolarHBondContact O-N 3Å; Y343-T345 VanDerWaalsContact C-N 3.26Å; Y343-T345 PolarHBondContact O-N 3.11Å; T345-T348 PolarHBondContact O-N 3.43Å; T345-R349 WeakPolarHBondContact O-CB 3.4Å; T345-R349 WeakPolarHBondContact O-CG 3.41Å; T345-R349 PolarHBondContact O-N 3.13Å; T345-N735 PolarHBondContact OG1-ND2 3.06Å; T345-N739 WeakPolarHBondContact CA-OD1 3.25Å
346	L	87.4	Confident	83.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-47.2	179.6	178.7	58.7	0	0	0	111.7	N277 L280 M281 T342 Y343 T348 R349 L350 F358	N277-L346 HydrophobicContact CB-CD1 4.01Å; L280-L346 HydrophobicContact CB-CD1 4.18Å; M281-L346 HydrophobicContact CB-CD2 4.37Å; M281-L346 HydrophobicContact CE-CD1 4.27Å; M281-L346 HydrophobicContact CG-CD1 4.22Å; M281-L346 HydrophobicContact CG-CD2 3.55Å; M281-L346 HydrophobicContact CG-CG 4.48Å; T342-L346 VanDerWaalsContact O-CB 3.25Å; T342-L346 WeakPolarHBondContact O-CB 3.49Å; T342-L346 PolarHBondContact O-N 2.66Å; Y343-L346 PolarHBondContact O-N 2.92Å; Y343-L346 VanDerWaalsContact O-N 3.16Å; L346-T348 VanDerWaalsContact C-N 3.34Å; L346-T348 PolarHBondContact O-N 3.22Å; L346-R349 PolarHBondContact O-N 3.38Å; L346-L350 HydrophobicContact CD1-CD1 3.78Å; L346-L350 HydrophobicContact CD1-CG 4.05Å; L346-L350 HydrophobicContact CG-CD1 3.83Å; L346-L350 WeakPolarHBondContact O-CB 3.41Å; L346-L350 VanDerWaalsContact O-CG 3.27Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 2.91Å; L346-F358 HydrophobicContact CD2-CB 3.8Å; L346-F358 HydrophobicContact CD2-CD1 3.5Å; L346-F358 VanDerWaalsContact CD2-CD1 3.5Å; L346-F358 HydrophobicContact CD2-CD2 4.35Å; L346-F358 HydrophobicContact CD2-CE1 4.13Å; L346-F358 HydrophobicContact CD2-CG 3.62Å; L346-F358 HydrophobicContact CG-CB 4.13Å; L346-F358 HydrophobicContact CG-CG 4.48Å
347	Q	85.1	Confident	82.9	Confident	35 Å²	35	44 Å²	44	16%	0.164	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-42.4	175.7	-66.7	-62.8	-0.1	0	0	112	Y343 L350 R351 S357 F358	Y343-Q347 HydrophobicContact CD1-CG 3.97Å; Y343-Q347 HydrophobicContact CE1-CG 3.7Å; Y343-Q347 HydrophobicContact CE2-CG 4.27Å; Y343-Q347 VanDerWaalsContact CE2-NE2 3.33Å; Y343-Q347 HydrophobicContact CG-CG 4.39Å; Y343-Q347 WeakPolarHBondContact O-CG 3.5Å; Y343-Q347 PolarHBondContact O-N 2.82Å; Y343-Q347 PolarHBondContact OH-NE2 3.19Å; Y343-Q347 VanDerWaalsContact OH-NE2 3.14Å; Q347-L350 PolarHBondContact O-N 2.96Å; Q347-R351 VanDerWaalsContact O-CB 3.26Å; Q347-R351 WeakPolarHBondContact O-CB 3.27Å; Q347-R351 PolarHBondContact O-N 2.89Å; Q347-S357 VanDerWaalsContact OE1-CB 3.3Å; Q347-F358 PolarHBondContact NE2-O 3.13Å
348	T	77.1	Confident	82.8	Confident	14 Å²	14	44.7 Å²	44.7	9%	0.086	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-46.4	176.8	-65.2	0	0	0	0	111.1	N344 T345 L346 L352 N739	N344-T348 WeakPolarHBondContact O-CB 3.19Å; N344-T348 PolarHBondContact O-N 3.1Å; N344-T348 PolarHBondContact O-OG1 3.4Å; T345-T348 PolarHBondContact O-N 3.43Å; L346-T348 VanDerWaalsContact C-N 3.34Å; L346-T348 PolarHBondContact O-N 3.22Å; T348-L352 HydrophobicContact CG2-CD1 3.79Å; T348-L352 HydrophobicContact CG2-CG 4.43Å; T348-L352 WeakPolarHBondContact O-CB 3.38Å; T348-L352 WeakPolarHBondContact O-CD1 3.08Å; T348-L352 WeakPolarHBondContact O-CG 3.4Å; T348-L352 PolarHBondContact O-N 3.24Å; T348-N739 HydrophobicContact CG2-CB 4.07Å
349	R	81.6	Confident	82.6	Confident	93 Å²	93	46.9 Å²	46.9	35%	0.351	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-43.9	177.9	-73.8	178.2	179.4	-162.7	1.6	113	T345 L346 L352 A353	T345-R349 WeakPolarHBondContact O-CB 3.4Å; T345-R349 WeakPolarHBondContact O-CG 3.41Å; T345-R349 PolarHBondContact O-N 3.13Å; L346-R349 PolarHBondContact O-N 3.38Å; R349-L352 PolarHBondContact O-N 3.12Å; R349-A353 VanDerWaalsContact O-CB 3.27Å; R349-A353 WeakPolarHBondContact O-CB 3.37Å; R349-A353 PolarHBondContact O-N 3.2Å
350	L	79.6	Confident	82.4	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-45.9	178.6	-69.5	167.4	0	0	0	111.3	N277 M281 L346 Q347 L352 A353 N354 R355 F358	N277-L350 HydrophobicContact CB-CD2 4.4Å; M281-L350 HydrophobicContact CE-CD1 3.89Å; M281-L350 HydrophobicContact CE-CD2 4.17Å; L346-L350 HydrophobicContact CD1-CD1 3.78Å; L346-L350 HydrophobicContact CD1-CG 4.05Å; L346-L350 HydrophobicContact CG-CD1 3.83Å; L346-L350 WeakPolarHBondContact O-CB 3.41Å; L346-L350 VanDerWaalsContact O-CG 3.27Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 2.91Å; Q347-L350 PolarHBondContact O-N 2.96Å; L350-L352 PolarHBondContact O-N 2.98Å; L350-A353 CarbonylContact O-C 3.36Å; L350-A353 PolarHBondContact O-N 3.05Å; L350-N354 PolarHBondContact O-N 2.92Å; L350-R355 HydrophobicContact CB-CB 4.41Å; L350-R355 HydrophobicContact CD2-CB 3.84Å; L350-R355 PolarHBondContact O-N 3.31Å; L350-F358 HydrophobicContact CD1-CB 3.71Å
351	R	77.7	Confident	82.4	Confident	164 Å²	164	50.6 Å²	50.6	62%	0.619	26%	0.261	S	S	*	.	H	α-helix	trans	-59	-46.3	175.6	-178.7	-176.7	64.7	-148.4	-7.5	112.3	Q347 A353 N354	Q347-R351 VanDerWaalsContact O-CB 3.26Å; Q347-R351 WeakPolarHBondContact O-CB 3.27Å; Q347-R351 PolarHBondContact O-N 2.89Å; R351-A353 VanDerWaalsContact C-N 3.33Å; R351-N354 PolarHBondContact O-N 3.29Å
352	L	71.1	Confident	82.2	Confident	33 Å²	33	58.8 Å²	58.8	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-41.3	177.6	-72	169.1	0	0	0	111.3	T348 R349 L350 N354 T742 A743 Y746	T348-L352 HydrophobicContact CG2-CD1 3.79Å; T348-L352 HydrophobicContact CG2-CG 4.43Å; T348-L352 WeakPolarHBondContact O-CB 3.38Å; T348-L352 WeakPolarHBondContact O-CD1 3.08Å; T348-L352 WeakPolarHBondContact O-CG 3.4Å; T348-L352 PolarHBondContact O-N 3.24Å; R349-L352 PolarHBondContact O-N 3.12Å; L350-L352 PolarHBondContact O-N 2.98Å; L352-N354 PolarHBondContact O-N 2.73Å; L352-T742 HydrophobicContact CD1-CG2 4.2Å; L352-A743 HydrophobicContact CD1-CB 4.05Å; L352-A743 HydrophobicContact CD2-CB 4.09Å; L352-Y746 HydrophobicContact CB-CD1 3.72Å; L352-Y746 HydrophobicContact CB-CD2 4.17Å; L352-Y746 HydrophobicContact CB-CE1 4.03Å; L352-Y746 HydrophobicContact CB-CE2 4.42Å; L352-Y746 HydrophobicContact CB-CG 3.84Å; L352-Y746 HydrophobicContact CD1-CG 4.28Å; L352-Y746 HydrophobicContact CD2-CD1 3.99Å; L352-Y746 HydrophobicContact CD2-CG 4.29Å; L352-Y746 HydrophobicContact CG-CD1 4.34Å; L352-Y746 HydrophobicContact CG-CG 4.35Å; L352-Y746 WeakPolarHBondContact O-CE1 3.43Å; L352-Y746 VanDerWaalsContact O-CZ 3.23Å; L352-Y746 PolarHBondContact O-OH 3.44Å
353	A	71.9	Confident	82.1	Confident	7 Å²	7	59.7 Å²	59.7	6%	0.058	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	5.2	177.8	0	0	0	0	0	115.2	R349 L350 R351 R355 Y746	R349-A353 VanDerWaalsContact O-CB 3.27Å; R349-A353 WeakPolarHBondContact O-CB 3.37Å; R349-A353 PolarHBondContact O-N 3.2Å; L350-A353 CarbonylContact O-C 3.36Å; L350-A353 PolarHBondContact O-N 3.05Å; R351-A353 VanDerWaalsContact C-N 3.33Å; A353-R355 HydrophobicContact CB-CG 4Å; A353-R355 PolarHBondContact O-N 2.94Å; A353-Y746 WeakPolarHBondContact CA-OH 3.37Å
354	N	70.1	Confident	82.2	Confident	117 Å²	117	59.1 Å²	59.1	63%	0.626	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41.7	-171.9	-60.6	-45.9	0	0	0	113.1	L350 R351 L352	L350-N354 PolarHBondContact O-N 2.92Å; R351-N354 PolarHBondContact O-N 3.29Å; L352-N354 PolarHBondContact O-N 2.73Å
355	R	74.3	Confident	82.4	Confident	18 Å²	18	58.8 Å²	58.8	7%	0.068	31%	0.307	C	S	.	.			trans	-107.8	157.5	177.3	-64.8	178.5	-171.2	-115.7	7.2	110.6	N274 L350 A353 L893	N274-R355 PolarHBondContact ND2-NH1 3.15Å; N274-R355 VanDerWaalsContact ND2-NH1 3.14Å; L350-R355 HydrophobicContact CB-CB 4.41Å; L350-R355 HydrophobicContact CD2-CB 3.84Å; L350-R355 PolarHBondContact O-N 3.31Å; A353-R355 HydrophobicContact CB-CG 4Å; A353-R355 PolarHBondContact O-N 2.94Å; R355-L893 PolarHBondContact NH1-O 3.26Å
356	P	75.4	Confident	82.6	Confident	75 Å²	75	59.6 Å²	59.6	49%	0.487	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-53.9	143	174.5	-25.9	35.2	0	0	0	112
357	S	80.8	Confident	82.8	Confident	87 Å²	87	67.1 Å²	67.1	61%	0.608	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-61.4	140.9	172.3	50.5	0	0	0	0	110.8	Q347 L359	Q347-S357 VanDerWaalsContact OE1-CB 3.3Å; S357-L359 PolarHBondContact O-N 3.29Å
358	F	87.6	Confident	83.3	Confident	21 Å²	21	68.7 Å²	68.7	9%	0.092	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-67.1	133.2	173.3	172.8	-122.1	0	0	0	110	M281 Y284 E285 Y343 L346 Q347 L350 P360	M281-F358 HydrophobicContact CB-CD2 4.43Å; M281-F358 HydrophobicContact CB-CE2 4.13Å; M281-F358 HydrophobicContact CE-CB 4.35Å; M281-F358 HydrophobicContact CE-CD2 4.22Å; M281-F358 HydrophobicContact CG-CD2 3.73Å; M281-F358 HydrophobicContact CG-CE2 3.93Å; M281-F358 HydrophobicContact CG-CG 4.23Å; M281-F358 HydrophobicContact SD-CD2 4.32Å; Y284-F358 AromaticContact CD1-CE1 3.58Å; Y284-F358 HydrophobicContact CD1-CE1 3.58Å; Y284-F358 AromaticContact CD1-CZ 3.95Å; Y284-F358 HydrophobicContact CD1-CZ 3.95Å; Y284-F358 HydrophobicContact CE1-CE1 4.08Å; Y284-F358 AromaticContact CG-CE1 3.9Å; Y284-F358 HydrophobicContact CG-CE1 3.9Å; E285-F358 HydrophobicContact CG-CZ 4.27Å; Y343-F358 HydrophobicContact CD2-CD1 4.06Å; Y343-F358 HydrophobicContact CD2-CE1 4.41Å; Y343-F358 HydrophobicContact CE2-CD1 4.17Å; L346-F358 HydrophobicContact CD2-CB 3.8Å; L346-F358 HydrophobicContact CD2-CD1 3.5Å; L346-F358 VanDerWaalsContact CD2-CD1 3.5Å; L346-F358 HydrophobicContact CD2-CD2 4.35Å; L346-F358 HydrophobicContact CD2-CE1 4.13Å; L346-F358 HydrophobicContact CD2-CG 3.62Å; L346-F358 HydrophobicContact CG-CB 4.13Å; L346-F358 HydrophobicContact CG-CG 4.48Å; Q347-F358 PolarHBondContact NE2-O 3.13Å; L350-F358 HydrophobicContact CD1-CB 3.71Å; F358-P360 HydrophobicContact CD1-CG 4.27Å; F358-P360 HydrophobicContact CE1-CB 4.42Å; F358-P360 HydrophobicContact CE1-CG 3.76Å; F358-P360 HydrophobicContact CZ-CB 4.44Å; F358-P360 HydrophobicContact CZ-CG 4.24Å
359	L	88	Confident	84.1	Confident	135 Å²	135	68.1 Å²	68.1	71%	0.707	35%	0.351	S	S	*	.			trans	-117.9	113.3	171.4	-162.3	81.2	0	0	0	107.5	S357	S357-L359 PolarHBondContact O-N 3.29Å
360	P	89.2	Confident	84.6	Confident	10 Å²	10	65.3 Å²	65.3	7%	0.065	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-56.1	162.4	173	-28.6	35.4	0	0	0	114.1	Y284 E285 Y343 F358 H364 M365	Y284-P360 HydrophobicContact CD1-CG 4.38Å; Y284-P360 HydrophobicContact CE1-CB 3.76Å; Y284-P360 HydrophobicContact CE1-CG 3.57Å; E285-P360 VanDerWaalsContact OE1-CA 3.31Å; E285-P360 WeakPolarHBondContact OE1-CA 3.46Å; Y343-P360 HydrophobicContact CD2-CG 4.41Å; Y343-P360 HydrophobicContact CE2-CG 4Å; F358-P360 HydrophobicContact CD1-CG 4.27Å; F358-P360 HydrophobicContact CE1-CB 4.42Å; F358-P360 HydrophobicContact CE1-CG 3.76Å; F358-P360 HydrophobicContact CZ-CB 4.44Å; F358-P360 HydrophobicContact CZ-CG 4.24Å; P360-H364 HydrophobicContact CB-CB 4.08Å; P360-H364 WeakPolarHBondContact CB-O 3.38Å; P360-M365 HydrophobicContact CB-SD 4.07Å; P360-M365 HydrophobicContact CG-SD 3.89Å
361	T	89.8	Confident	85.4	Confident	78 Å²	78	68.6 Å²	68.6	48%	0.479	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-53.4	146.3	164.1	-50.6	0	0	0	0	111.1	E285 G363 H364	E285-T361 VanDerWaalsContact CD-OG1 3.23Å; E285-T361 PolarHBondContact OE1-N 3.46Å; E285-T361 PolarHBondContact OE1-OG1 3.13Å; E285-T361 WeakPolarHBondContact OE2-CB 3.37Å; E285-T361 PolarHBondContact OE2-OG1 3.21Å; T361-G363 PolarHBondContact O-N 3.23Å; T361-H364 WeakPolarHBondContact O-CB 3.28Å; T361-H364 PolarHBondContact O-N 3.26Å
362	E	85.9	Confident	86.2	Confident	192 Å²	192	61.8 Å²	61.8	90%	0.897	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	128.5	176.7	-171.9	177	-179	0	0	111.1	H364	E362-H364 VanDerWaalsContact C-N 3.34Å
363	G	88	Confident	87.3	Confident	33 Å²	33	60.7 Å²	60.7	34%	0.34	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-9.4	-172.7	0	0	0	0	0	115.2	L292 T361 D368	L292-G363 WeakPolarHBondContact CD1-O 3.4Å; T361-G363 PolarHBondContact O-N 3.23Å; G363-D368 VanDerWaalsContact C-OD2 3.24Å; G363-D368 VanDerWaalsContact CA-OD2 3.24Å; G363-D368 WeakPolarHBondContact CA-OD2 3.42Å; G363-D368 WeakPolarHBondContact O-CB 3.38Å
364	H	91.8	Very high	88.3	Confident	34 Å²	34	66.9 Å²	66.9	16%	0.157	36%	0.36	C	S	.	.			trans	-100.4	19.1	175	-63.5	177.8	0	0	0	112.7	Y284 E285 A288 S289 P360 T361 E362	Y284-H364 WeakPolarHBondContact CE1-O 3.36Å; Y284-H364 PolarHBondContact OH-O 3.02Å; E285-H364 IonicContact OE2-CE1 2.69Å; E285-H364 IonicContact OE2-CG 3.56Å; E285-H364 IonicContact OE2-ND1 3.88Å; E285-H364 PolarHBondContact OE2-ND1 2.69Å; A288-H364 HydrophobicContact CB-CB 3.93Å; S289-H364 PolarHBondContact OG-CE1 3.37Å; P360-H364 HydrophobicContact CB-CB 4.08Å; P360-H364 WeakPolarHBondContact CB-O 3.38Å; T361-H364 WeakPolarHBondContact O-CB 3.28Å; T361-H364 PolarHBondContact O-N 3.26Å; E362-H364 VanDerWaalsContact C-N 3.34Å
365	M	91.7	Very high	89.4	Confident	63 Å²	63	66 Å²	66	31%	0.31	35%	0.352	S	S	.	.	S	Bend	trans	-71.8	152.1	174.1	-60.3	-67.3	-72.9	0	0	110.2	P360 E367 D368 I369	P360-M365 HydrophobicContact CB-SD 4.07Å; P360-M365 HydrophobicContact CG-SD 3.89Å; M365-E367 PolarHBondContact O-N 2.81Å; M365-D368 VanDerWaalsContact CB-OD2 3.26Å; M365-D368 WeakPolarHBondContact CB-OD2 3.39Å; M365-D368 PolarHBondContact N-OD2 3.47Å; M365-D368 VanDerWaalsContact N-OD2 3.14Å; M365-D368 WeakPolarHBondContact O-CB 3.45Å; M365-D368 PolarHBondContact O-N 3.29Å; M365-I369 PolarHBondContact O-N 3.39Å; M365-I369 VanDerWaalsContact O-N 3.12Å
366	I	91.7	Very high	90.4	Very high	37 Å²	37	65.1 Å²	65.1	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-55.2	-36.8	174.6	-66.1	179.4	0	0	0	111	Y284 L339 E340 Y343 D368 I369 D370	Y284-I366 HydrophobicContact CE2-CG1 4.46Å; L339-I366 HydrophobicContact CD2-CG1 4.28Å; E340-I366 HydrophobicContact CG-CD1 4.45Å; E340-I366 HydrophobicContact CG-CG2 4.2Å; Y343-I366 HydrophobicContact CD1-CD1 3.39Å; Y343-I366 HydrophobicContact CD1-CG1 4.45Å; Y343-I366 HydrophobicContact CD2-CD1 4.39Å; Y343-I366 HydrophobicContact CE1-CD1 3.97Å; Y343-I366 HydrophobicContact CG-CD1 3.62Å; Y343-I366 HydrophobicContact CG-CG1 4.4Å; I366-D368 PolarHBondContact O-N 3.03Å; I366-I369 PolarHBondContact O-N 3.3Å; I366-D370 WeakPolarHBondContact O-CB 3.36Å; I366-D370 PolarHBondContact O-N 2.92Å
367	E	91.8	Very high	91.1	Very high	159 Å²	159	65.2 Å²	65.2	74%	0.743	34%	0.343	S	S	*	.	H	α-helix	trans	-63.7	-37.4	177.5	-61.3	-174	-178.9	0	0	112.9	M365 S371	M365-E367 PolarHBondContact O-N 2.81Å; E367-S371 WeakPolarHBondContact O-CB 3.4Å; E367-S371 PolarHBondContact O-N 3.33Å
368	D	93.8	Very high	91.6	Very high	67 Å²	67	66.6 Å²	66.6	36%	0.358	34%	0.343	S	S	.	.	H	α-helix	trans	-67.4	-45.3	176.4	-60.1	-44	0	0	0	110.6	G363 M365 I366 S371 A372	G363-D368 VanDerWaalsContact C-OD2 3.24Å; G363-D368 VanDerWaalsContact CA-OD2 3.24Å; G363-D368 WeakPolarHBondContact CA-OD2 3.42Å; G363-D368 WeakPolarHBondContact O-CB 3.38Å; M365-D368 VanDerWaalsContact CB-OD2 3.26Å; M365-D368 WeakPolarHBondContact CB-OD2 3.39Å; M365-D368 PolarHBondContact N-OD2 3.47Å; M365-D368 VanDerWaalsContact N-OD2 3.14Å; M365-D368 WeakPolarHBondContact O-CB 3.45Å; M365-D368 PolarHBondContact O-N 3.29Å; I366-D368 PolarHBondContact O-N 3.03Å; D368-S371 WeakPolarHBondContact O-CB 3.32Å; D368-S371 PolarHBondContact O-N 3.11Å; D368-S371 VanDerWaalsContact O-N 3.16Å; D368-A372 WeakPolarHBondContact O-CB 3.5Å; D368-A372 PolarHBondContact O-N 2.95Å
369	I	93.9	Very high	91.8	Very high	2 Å²	2	68.5 Å²	68.5	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-42.2	178.2	-63.2	166.9	0	0	0	110.8	A288 L291 L292 K336 L339 M365 I366 S371 A372 W373	A288-I369 HydrophobicContact CB-CD1 4.08Å; L291-I369 HydrophobicContact CD2-CG2 3.71Å; L292-I369 HydrophobicContact CD1-CG1 4.34Å; L292-I369 HydrophobicContact CD2-CG1 4.16Å; L292-I369 HydrophobicContact CG-CG1 4.27Å; K336-I369 HydrophobicContact CG-CG2 4.39Å; L339-I369 HydrophobicContact CD1-CD1 3.64Å; L339-I369 HydrophobicContact CD2-CD1 3.59Å; L339-I369 HydrophobicContact CG-CD1 4.3Å; M365-I369 PolarHBondContact O-N 3.39Å; M365-I369 VanDerWaalsContact O-N 3.12Å; I366-I369 PolarHBondContact O-N 3.3Å; I369-S371 VanDerWaalsContact C-N 3.31Å; I369-S371 PolarHBondContact O-N 3.3Å; I369-A372 PolarHBondContact O-N 3.49Å; I369-W373 VanDerWaalsContact O-CB 3.28Å; I369-W373 WeakPolarHBondContact O-CB 3.41Å; I369-W373 PolarHBondContact O-N 2.99Å
370	D	93.4	Very high	92	Very high	34 Å²	34	62.3 Å²	62.3	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-39	172.7	-108.2	10.9	0	0	0	112.1	K336 I366 R374	K336-D370 WeakPolarHBondContact CE-OD1 3.3Å; K336-D370 IonicContact NZ-OD1 3.81Å; K336-D370 PolarHBondContact NZ-OD1 2.91Å; I366-D370 WeakPolarHBondContact O-CB 3.36Å; I366-D370 PolarHBondContact O-N 2.92Å; D370-R374 WeakPolarHBondContact O-CB 3.3Å; D370-R374 VanDerWaalsContact O-CG 3.23Å; D370-R374 WeakPolarHBondContact O-CG 3.14Å; D370-R374 PolarHBondContact O-N 2.73Å; D370-R374 IonicContact OD2-CZ 2.85Å; D370-R374 IonicContact OD2-NH2 3.67Å; D370-R374 PolarHBondContact OD2-NH2 3.3Å
371	S	94.9	Very high	91.6	Very high	75 Å²	75	69 Å²	69	52%	0.524	35%	0.346	S	S	.	.	H	α-helix	trans	-66.9	-47.7	177.2	-168.7	0	0	0	0	111.6	E367 D368 I369 W373 R374 Q375	E367-S371 WeakPolarHBondContact O-CB 3.4Å; E367-S371 PolarHBondContact O-N 3.33Å; D368-S371 WeakPolarHBondContact O-CB 3.32Å; D368-S371 PolarHBondContact O-N 3.11Å; D368-S371 VanDerWaalsContact O-N 3.16Å; I369-S371 VanDerWaalsContact C-N 3.31Å; I369-S371 PolarHBondContact O-N 3.3Å; S371-W373 PolarHBondContact O-N 3.21Å; S371-R374 PolarHBondContact O-N 3.45Å; S371-Q375 PolarHBondContact O-N 3.1Å
372	A	95.2	Very high	91.5	Very high	20 Å²	20	66.8 Å²	66.8	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-42.7	176.5	0	0	0	0	0	111.8	L292 I295 D368 I369 Q375 L376	L292-A372 HydrophobicContact CD2-CB 3.91Å; I295-A372 HydrophobicContact CD1-CB 3.89Å; I295-A372 HydrophobicContact CG2-CB 4.24Å; D368-A372 WeakPolarHBondContact O-CB 3.5Å; D368-A372 PolarHBondContact O-N 2.95Å; I369-A372 PolarHBondContact O-N 3.49Å; A372-Q375 WeakPolarHBondContact O-CB 3.17Å; A372-Q375 PolarHBondContact O-N 3.4Å; A372-L376 PolarHBondContact O-N 3.39Å
373	W	94.7	Very high	91.8	Very high	11 Å²	11	57.7 Å²	57.7	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-43.5	177.2	-169.5	-85.6	0	0	0	112.4	L291 W294 I295 K329 R332 L333 K336 I369 S371 Q375 L376 E377	L291-W373 HydrophobicContact CD1-CE3 4.45Å; L291-W373 HydrophobicContact CD1-CZ3 4.06Å; W294-W373 HydrophobicContact CZ3-CH2 4.41Å; W294-W373 AromaticContact CZ3-CZ3 3.9Å; W294-W373 HydrophobicContact CZ3-CZ3 3.9Å; I295-W373 HydrophobicContact CD1-CE3 4.22Å; K329-W373 HydrophobicContact CG-CH2 4.31Å; R332-W373 HydrophobicContact CB-CH2 4.31Å; R332-W373 HydrophobicContact CB-CZ3 4.23Å; L333-W373 HydrophobicContact CB-CH2 4.06Å; L333-W373 HydrophobicContact CB-CZ2 4.09Å; L333-W373 HydrophobicContact CD1-CH2 4.5Å; L333-W373 HydrophobicContact CD1-CZ2 3.86Å; K336-W373 HydrophobicContact CD-CB 4.27Å; K336-W373 HydrophobicContact CD-CD2 3.68Å; K336-W373 HydrophobicContact CD-CE3 3.93Å; K336-W373 HydrophobicContact CD-CG 3.82Å; I369-W373 VanDerWaalsContact O-CB 3.28Å; I369-W373 WeakPolarHBondContact O-CB 3.41Å; I369-W373 PolarHBondContact O-N 2.99Å; S371-W373 PolarHBondContact O-N 3.21Å; W373-Q375 VanDerWaalsContact C-N 3.26Å; W373-Q375 PolarHBondContact O-N 3.01Å; W373-L376 HydrophobicContact CE3-CD2 4.44Å; W373-L376 VanDerWaalsContact O-CB 3.3Å; W373-L376 WeakPolarHBondContact O-CB 3.21Å; W373-L376 PolarHBondContact O-N 2.92Å; W373-L376 VanDerWaalsContact O-N 3.17Å; W373-E377 VanDerWaalsContact CD1-CD 3.44Å; W373-E377 VanDerWaalsContact CD1-OE1 3.25Å; W373-E377 PolarHBondContact NE1-OE1 3.19Å; W373-E377 WeakPolarHBondContact O-CG 3.45Å; W373-E377 PolarHBondContact O-N 3.12Å
374	R	93.2	Very high	91.7	Very high	136 Å²	136	57.5 Å²	57.5	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-34.5	172.8	-72.7	171	-165.5	128	13.3	112.2	D370 S371 N378	D370-R374 WeakPolarHBondContact O-CB 3.3Å; D370-R374 VanDerWaalsContact O-CG 3.23Å; D370-R374 WeakPolarHBondContact O-CG 3.14Å; D370-R374 PolarHBondContact O-N 2.73Å; D370-R374 IonicContact OD2-CZ 2.85Å; D370-R374 IonicContact OD2-NH2 3.67Å; D370-R374 PolarHBondContact OD2-NH2 3.3Å; S371-R374 PolarHBondContact O-N 3.45Å; R374-N378 PolarHBondContact O-N 3.4Å; R374-N378 VanDerWaalsContact O-N 3.13Å; R374-N378 PolarHBondContact O-ND2 3.17Å
375	Q	93.7	Very high	91.4	Very high	99 Å²	99	61.2 Å²	61.2	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-42.2	175.6	-177.7	176.8	78.9	0	0	111.3	S371 A372 W373 N378 Y379	S371-Q375 PolarHBondContact O-N 3.1Å; A372-Q375 WeakPolarHBondContact O-CB 3.17Å; A372-Q375 PolarHBondContact O-N 3.4Å; W373-Q375 VanDerWaalsContact C-N 3.26Å; W373-Q375 PolarHBondContact O-N 3.01Å; Q375-N378 PolarHBondContact O-N 3.21Å; Q375-Y379 HydrophobicContact CG-CD2 4.02Å; Q375-Y379 HydrophobicContact CG-CE2 3.64Å; Q375-Y379 VanDerWaalsContact O-CD2 3.24Å; Q375-Y379 WeakPolarHBondContact O-CD2 3.48Å; Q375-Y379 PolarHBondContact O-N 3.15Å
376	L	94.2	Very high	91.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.7	-52.4	173.6	-171.3	74.4	0	0	0	111.4	W294 I295 Q298 I299 L302 A372 W373 N378 Y379 E380	W294-L376 HydrophobicContact CH2-CD2 4Å; W294-L376 HydrophobicContact CZ3-CD2 3.62Å; I295-L376 HydrophobicContact CG1-CD2 4.47Å; I295-L376 HydrophobicContact CG2-CB 4.37Å; I295-L376 HydrophobicContact CG2-CD1 4.43Å; Q298-L376 HydrophobicContact CB-CD1 3.99Å; I299-L376 HydrophobicContact CG1-CD1 4.32Å; L302-L376 HydrophobicContact CD1-CD1 3.46Å; L302-L376 VanDerWaalsContact CD1-CD1 3.46Å; L302-L376 HydrophobicContact CD1-CG 4.2Å; A372-L376 PolarHBondContact O-N 3.39Å; W373-L376 HydrophobicContact CE3-CD2 4.44Å; W373-L376 VanDerWaalsContact O-CB 3.3Å; W373-L376 WeakPolarHBondContact O-CB 3.21Å; W373-L376 PolarHBondContact O-N 2.92Å; W373-L376 VanDerWaalsContact O-N 3.17Å; L376-N378 VanDerWaalsContact C-N 3.3Å; L376-N378 PolarHBondContact O-N 2.65Å; L376-Y379 PolarHBondContact O-N 3.41Å; L376-E380 PolarHBondContact O-N 2.82Å
377	E	91	Very high	91.4	Very high	77 Å²	77	59 Å²	59	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-37.5	-179.3	-69.4	174.7	155.1	0	0	113	W373 E380 K381	W373-E377 VanDerWaalsContact CD1-CD 3.44Å; W373-E377 VanDerWaalsContact CD1-OE1 3.25Å; W373-E377 PolarHBondContact NE1-OE1 3.19Å; W373-E377 WeakPolarHBondContact O-CG 3.45Å; W373-E377 PolarHBondContact O-N 3.12Å; E377-E380 WeakPolarHBondContact CA-OE2 3.35Å; E377-E380 PolarHBondContact O-N 3.22Å; E377-K381 PolarHBondContact O-N 2.54Å; E377-K381 VanDerWaalsContact O-N 3.08Å
378	N	89.4	Confident	91.1	Very high	115 Å²	115	53.5 Å²	53.5	62%	0.615	27%	0.27	S	S	*	.	H	α-helix	trans	-65.3	-37.5	174.6	-78.3	-57	0	0	0	112.4	R374 Q375 L376 G382	R374-N378 PolarHBondContact O-N 3.4Å; R374-N378 VanDerWaalsContact O-N 3.13Å; R374-N378 PolarHBondContact O-ND2 3.17Å; Q375-N378 PolarHBondContact O-N 3.21Å; L376-N378 VanDerWaalsContact C-N 3.3Å; L376-N378 PolarHBondContact O-N 2.65Å; N378-G382 PolarHBondContact O-N 3.02Å
379	Y	92.9	Very high	90.9	Very high	62 Å²	62	52.9 Å²	52.9	24%	0.243	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-39.9	175.3	-75	-57	0	0	0	112.5	I299 K303 R305 Q375 L376 G382 F383	I299-Y379 HydrophobicContact CG1-CD2 4.14Å; I299-Y379 HydrophobicContact CG1-CE2 4.36Å; I299-Y379 HydrophobicContact CG2-CD2 4.09Å; I299-Y379 HydrophobicContact CG2-CE2 3.75Å; K303-Y379 HydrophobicContact CB-CD1 4.34Å; K303-Y379 HydrophobicContact CB-CE1 4.29Å; K303-Y379 HydrophobicContact CD-CE1 4.16Å; K303-Y379 HydrophobicContact CG-CE1 4.11Å; R305-Y379 PolarHBondContact NH2-O 3.24Å; Q375-Y379 HydrophobicContact CG-CD2 4.02Å; Q375-Y379 HydrophobicContact CG-CE2 3.64Å; Q375-Y379 VanDerWaalsContact O-CD2 3.24Å; Q375-Y379 WeakPolarHBondContact O-CD2 3.48Å; Q375-Y379 PolarHBondContact O-N 3.15Å; L376-Y379 PolarHBondContact O-N 3.41Å; Y379-G382 PolarHBondContact O-N 3Å; Y379-F383 VanDerWaalsContact O-CB 3.3Å; Y379-F383 WeakPolarHBondContact O-CB 3.38Å; Y379-F383 PolarHBondContact O-N 2.95Å
380	E	91	Very high	90.8	Very high	5 Å²	5	53.8 Å²	53.8	2%	0.023	28%	0.279	C	S	.	.	H	α-helix	trans	-56.9	-52.2	174.8	-72.4	178.4	104.8	0	0	111.8	L302 Y324 R325 K329 L376 E377 G382 F383 E384	L302-E380 HydrophobicContact CD1-CG 3.83Å; L302-E380 HydrophobicContact CD2-CG 4.12Å; Y324-E380 HydrophobicContact CE1-CG 4.2Å; Y324-E380 WeakPolarHBondContact CE1-OE1 3.26Å; R325-E380 WeakPolarHBondContact CD-OE1 3.33Å; R325-E380 IonicContact NE-OE1 3.73Å; K329-E380 WeakPolarHBondContact CD-OE1 3.16Å; K329-E380 IonicContact NZ-OE1 3.58Å; K329-E380 PolarHBondContact NZ-OE1 3.35Å; K329-E380 IonicContact NZ-OE2 2.82Å; K329-E380 PolarHBondContact NZ-OE2 3.01Å; L376-E380 PolarHBondContact O-N 2.82Å; E377-E380 WeakPolarHBondContact CA-OE2 3.35Å; E377-E380 PolarHBondContact O-N 3.22Å; E380-G382 VanDerWaalsContact C-N 3.31Å; E380-G382 PolarHBondContact O-N 3.01Å; E380-F383 WeakPolarHBondContact O-CB 3.32Å; E380-F383 PolarHBondContact O-N 3.01Å; E380-E384 PolarHBondContact O-N 3.17Å; E380-E384 VanDerWaalsContact O-N 3.11Å
381	K	82.8	Confident	90.6	Very high	151 Å²	151	52.5 Å²	52.5	66%	0.657	27%	0.272	S	S	*	.	H	α-helix	trans	-55.1	-47.7	-179.6	-175.6	178.7	-178.6	178.2	0	111.7	E377 F383 D385	E377-K381 PolarHBondContact O-N 2.54Å; E377-K381 VanDerWaalsContact O-N 3.08Å; K381-F383 VanDerWaalsContact C-N 3.27Å; K381-F383 PolarHBondContact O-N 3.39Å; K381-D385 PolarHBondContact O-N 2.88Å
382	G	87.1	Confident	90.3	Very high	31 Å²	31	53 Å²	53	32%	0.32	26%	0.264	S	S	.	.	H	α-helix	trans	-75.6	-8.6	177.6	0	0	0	0	0	115	R305 N378 Y379 E380 W386	R305-G382 PolarHBondContact NE-O 2.86Å; R305-G382 PolarHBondContact NH2-O 3.24Å; N378-G382 PolarHBondContact O-N 3.02Å; Y379-G382 PolarHBondContact O-N 3Å; E380-G382 VanDerWaalsContact C-N 3.31Å; E380-G382 PolarHBondContact O-N 3.01Å; G382-W386 WeakPolarHBondContact O-CB 3.42Å
383	F	92	Very high	90.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-87.6	-49.4	177.5	179.9	-80.7	0	0	0	110.6	F301 L302 K317 Y321 Y379 E380 K381 W386 L387	F301-F383 HydrophobicContact CE1-CE1 4.45Å; F301-F383 HydrophobicContact CE1-CE2 4.23Å; F301-F383 AromaticContact CE1-CZ 3.86Å; F301-F383 HydrophobicContact CE1-CZ 3.86Å; F301-F383 HydrophobicContact CE2-CZ 4.39Å; F301-F383 HydrophobicContact CZ-CE2 4.29Å; F301-F383 AromaticContact CZ-CZ 3.73Å; F301-F383 HydrophobicContact CZ-CZ 3.73Å; F301-F383 WeakPolarHBondContact O-CE2 3.22Å; L302-F383 HydrophobicContact CD2-CG 4.36Å; K317-F383 HydrophobicContact CD-CZ 4.36Å; K317-F383 HydrophobicContact CG-CZ 3.96Å; Y321-F383 HydrophobicContact CD1-CD1 4.26Å; Y321-F383 HydrophobicContact CD1-CE1 4.25Å; Y321-F383 AromaticContact CD2-CD1 3.63Å; Y321-F383 HydrophobicContact CD2-CD1 3.63Å; Y321-F383 AromaticContact CD2-CE1 3.67Å; Y321-F383 HydrophobicContact CD2-CE1 3.67Å; Y321-F383 HydrophobicContact CE1-CD1 4.49Å; Y321-F383 AromaticContact CE2-CD1 3.9Å; Y321-F383 HydrophobicContact CE2-CD1 3.9Å; Y321-F383 HydrophobicContact CE2-CE1 4.41Å; Y321-F383 AromaticContact CG-CD1 3.82Å; Y321-F383 HydrophobicContact CG-CD1 3.82Å; Y321-F383 AromaticContact CG-CE1 3.57Å; Y321-F383 HydrophobicContact CG-CE1 3.57Å; Y379-F383 VanDerWaalsContact O-CB 3.3Å; Y379-F383 WeakPolarHBondContact O-CB 3.38Å; Y379-F383 PolarHBondContact O-N 2.95Å; E380-F383 WeakPolarHBondContact O-CB 3.32Å; E380-F383 PolarHBondContact O-N 3.01Å; K381-F383 VanDerWaalsContact C-N 3.27Å; K381-F383 PolarHBondContact O-N 3.39Å; F383-W386 HydrophobicContact CE2-CZ3 4.45Å; F383-W386 PolarHBondContact O-N 2.94Å; F383-L387 HydrophobicContact CD1-CD2 4.43Å; F383-L387 HydrophobicContact CE1-CD2 3.6Å; F383-L387 HydrophobicContact CZ-CD2 4.09Å; F383-L387 WeakPolarHBondContact O-CB 3.47Å; F383-L387 PolarHBondContact O-N 3.48Å
384	E	85.2	Confident	89.9	Confident	29 Å²	29	55.1 Å²	55.1	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-46	-179.1	-170.5	163.6	-171	0	0	111.6	Y321 R325 E380 W386 L387 V388 Q702 R720	Y321-E384 HydrophobicContact CE1-CB 3.77Å; Y321-E384 HydrophobicContact CE1-CG 3.93Å; Y321-E384 WeakPolarHBondContact CE1-OE2 3.43Å; Y321-E384 PolarHBondContact OH-OE2 2.96Å; R325-E384 IonicContact NH1-OE2 2.79Å; R325-E384 PolarHBondContact NH1-OE2 3.25Å; E380-E384 PolarHBondContact O-N 3.17Å; E380-E384 VanDerWaalsContact O-N 3.11Å; E384-W386 PolarHBondContact O-N 3.23Å; E384-L387 PolarHBondContact O-N 3.14Å; E384-V388 WeakPolarHBondContact O-CB 2.92Å; E384-V388 WeakPolarHBondContact O-CG2 3.45Å; E384-V388 PolarHBondContact O-N 3.06Å; E384-Q702 PolarHBondContact OE1-NE2 3.42Å; E384-R720 IonicContact OE2-NH1 3.77Å
385	D	85.2	Confident	89.6	Confident	112 Å²	112	50.4 Å²	50.4	60%	0.599	25%	0.253	S	S	*	.	H	α-helix	trans	-57.9	-45.7	176.3	-78.7	-19.3	0	0	0	112	K381 A389	K381-D385 PolarHBondContact O-N 2.88Å; D385-A389 WeakPolarHBondContact O-CB 3.36Å; D385-A389 PolarHBondContact O-N 3.34Å; D385-A389 VanDerWaalsContact O-N 3.1Å
386	W	93.2	Very high	89.4	Confident	53 Å²	53	49.6 Å²	49.6	20%	0.201	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-47.6	177.5	162.9	76.8	0	0	0	111.6	R305 T306 T307 K317 G382 F383 E384 V388 A389 E390	R305-W386 HydrophobicContact CB-CD2 4.23Å; R305-W386 HydrophobicContact CB-CZ2 4.36Å; R305-W386 HydrophobicContact CG-CD2 4.42Å; R305-W386 WeakPolarHBondContact O-CZ2 3.16Å; T306-W386 WeakPolarHBondContact O-CH2 3.38Å; T307-W386 HydrophobicContact CG2-CH2 3.7Å; T307-W386 HydrophobicContact CG2-CZ2 3.91Å; K317-W386 HydrophobicContact CD-CH2 4.41Å; K317-W386 HydrophobicContact CD-CZ3 4.4Å; G382-W386 WeakPolarHBondContact O-CB 3.42Å; F383-W386 HydrophobicContact CE2-CZ3 4.45Å; F383-W386 PolarHBondContact O-N 2.94Å; E384-W386 PolarHBondContact O-N 3.23Å; W386-V388 PolarHBondContact O-N 2.89Å; W386-A389 PolarHBondContact O-N 3.13Å; W386-E390 HydrophobicContact CZ2-CB 4.46Å; W386-E390 HydrophobicContact CZ2-CG 4.29Å; W386-E390 WeakPolarHBondContact O-CB 3.47Å; W386-E390 PolarHBondContact O-N 2.67Å
387	L	90.5	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.7	-37.8	-174.1	-174.4	55.5	0	0	0	112	A314 K317 L318 F383 E384 E390 I391	A314-L387 HydrophobicContact CB-CD1 4.36Å; K317-L387 HydrophobicContact CB-CD1 4.42Å; K317-L387 HydrophobicContact CB-CD2 4.39Å; K317-L387 HydrophobicContact CG-CD1 4.49Å; K317-L387 HydrophobicContact CG-CD2 4.19Å; L318-L387 HydrophobicContact CB-CD2 3.82Å; L318-L387 HydrophobicContact CB-CG 4.37Å; L318-L387 HydrophobicContact CD1-CD2 4.06Å; F383-L387 HydrophobicContact CD1-CD2 4.43Å; F383-L387 HydrophobicContact CE1-CD2 3.6Å; F383-L387 HydrophobicContact CZ-CD2 4.09Å; F383-L387 WeakPolarHBondContact O-CB 3.47Å; F383-L387 PolarHBondContact O-N 3.48Å; E384-L387 PolarHBondContact O-N 3.14Å; L387-E390 PolarHBondContact O-N 3Å; L387-I391 HydrophobicContact CG-CD1 4.46Å; L387-I391 WeakPolarHBondContact O-CG1 3.45Å; L387-I391 PolarHBondContact O-N 3.42Å
388	V	86.8	Confident	89.1	Confident	44 Å²	44	52.6 Å²	52.6	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-70	-33.4	174.1	171.9	0	0	0	0	111.8	E384 W386 K392	E384-V388 WeakPolarHBondContact O-CB 2.92Å; E384-V388 WeakPolarHBondContact O-CG2 3.45Å; E384-V388 PolarHBondContact O-N 3.06Å; W386-V388 PolarHBondContact O-N 2.89Å; V388-K392 WeakPolarHBondContact O-CD 3.38Å; V388-K392 WeakPolarHBondContact O-CG 3.12Å; V388-K392 PolarHBondContact O-N 3.06Å
389	A	88.9	Confident	89	Confident	54 Å²	54	49.5 Å²	49.5	45%	0.446	24%	0.243	S	C	.	.	H	α-helix	trans	-69.1	-40.4	172.4	0	0	0	0	0	111.9	D385 W386 K392 R393	D385-A389 WeakPolarHBondContact O-CB 3.36Å; D385-A389 PolarHBondContact O-N 3.34Å; D385-A389 VanDerWaalsContact O-N 3.1Å; W386-A389 PolarHBondContact O-N 3.13Å; A389-K392 PolarHBondContact O-N 2.66Å; A389-R393 PolarHBondContact O-N 2.98Å
390	E	91.2	Very high	88.9	Confident	22 Å²	22	46.7 Å²	46.7	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-43	179.6	178.5	59.5	-174.2	0	0	112.2	T307 W386 L387 K392 R393 L394	T307-E390 HydrophobicContact CG2-CG 3.78Å; T307-E390 PolarHBondContact OG1-OE1 3.45Å; W386-E390 HydrophobicContact CZ2-CB 4.46Å; W386-E390 HydrophobicContact CZ2-CG 4.29Å; W386-E390 WeakPolarHBondContact O-CB 3.47Å; W386-E390 PolarHBondContact O-N 2.67Å; L387-E390 PolarHBondContact O-N 3Å; E390-K392 VanDerWaalsContact C-N 3.29Å; E390-K392 PolarHBondContact O-N 3.03Å; E390-R393 WeakPolarHBondContact O-CB 3.25Å; E390-R393 PolarHBondContact O-N 2.67Å; E390-R393 VanDerWaalsContact O-N 3.15Å; E390-R393 IonicContact OE1-CZ 2.68Å; E390-R393 IonicContact OE1-NE 2.71Å; E390-R393 IonicContact OE1-NH2 3.98Å; E390-R393 PolarHBondContact OE1-NH2 3.2Å; E390-R393 IonicContact OE2-CZ 2.7Å; E390-R393 IonicContact OE2-NE 3.96Å; E390-R393 PolarHBondContact OE2-NE 3.08Å; E390-R393 IonicContact OE2-NH2 2.82Å; E390-R393 PolarHBondContact OE2-NH2 3.44Å; E390-L394 HydrophobicContact CG-CD1 4.13Å; E390-L394 VanDerWaalsContact O-CG 3.3Å; E390-L394 WeakPolarHBondContact O-CG 3.16Å; E390-L394 PolarHBondContact O-N 3.36Å
391	I	90	Very high	88.9	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-56.3	-44.4	174.1	-70.6	166.3	0	0	0	110.9	A314 R315 L318 L387 L394 E395 L705	A314-I391 HydrophobicContact CB-CD1 4.48Å; A314-I391 HydrophobicContact CB-CG1 3.66Å; R315-I391 HydrophobicContact CG-CD1 4.38Å; L318-I391 HydrophobicContact CB-CD1 4.33Å; L318-I391 HydrophobicContact CD2-CD1 3.92Å; L387-I391 HydrophobicContact CG-CD1 4.46Å; L387-I391 WeakPolarHBondContact O-CG1 3.45Å; L387-I391 PolarHBondContact O-N 3.42Å; I391-L394 PolarHBondContact O-N 3.43Å; I391-E395 WeakPolarHBondContact O-CG 3.41Å; I391-E395 PolarHBondContact O-N 3.18Å; I391-L705 HydrophobicContact CG2-CD2 4.03Å
392	K	87.1	Confident	89.2	Confident	84 Å²	84	46 Å²	46	37%	0.365	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-40.3	177.1	-65.5	165.8	-168.1	166.8	0	112.6	V388 A389 E390 L394 E395 Q396 T707	V388-K392 WeakPolarHBondContact O-CD 3.38Å; V388-K392 WeakPolarHBondContact O-CG 3.12Å; V388-K392 PolarHBondContact O-N 3.06Å; A389-K392 PolarHBondContact O-N 2.66Å; E390-K392 VanDerWaalsContact C-N 3.29Å; E390-K392 PolarHBondContact O-N 3.03Å; K392-L394 VanDerWaalsContact C-N 3.33Å; K392-E395 PolarHBondContact O-N 2.95Å; K392-Q396 WeakPolarHBondContact O-CB 3.34Å; K392-Q396 PolarHBondContact O-N 3.01Å; K392-T707 HydrophobicContact CD-CG2 4.46Å; K392-T707 VanDerWaalsContact CE-CG2 3.4Å; K392-T707 VanDerWaalsContact NZ-CG2 3.32Å
393	R	91.1	Very high	89.3	Confident	66 Å²	66	47.5 Å²	47.5	25%	0.249	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-46.9	176.2	-172.3	-170.6	69.2	93.3	3.1	110.4	A389 E390 Q396 I397 L469 N470	A389-R393 PolarHBondContact O-N 2.98Å; E390-R393 WeakPolarHBondContact O-CB 3.25Å; E390-R393 PolarHBondContact O-N 2.67Å; E390-R393 VanDerWaalsContact O-N 3.15Å; E390-R393 IonicContact OE1-CZ 2.68Å; E390-R393 IonicContact OE1-NE 2.71Å; E390-R393 IonicContact OE1-NH2 3.98Å; E390-R393 PolarHBondContact OE1-NH2 3.2Å; E390-R393 IonicContact OE2-CZ 2.7Å; E390-R393 IonicContact OE2-NE 3.96Å; E390-R393 PolarHBondContact OE2-NE 3.08Å; E390-R393 IonicContact OE2-NH2 2.82Å; E390-R393 PolarHBondContact OE2-NH2 3.44Å; R393-Q396 PolarHBondContact O-N 3.21Å; R393-I397 HydrophobicContact CG-CD1 4.18Å; R393-I397 VanDerWaalsContact NH1-CD1 3.26Å; R393-I397 WeakPolarHBondContact O-CG1 3.41Å; R393-I397 PolarHBondContact O-N 3.24Å; R393-L469 HydrophobicContact CG-CD2 4.22Å; R393-L469 PolarHBondContact NH1-O 3.46Å; R393-N470 PolarHBondContact NH1-O 3.42Å
394	L	90.6	Very high	89.3	Confident	10 Å²	10	48 Å²	48	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-66.5	-39.2	-179.8	-65.3	173.8	0	0	0	112.3	G309 I311 A314 E390 I391 K392 I397 E398	G309-L394 WeakPolarHBondContact O-CD2 3.5Å; I311-L394 HydrophobicContact CG1-CB 3.58Å; A314-L394 HydrophobicContact CB-CD1 4.01Å; E390-L394 HydrophobicContact CG-CD1 4.13Å; E390-L394 VanDerWaalsContact O-CG 3.3Å; E390-L394 WeakPolarHBondContact O-CG 3.16Å; E390-L394 PolarHBondContact O-N 3.36Å; I391-L394 PolarHBondContact O-N 3.43Å; K392-L394 VanDerWaalsContact C-N 3.33Å; L394-I397 PolarHBondContact O-N 2.88Å; L394-E398 PolarHBondContact O-N 2.95Å
395	E	87.2	Confident	89.6	Confident	38 Å²	38	53.9 Å²	53.9	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-38.1	173.8	-74	169.5	168.4	0	0	112.8	I311 R315 I391 K392 E398 Y399 L705	I311-E395 HydrophobicContact CD1-CB 4.42Å; I311-E395 HydrophobicContact CD1-CG 3.69Å; I311-E395 HydrophobicContact CG1-CG 4.1Å; I311-E395 HydrophobicContact CG2-CG 4.29Å; R315-E395 IonicContact CZ-OE1 2.71Å; R315-E395 IonicContact NE-OE1 2.62Å; R315-E395 IonicContact NH2-OE1 3.43Å; R315-E395 PolarHBondContact NH2-OE1 3.02Å; I391-E395 WeakPolarHBondContact O-CG 3.41Å; I391-E395 PolarHBondContact O-N 3.18Å; K392-E395 PolarHBondContact O-N 2.95Å; E395-E398 PolarHBondContact O-N 2.69Å; E395-Y399 WeakPolarHBondContact O-CB 3.27Å; E395-Y399 PolarHBondContact O-N 3.15Å; E395-Y399 VanDerWaalsContact O-N 3.09Å; E395-L705 WeakPolarHBondContact OE2-CD1 3.2Å; E395-L705 VanDerWaalsContact OE2-CD2 3.23Å; E395-L705 WeakPolarHBondContact OE2-CD2 3.23Å
396	Q	89.4	Confident	89.7	Confident	82 Å²	82	53.7 Å²	53.7	38%	0.383	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-42.8	172.1	-176	176.5	-1.4	0	0	111.2	K392 R393 Y399 L400 E465 L469	K392-Q396 WeakPolarHBondContact O-CB 3.34Å; K392-Q396 PolarHBondContact O-N 3.01Å; R393-Q396 PolarHBondContact O-N 3.21Å; Q396-Y399 PolarHBondContact O-N 3.16Å; Q396-L400 HydrophobicContact CG-CD1 3.82Å; Q396-L400 HydrophobicContact CG-CG 4.34Å; Q396-L400 WeakPolarHBondContact O-CB 3.48Å; Q396-L400 VanDerWaalsContact O-CG 3.25Å; Q396-L400 WeakPolarHBondContact O-CG 3.01Å; Q396-L400 PolarHBondContact O-N 3.47Å; Q396-E465 PolarHBondContact NE2-OE1 3.44Å; Q396-L469 HydrophobicContact CG-CD1 3.85Å
397	I	90.9	Very high	89.5	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-48.7	175.4	-74.4	169.7	0	0	0	111.3	R393 L394 Y399 L400 A401 L469 Y471	R393-I397 HydrophobicContact CG-CD1 4.18Å; R393-I397 VanDerWaalsContact NH1-CD1 3.26Å; R393-I397 WeakPolarHBondContact O-CG1 3.41Å; R393-I397 PolarHBondContact O-N 3.24Å; L394-I397 PolarHBondContact O-N 2.88Å; I397-Y399 VanDerWaalsContact C-N 3.32Å; I397-Y399 PolarHBondContact O-N 3.5Å; I397-L400 PolarHBondContact O-N 3.24Å; I397-A401 VanDerWaalsContact O-CB 3.27Å; I397-A401 WeakPolarHBondContact O-CB 3.5Å; I397-A401 PolarHBondContact O-N 2.88Å; I397-L469 HydrophobicContact CD1-CB 4.05Å; I397-L469 HydrophobicContact CG1-CB 3.87Å; I397-L469 HydrophobicContact CG1-CD1 4.07Å; I397-Y471 HydrophobicContact CG2-CD2 3.35Å; I397-Y471 HydrophobicContact CG2-CE2 3.83Å; I397-Y471 HydrophobicContact CG2-CG 4.05Å
398	E	88.5	Confident	89.5	Confident	126 Å²	126	53.2 Å²	53.2	59%	0.589	25%	0.252	S	S	*	.	H	α-helix	trans	-59.7	-43.7	179.5	-168.6	-171.2	170.6	0	0	111.3	I311 L394 E395 K402	I311-E398 HydrophobicContact CD1-CB 4.23Å; I311-E398 WeakPolarHBondContact CD1-OE2 3.29Å; L394-E398 PolarHBondContact O-N 2.95Å; E395-E398 PolarHBondContact O-N 2.69Å; E398-K402 VanDerWaalsContact O-CB 3.3Å; E398-K402 WeakPolarHBondContact O-CB 3.36Å; E398-K402 PolarHBondContact O-N 3.05Å
399	Y	87.2	Confident	89.7	Confident	50 Å²	50	55.3 Å²	55.3	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-48.9	175.8	170.1	-110.1	0	0	0	112.4	E395 Q396 I397 K402 K403 M540 I542	E395-Y399 WeakPolarHBondContact O-CB 3.27Å; E395-Y399 PolarHBondContact O-N 3.15Å; E395-Y399 VanDerWaalsContact O-N 3.09Å; Q396-Y399 PolarHBondContact O-N 3.16Å; I397-Y399 VanDerWaalsContact C-N 3.32Å; I397-Y399 PolarHBondContact O-N 3.5Å; Y399-K402 PolarHBondContact O-N 2.76Å; Y399-K403 HydrophobicContact CE1-CD 4.28Å; Y399-K403 WeakPolarHBondContact O-CB 3.5Å; Y399-K403 PolarHBondContact O-N 2.94Å; Y399-M540 HydrophobicContact CD2-CE 4.36Å; Y399-M540 HydrophobicContact CE2-CB 4.44Å; Y399-M540 HydrophobicContact CE2-CE 3.96Å; Y399-M540 HydrophobicContact CE2-SD 4.09Å; Y399-I542 HydrophobicContact CD1-CD1 4.05Å; Y399-I542 HydrophobicContact CE1-CD1 3.61Å; Y399-I542 HydrophobicContact CE2-CD1 4.27Å
400	L	91.4	Very high	89.6	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-41.9	-179.3	-70.7	170.9	0	0	0	112.3	Q396 I397 K402 K403 F404 I462 E465 L466 L469	Q396-L400 HydrophobicContact CG-CD1 3.82Å; Q396-L400 HydrophobicContact CG-CG 4.34Å; Q396-L400 WeakPolarHBondContact O-CB 3.48Å; Q396-L400 VanDerWaalsContact O-CG 3.25Å; Q396-L400 WeakPolarHBondContact O-CG 3.01Å; Q396-L400 PolarHBondContact O-N 3.47Å; I397-L400 PolarHBondContact O-N 3.24Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 PolarHBondContact O-N 3.28Å; L400-K403 WeakPolarHBondContact O-CB 3.47Å; L400-K403 PolarHBondContact O-N 3.49Å; L400-F404 WeakPolarHBondContact O-CB 3.31Å; L400-F404 PolarHBondContact O-N 3.41Å; L400-I462 HydrophobicContact CB-CG2 4.48Å; L400-I462 HydrophobicContact CD2-CG2 4.35Å; L400-E465 HydrophobicContact CD1-CB 4.27Å; L400-E465 VanDerWaalsContact CD1-CD 3.43Å; L400-E465 HydrophobicContact CD1-CG 3.69Å; L400-E465 WeakPolarHBondContact CD1-OE1 3.37Å; L400-E465 WeakPolarHBondContact CD2-OE2 3.37Å; L400-L466 HydrophobicContact CB-CD2 3.64Å; L400-L466 HydrophobicContact CB-CG 4Å; L400-L466 HydrophobicContact CD1-CD2 4.41Å; L400-L469 HydrophobicContact CD1-CD1 3.45Å; L400-L469 VanDerWaalsContact CD1-CD1 3.45Å
401	A	91	Very high	89.5	Confident	19 Å²	19	54.5 Å²	54.5	16%	0.157	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-42.2	176.6	0	0	0	0	0	111.3	I397 R405 Y471	I397-A401 VanDerWaalsContact O-CB 3.27Å; I397-A401 WeakPolarHBondContact O-CB 3.5Å; I397-A401 PolarHBondContact O-N 2.88Å; A401-R405 WeakPolarHBondContact O-CB 3.3Å; A401-R405 PolarHBondContact O-N 3.15Å; A401-Y471 HydrophobicContact CB-CE1 4.22Å
402	K	89.1	Confident	89.5	Confident	122 Å²	122	57.1 Å²	57.1	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-42.5	173.2	-175.7	178	178.8	179.9	0	111.9	E398 Y399 L400 L406	E398-K402 VanDerWaalsContact O-CB 3.3Å; E398-K402 WeakPolarHBondContact O-CB 3.36Å; E398-K402 PolarHBondContact O-N 3.05Å; Y399-K402 PolarHBondContact O-N 2.76Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 PolarHBondContact O-N 3.28Å; K402-L406 WeakPolarHBondContact O-CB 3.44Å; K402-L406 PolarHBondContact O-N 3.48Å; K402-L406 VanDerWaalsContact O-N 3.11Å
403	K	89.6	Confident	89.5	Confident	63 Å²	63	57 Å²	57	27%	0.274	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-43.1	178.5	-169	-179.7	-176.1	172.6	0	112.3	Y399 L400 L406 K407 I462	Y399-K403 HydrophobicContact CE1-CD 4.28Å; Y399-K403 WeakPolarHBondContact O-CB 3.5Å; Y399-K403 PolarHBondContact O-N 2.94Å; L400-K403 WeakPolarHBondContact O-CB 3.47Å; L400-K403 PolarHBondContact O-N 3.49Å; K403-L406 PolarHBondContact O-N 3.45Å; K403-K407 WeakPolarHBondContact O-CG 3.24Å; K403-K407 PolarHBondContact O-N 2.99Å; K403-I462 HydrophobicContact CD-CD1 3.95Å; K403-I462 HydrophobicContact CG-CD1 3.97Å
404	F	91.8	Very high	89.4	Confident	11 Å²	11	55.3 Å²	55.3	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-58.1	-55.8	173.5	177.9	-102.4	0	0	0	110.5	L400 L406 K407 C408 I459 I462 A463 L466 V477 R480 T481	L400-F404 WeakPolarHBondContact O-CB 3.31Å; L400-F404 PolarHBondContact O-N 3.41Å; F404-L406 VanDerWaalsContact C-N 3.28Å; F404-L406 PolarHBondContact O-N 3.11Å; F404-K407 PolarHBondContact O-N 3.32Å; F404-C408 WeakPolarHBondContact CE2-SG 3.2Å; F404-C408 WeakPolarHBondContact CZ-SG 3.3Å; F404-C408 PolarHBondContact O-N 3.49Å; F404-C408 PolarHBondContact O-SG 3.37Å; F404-C408 VanDerWaalsContact O-SG 3.33Å; F404-I459 HydrophobicContact CD2-CG2 4.33Å; F404-I459 HydrophobicContact CE2-CG2 3.82Å; F404-I462 HydrophobicContact CB-CG2 3.82Å; F404-I462 HydrophobicContact CD2-CG2 4.33Å; F404-A463 HydrophobicContact CE2-CB 4.08Å; F404-L466 HydrophobicContact CB-CD1 4.05Å; F404-L466 HydrophobicContact CG-CD1 4.3Å; F404-V477 HydrophobicContact CD1-CG1 4.36Å; F404-V477 HydrophobicContact CD1-CG2 4.24Å; F404-V477 HydrophobicContact CD2-CG1 4.3Å; F404-V477 HydrophobicContact CE1-CB 4.18Å; F404-V477 HydrophobicContact CE1-CG1 3.96Å; F404-V477 HydrophobicContact CE1-CG2 4.04Å; F404-V477 HydrophobicContact CE2-CG1 3.9Å; F404-V477 HydrophobicContact CZ-CB 4.27Å; F404-V477 HydrophobicContact CZ-CG1 3.72Å; F404-V477 WeakPolarHBondContact CZ-O 3.28Å; F404-R480 HydrophobicContact CZ-CB 4.33Å; F404-T481 WeakPolarHBondContact CE2-OG1 3.35Å; F404-T481 WeakPolarHBondContact CZ-OG1 3.27Å
405	R	90.9	Very high	89.2	Confident	151 Å²	151	54.9 Å²	54.9	57%	0.57	27%	0.27	S	S	*	.	H	α-helix	trans	-53.9	-44.4	179.4	-174.4	179.9	69.7	178.2	0.4	112	A401 L409	A401-R405 WeakPolarHBondContact O-CB 3.3Å; A401-R405 PolarHBondContact O-N 3.15Å; R405-L409 HydrophobicContact CG-CD1 4.1Å; R405-L409 WeakPolarHBondContact O-CB 3.39Å; R405-L409 WeakPolarHBondContact O-CD1 3.49Å; R405-L409 WeakPolarHBondContact O-CG 3.28Å; R405-L409 PolarHBondContact O-N 2.9Å; R405-L409 VanDerWaalsContact O-N 3.13Å
406	L	87.4	Confident	89.3	Confident	109 Å²	109	59.4 Å²	59.4	57%	0.571	30%	0.296	S	S	*	.	H	α-helix	trans	-63.5	-46.3	177.7	-177.6	62.4	0	0	0	111.9	K402 K403 F404 L409 T410	K402-L406 WeakPolarHBondContact O-CB 3.44Å; K402-L406 PolarHBondContact O-N 3.48Å; K402-L406 VanDerWaalsContact O-N 3.11Å; K403-L406 PolarHBondContact O-N 3.45Å; F404-L406 VanDerWaalsContact C-N 3.28Å; F404-L406 PolarHBondContact O-N 3.11Å; L406-L409 PolarHBondContact O-N 3.03Å; L406-T410 WeakPolarHBondContact O-CG2 3.2Å; L406-T410 PolarHBondContact O-N 3.35Å; L406-T410 PolarHBondContact O-OG1 3.34Å
407	K	89.3	Confident	89.1	Confident	42 Å²	42	56.9 Å²	56.9	18%	0.183	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-38.4	-178.9	-73	-171.5	-179	-61.1	0	113.3	K403 F404 T410 H411 I459 I462	K403-K407 WeakPolarHBondContact O-CG 3.24Å; K403-K407 PolarHBondContact O-N 2.99Å; F404-K407 PolarHBondContact O-N 3.32Å; K407-T410 PolarHBondContact O-N 2.9Å; K407-T410 PolarHBondContact O-OG1 3.48Å; K407-T410 VanDerWaalsContact O-OG1 3.09Å; K407-H411 WeakPolarHBondContact O-CB 3.44Å; K407-H411 PolarHBondContact O-N 2.76Å; K407-I459 HydrophobicContact CB-CD1 4.23Å; K407-I459 HydrophobicContact CB-CG1 3.79Å; K407-I462 HydrophobicContact CD-CD1 3.83Å
408	C	90.5	Very high	89	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-46.6	175	-62.2	0	0	0	0	110.8	F404 T410 H411 E412 I484	F404-C408 WeakPolarHBondContact CE2-SG 3.2Å; F404-C408 WeakPolarHBondContact CZ-SG 3.3Å; F404-C408 PolarHBondContact O-N 3.49Å; F404-C408 PolarHBondContact O-SG 3.37Å; F404-C408 VanDerWaalsContact O-SG 3.33Å; C408-T410 VanDerWaalsContact C-N 3.32Å; C408-T410 PolarHBondContact O-N 2.97Å; C408-H411 PolarHBondContact O-N 2.8Å; C408-H411 VanDerWaalsContact O-N 3.13Å; C408-E412 WeakPolarHBondContact O-CB 3.34Å; C408-E412 VanDerWaalsContact O-CD 3.31Å; C408-E412 VanDerWaalsContact O-CG 3.23Å; C408-E412 WeakPolarHBondContact O-CG 3.45Å; C408-E412 PolarHBondContact O-N 3.41Å; C408-I484 HydrophobicContact CB-CD1 3.91Å
409	L	90.3	Very high	88.8	Confident	89 Å²	89	53.7 Å²	53.7	47%	0.466	28%	0.281	S	S	.	.	H	α-helix	trans	-57.7	-41.1	175.3	-72.3	169.5	0	0	0	112.8	R405 L406 A413	R405-L409 HydrophobicContact CG-CD1 4.1Å; R405-L409 WeakPolarHBondContact O-CB 3.39Å; R405-L409 WeakPolarHBondContact O-CD1 3.49Å; R405-L409 WeakPolarHBondContact O-CG 3.28Å; R405-L409 PolarHBondContact O-N 2.9Å; R405-L409 VanDerWaalsContact O-N 3.13Å; L406-L409 PolarHBondContact O-N 3.03Å; L409-A413 VanDerWaalsContact O-CB 3.25Å; L409-A413 WeakPolarHBondContact O-CB 3.43Å; L409-A413 PolarHBondContact O-N 3.5Å; L409-A413 VanDerWaalsContact O-N 3.09Å
410	T	87.1	Confident	88.7	Confident	59 Å²	59	57.3 Å²	57.3	36%	0.362	30%	0.303	S	S	.	.	H	α-helix	trans	-76	-22.2	178	60.7	0	0	0	0	114	L406 K407 C408 R455	L406-T410 WeakPolarHBondContact O-CG2 3.2Å; L406-T410 PolarHBondContact O-N 3.35Å; L406-T410 PolarHBondContact O-OG1 3.34Å; K407-T410 PolarHBondContact O-N 2.9Å; K407-T410 PolarHBondContact O-OG1 3.48Å; K407-T410 VanDerWaalsContact O-OG1 3.09Å; C408-T410 VanDerWaalsContact C-N 3.32Å; C408-T410 PolarHBondContact O-N 2.97Å; T410-R455 PolarHBondContact O-NH1 3.36Å
411	H	89	Confident	88.3	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-78.4	-49.1	171.5	-177.2	90.7	0	0	0	111.2	K407 C408 A413 W414 A415 V456 I459 W488	K407-H411 WeakPolarHBondContact O-CB 3.44Å; K407-H411 PolarHBondContact O-N 2.76Å; C408-H411 PolarHBondContact O-N 2.8Å; C408-H411 VanDerWaalsContact O-N 3.13Å; H411-A413 VanDerWaalsContact C-N 3.32Å; H411-A413 PolarHBondContact O-N 2.8Å; H411-W414 AromaticContact CE1-CE3 3.99Å; H411-W414 AromaticContact CE1-CZ3 3.85Å; H411-W414 WeakPolarHBondContact O-CA 3.45Å; H411-W414 WeakPolarHBondContact O-CB 3.46Å; H411-W414 PolarHBondContact O-N 2.95Å; H411-A415 WeakPolarHBondContact O-CB 3.35Å; H411-A415 PolarHBondContact O-N 3.31Å; H411-V456 WeakPolarHBondContact CE1-CG2 3.47Å; H411-I459 HydrophobicContact CB-CD1 3.79Å; H411-W488 AromaticContact CE1-CE3 3.78Å; H411-W488 AromaticContact CE1-CZ3 3.96Å
412	E	89.5	Confident	87.9	Confident	61 Å²	61	59.6 Å²	59.6	29%	0.285	32%	0.317	S	S	.	.	H	α-helix	trans	-56.6	-45.1	177.9	-70.9	157.1	-171	0	0	111.4	C408 W414 A415 D416 R480	C408-E412 WeakPolarHBondContact O-CB 3.34Å; C408-E412 VanDerWaalsContact O-CD 3.31Å; C408-E412 VanDerWaalsContact O-CG 3.23Å; C408-E412 WeakPolarHBondContact O-CG 3.45Å; C408-E412 PolarHBondContact O-N 3.41Å; E412-W414 PolarHBondContact O-N 3.25Å; E412-A415 PolarHBondContact O-N 2.87Å; E412-D416 PolarHBondContact O-N 3.48Å; E412-R480 IonicContact OE1-CZ 3.26Å; E412-R480 VanDerWaalsContact OE1-CZ 3.23Å; E412-R480 IonicContact OE1-NE 2.9Å; E412-R480 PolarHBondContact OE1-NE 3.09Å; E412-R480 IonicContact OE1-NH2 3.17Å; E412-R480 PolarHBondContact OE1-NH2 3.02Å; E412-R480 IonicContact OE2-CZ 3.94Å; E412-R480 IonicContact OE2-NE 2.64Å; E412-R480 IonicContact OE2-NH2 3.9Å; E412-R480 PolarHBondContact OE2-NH2 3.16Å
413	A	88.4	Confident	87.6	Confident	82 Å²	82	57.2 Å²	57.2	68%	0.678	32%	0.316	S	S	*	.	H	α-helix	trans	-64.6	-23.6	176.3	0	0	0	0	0	114	L409 H411	L409-A413 VanDerWaalsContact O-CB 3.25Å; L409-A413 WeakPolarHBondContact O-CB 3.43Å; L409-A413 PolarHBondContact O-N 3.5Å; L409-A413 VanDerWaalsContact O-N 3.09Å; H411-A413 VanDerWaalsContact C-N 3.32Å; H411-A413 PolarHBondContact O-N 2.8Å
414	W	88.2	Confident	87.3	Confident	30 Å²	30	58.6 Å²	58.6	11%	0.114	33%	0.326	C	S	.	.	H	α-helix	trans	-84.5	-37.9	171.9	165.5	94.6	0	0	0	112	H411 E412 D416 K418 D448 L449 H452 W488 L491	H411-W414 AromaticContact CE1-CE3 3.99Å; H411-W414 AromaticContact CE1-CZ3 3.85Å; H411-W414 WeakPolarHBondContact O-CA 3.45Å; H411-W414 WeakPolarHBondContact O-CB 3.46Å; H411-W414 PolarHBondContact O-N 2.95Å; E412-W414 PolarHBondContact O-N 3.25Å; W414-D416 VanDerWaalsContact C-N 3.34Å; W414-K418 WeakPolarHBondContact O-CE 3.49Å; W414-K418 WeakPolarHBondContact O-CG 3.35Å; W414-D448 VanDerWaalsContact NE1-CG 3.33Å; W414-D448 PolarHBondContact NE1-OD1 3.45Å; W414-D448 PolarHBondContact NE1-OD2 3.49Å; W414-L449 HydrophobicContact CH2-CD1 3.9Å; W414-H452 AromaticContact CD1-CE1 3.13Å; W414-H452 AromaticContact CD1-ND1 3.76Å; W414-H452 AromaticContact CD1-NE2 3.42Å; W414-H452 AromaticContact CD2-CE1 3.47Å; W414-H452 VanDerWaalsContact CD2-CE1 3.47Å; W414-H452 AromaticContact CD2-CG 3.96Å; W414-H452 AromaticContact CD2-ND1 3.27Å; W414-H452 VanDerWaalsContact CD2-ND1 3.27Å; W414-H452 AromaticContact CE2-CD2 3.9Å; W414-H452 AromaticContact CE2-CE1 3.64Å; W414-H452 AromaticContact CE2-CG 3.62Å; W414-H452 AromaticContact CE2-ND1 3.44Å; W414-H452 AromaticContact CE2-NE2 3.94Å; W414-H452 AromaticContact CE3-ND1 3.68Å; W414-H452 AromaticContact CG-CE1 3.18Å; W414-H452 AromaticContact CG-ND1 3.53Å; W414-H452 AromaticContact CG-NE2 3.94Å; W414-H452 HydrophobicContact CH2-CB 4.14Å; W414-H452 HydrophobicContact CZ2-CB 4Å; W414-H452 AromaticContact CZ2-CG 3.83Å; W414-H452 AromaticContact NE1-CD2 3.65Å; W414-H452 AromaticContact NE1-CE1 3.36Å; W414-H452 PolarHBondContact NE1-CE1 2.9Å; W414-H452 AromaticContact NE1-CG 3.84Å; W414-H452 AromaticContact NE1-ND1 3.66Å; W414-H452 AromaticContact NE1-NE2 3.37Å; W414-H452 PolarHBondContact NE1-NE2 3.46Å; W414-W488 HydrophobicContact CH2-CE3 4.24Å; W414-W488 HydrophobicContact CH2-CH2 4.34Å; W414-W488 AromaticContact CH2-CZ3 3.52Å; W414-W488 HydrophobicContact CH2-CZ3 3.52Å; W414-W488 HydrophobicContact CZ3-CE3 4.11Å; W414-W488 AromaticContact CZ3-CZ3 3.65Å; W414-W488 HydrophobicContact CZ3-CZ3 3.65Å; W414-L491 HydrophobicContact CH2-CD1 4.05Å; W414-L491 HydrophobicContact CZ3-CD1 3.88Å
415	A	86.4	Confident	86.7	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-76.6	-21.4	-175.2	0	0	0	0	0	113.2	H411 E412 K418 Q487 L491	H411-A415 WeakPolarHBondContact O-CB 3.35Å; H411-A415 PolarHBondContact O-N 3.31Å; E412-A415 PolarHBondContact O-N 2.87Å; A415-K418 WeakPolarHBondContact O-CB 3.35Å; A415-K418 WeakPolarHBondContact O-CG 3.39Å; A415-K418 PolarHBondContact O-N 2.84Å; A415-Q487 HydrophobicContact CB-CG 4.37Å; A415-Q487 VanDerWaalsContact CB-NE2 3.31Å; A415-L491 HydrophobicContact CB-CD1 4.46Å
416	D	88.6	Confident	86.2	Confident	134 Å²	134	59.1 Å²	59.1	72%	0.717	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	137.3	176.7	-172.5	27	0	0	0	112.4	E412 W414 K418	E412-D416 PolarHBondContact O-N 3.48Å; W414-D416 VanDerWaalsContact C-N 3.34Å; D416-K418 PolarHBondContact O-N 2.7Å
417	G	86.5	Confident	85.6	Confident	28 Å²	28	54.5 Å²	54.5	29%	0.289	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	-11.4	-177.1	0	0	0	0	0	117.2	N420 S421	G417-N420 PolarHBondContact O-N 2.73Å; G417-S421 PolarHBondContact O-N 3Å; G417-S421 PolarHBondContact O-OG 3.05Å
418	K	88	Confident	84.5	Confident	46 Å²	46	58.7 Å²	58.7	20%	0.2	33%	0.332	C	S	.	.	H	α-helix	trans	-64.7	-45.4	-176.2	-60.2	-73.7	-163.4	154.4	0	112.2	W414 A415 D416 N420 S421 L422 F445 D448 L491	W414-K418 WeakPolarHBondContact O-CE 3.49Å; W414-K418 WeakPolarHBondContact O-CG 3.35Å; A415-K418 WeakPolarHBondContact O-CB 3.35Å; A415-K418 WeakPolarHBondContact O-CG 3.39Å; A415-K418 PolarHBondContact O-N 2.84Å; D416-K418 PolarHBondContact O-N 2.7Å; K418-N420 VanDerWaalsContact C-N 3.33Å; K418-N420 PolarHBondContact O-N 2.88Å; K418-S421 WeakPolarHBondContact O-CA 3.45Å; K418-S421 WeakPolarHBondContact O-CB 3.43Å; K418-S421 PolarHBondContact O-N 3.17Å; K418-L422 WeakPolarHBondContact O-CG 3.31Å; K418-L422 PolarHBondContact O-N 3.44Å; K418-F445 HydrophobicContact CB-CE2 4.45Å; K418-F445 HydrophobicContact CD-CD2 4.46Å; K418-F445 HydrophobicContact CD-CE2 3.96Å; K418-D448 IonicContact NZ-OD2 2.78Å; K418-D448 PolarHBondContact NZ-OD2 3.07Å; K418-L491 HydrophobicContact CB-CD1 4.45Å; K418-L491 HydrophobicContact CB-CD2 3.69Å
419	A	85.5	Confident	83.2	Confident	27 Å²	27	62.9 Å²	62.9	22%	0.223	38%	0.376	C	S	.	.	H	α-helix	trans	-62.1	-38.9	179.6	0	0	0	0	0	112.6	L422 S423 L491 L494	A419-L422 PolarHBondContact O-N 2.8Å; A419-S423 PolarHBondContact O-N 3.17Å; A419-S423 PolarHBondContact O-OG 3.29Å; A419-L491 HydrophobicContact CB-CD2 3.92Å; A419-L494 HydrophobicContact CB-CD1 4.09Å
420	N	84.8	Confident	82	Confident	125 Å²	125	59.6 Å²	59.6	67%	0.668	36%	0.362	S	S	*	.	H	α-helix	trans	-64.1	-42	173	-66.4	-21.4	0	0	0	110.9	G417 K418 L422 S423	G417-N420 PolarHBondContact O-N 2.73Å; K418-N420 VanDerWaalsContact C-N 3.33Å; K418-N420 PolarHBondContact O-N 2.88Å; N420-L422 VanDerWaalsContact C-N 3.34Å; N420-L422 PolarHBondContact O-N 3.33Å; N420-S423 PolarHBondContact O-N 2.98Å
421	S	82	Confident	80.6	Confident	60 Å²	60	59 Å²	59	42%	0.42	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-32.5	179	-58.7	0	0	0	0	113.6	G417 K418	G417-S421 PolarHBondContact O-N 3Å; G417-S421 PolarHBondContact O-OG 3.05Å; K418-S421 WeakPolarHBondContact O-CA 3.45Å; K418-S421 WeakPolarHBondContact O-CB 3.43Å; K418-S421 PolarHBondContact O-N 3.17Å
422	L	84.1	Confident	79.1	Confident	11 Å²	11	62.7 Å²	62.7	6%	0.058	38%	0.379	C	S	.	.	H	α-helix	trans	-76.6	-25.7	175.8	-67.3	173.5	0	0	0	113.3	K418 A419 N420 L424 F445 L491 L494 R498	K418-L422 WeakPolarHBondContact O-CG 3.31Å; K418-L422 PolarHBondContact O-N 3.44Å; A419-L422 PolarHBondContact O-N 2.8Å; N420-L422 VanDerWaalsContact C-N 3.34Å; N420-L422 PolarHBondContact O-N 3.33Å; L422-L424 VanDerWaalsContact C-N 3.29Å; L422-L424 PolarHBondContact O-N 3.05Å; L422-F445 HydrophobicContact CD1-CE1 3.7Å; L422-F445 HydrophobicContact CD1-CZ 3.76Å; L422-F445 HydrophobicContact CD2-CD1 3.7Å; L422-F445 HydrophobicContact CD2-CE1 3.6Å; L422-F445 HydrophobicContact CD2-CG 4.34Å; L422-F445 HydrophobicContact CD2-CZ 4.18Å; L422-F445 HydrophobicContact CG-CE1 4.12Å; L422-F445 HydrophobicContact CG-CZ 4.27Å; L422-L491 HydrophobicContact CD1-CD2 3.91Å; L422-L491 WeakPolarHBondContact CD1-O 3.44Å; L422-L494 HydrophobicContact CB-CB 3.82Å; L422-L494 HydrophobicContact CD1-CB 3.75Å; L422-L494 HydrophobicContact CG-CB 4.44Å; L422-R498 WeakPolarHBondContact O-CD 3.34Å
423	S	82	Confident	77.6	Confident	72 Å²	72	60.5 Å²	60.5	50%	0.503	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.9	-176.8	-54.9	0	0	0	0	113.9	A419 N420	A419-S423 PolarHBondContact O-N 3.17Å; A419-S423 PolarHBondContact O-OG 3.29Å; N420-S423 PolarHBondContact O-N 2.98Å
424	L	83.5	Confident	76.7	Confident	93 Å²	93	59.2 Å²	59.2	49%	0.487	35%	0.354	S	S	.	.			trans	-76.7	144.2	177.3	-66.5	171.4	0	0	0	111.9	L422 D426 R498	L422-L424 VanDerWaalsContact C-N 3.29Å; L422-L424 PolarHBondContact O-N 3.05Å; L424-D426 HydrophobicContact CB-CB 4.45Å; L424-R498 PolarHBondContact O-NH1 2.88Å
425	E	79.7	Confident	75.8	Confident	114 Å²	114	58.1 Å²	58.1	53%	0.533	35%	0.35	S	S	.	.			trans	-104	35.6	175.9	-57.8	-159.7	125.4	0	0	112.2	Y427 E428 K501	E425-Y427 HydrophobicContact CB-CE1 4.13Å; E425-Y427 WeakPolarHBondContact CB-OH 3.38Å; E425-Y427 HydrophobicContact CG-CE1 4.44Å; E425-Y427 WeakPolarHBondContact CG-OH 3.47Å; E425-Y427 PolarHBondContact O-N 3.41Å; E425-Y427 VanDerWaalsContact O-N 3.11Å; E425-Y427 PolarHBondContact OE1-OH 3.3Å; E425-E428 PolarHBondContact O-N 2.77Å; E425-K501 IonicContact OE1-NZ 3.8Å; E425-K501 PolarHBondContact OE1-NZ 3.19Å
426	D	78.9	Confident	75	Confident	59 Å²	59	59.2 Å²	59.2	32%	0.316	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-1	-173.2	60.1	-14.5	0	0	0	116.1	L424 L438 R498	L424-D426 HydrophobicContact CB-CB 4.45Å; D426-L438 VanDerWaalsContact CG-CD2 3.44Å; D426-L438 VanDerWaalsContact O-CD1 3.26Å; D426-L438 WeakPolarHBondContact O-CD1 3.23Å; D426-L438 WeakPolarHBondContact OD2-CD2 3.3Å; D426-R498 IonicContact OD1-CZ 2.7Å; D426-R498 IonicContact OD1-NH1 3.68Å; D426-R498 PolarHBondContact OD1-NH1 3.13Å; D426-R498 IonicContact OD1-NH2 3.84Å; D426-R498 PolarHBondContact OD1-NH2 2.92Å; D426-R498 IonicContact OD2-NH2 2.7Å; D426-R498 PolarHBondContact OD2-NH2 3.16Å; D426-R498 VanDerWaalsContact OD2-NH2 3.17Å
427	Y	75.9	Confident	74	Confident	11 Å²	11	54.3 Å²	54.3	4%	0.043	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-12.4	174	53	-95.7	0	0	0	113.2	E425 G429 A430 L435 K501 I502	E425-Y427 HydrophobicContact CB-CE1 4.13Å; E425-Y427 WeakPolarHBondContact CB-OH 3.38Å; E425-Y427 HydrophobicContact CG-CE1 4.44Å; E425-Y427 WeakPolarHBondContact CG-OH 3.47Å; E425-Y427 PolarHBondContact O-N 3.41Å; E425-Y427 VanDerWaalsContact O-N 3.11Å; E425-Y427 PolarHBondContact OE1-OH 3.3Å; Y427-G429 PolarHBondContact O-N 2.95Å; Y427-A430 WeakPolarHBondContact O-CB 3.36Å; Y427-L435 WeakPolarHBondContact O-CD2 3.39Å; Y427-K501 HydrophobicContact CD1-CB 4.4Å; Y427-K501 HydrophobicContact CD2-CB 4.32Å; Y427-K501 HydrophobicContact CE1-CB 4.11Å; Y427-K501 HydrophobicContact CE1-CD 3.8Å; Y427-K501 HydrophobicContact CE2-CB 4.06Å; Y427-K501 HydrophobicContact CE2-CD 3.83Å; Y427-K501 WeakPolarHBondContact OH-CD 3.28Å; Y427-K501 PolarHBondContact OH-NZ 3.44Å; Y427-I502 HydrophobicContact CD1-CG1 3.96Å; Y427-I502 HydrophobicContact CG-CG1 4.17Å
428	E	65.1	Low	73.6	Confident	130 Å²	130	53.4 Å²	53.4	61%	0.607	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	120.8	-178.7	-57.1	-168	-179.2	0	0	111.2	E425 A430	E425-E428 PolarHBondContact O-N 2.77Å; E428-A430 PolarHBondContact O-N 2.7Å
429	G	62.9	Low	73.1	Confident	89 Å²	89	51.7 Å²	51.7	92%	0.918	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	3.6	-176.4	0	0	0	0	0	115.1	Y427	Y427-G429 PolarHBondContact O-N 2.95Å
430	A	65.4	Low	72.3	Confident	20 Å²	20	53.2 Å²	53.2	17%	0.165	32%	0.318	C	S	.	.			trans	-56.8	139.8	177.4	0	0	0	0	0	111.8	Y427 E428 T434 L435 L438	Y427-A430 WeakPolarHBondContact O-CB 3.36Å; E428-A430 PolarHBondContact O-N 2.7Å; A430-T434 HydrophobicContact CB-CG2 3.61Å; A430-L435 HydrophobicContact CB-CD1 4.18Å; A430-L435 HydrophobicContact CB-CD2 3.78Å; A430-L435 HydrophobicContact CB-CG 3.62Å; A430-L435 VanDerWaalsContact O-CD1 3.27Å; A430-L435 WeakPolarHBondContact O-CD1 3.3Å; A430-L438 HydrophobicContact CB-CD1 4.12Å
431	S	58.8	Low	72	Confident	45 Å²	45	51.4 Å²	51.4	32%	0.315	30%	0.304	S	S	.	.			trans	-61.9	166.5	175.1	82.4	0	0	0	0	110.9	S433 T434 L435	S431-S433 PolarHBondContact O-N 2.99Å; S431-S433 WeakPolarHBondContact OG-CB 3.46Å; S431-S433 PolarHBondContact OG-N 3.36Å; S431-S433 PolarHBondContact OG-OG 2.98Å; S431-T434 WeakPolarHBondContact CB-OG1 3.28Å; S431-T434 PolarHBondContact N-OG1 3.04Å; S431-T434 CarbonylContact O-C 3.42Å; S431-T434 WeakPolarHBondContact O-CA 3.42Å; S431-T434 WeakPolarHBondContact O-CB 3.26Å; S431-T434 PolarHBondContact O-N 3.01Å; S431-T434 PolarHBondContact OG-N 3.22Å; S431-T434 VanDerWaalsContact OG-N 3.1Å; S431-T434 PolarHBondContact OG-OG1 3.05Å; S431-L435 PolarHBondContact O-N 3.04Å
432	L	56.1	Low	72	Confident	79 Å²	79	48.8 Å²	48.8	41%	0.414	29%	0.285	S	S	.	.	H	α-helix	trans	-39.3	-69.7	163.5	-150.6	51.2	0	0	0	109.2	T434 L435 L508 L509	L432-T434 PolarHBondContact O-N 3.01Å; L432-L435 PolarHBondContact O-N 3.15Å; L432-L508 HydrophobicContact CD1-CB 3.58Å; L432-L508 HydrophobicContact CD1-CD2 3.99Å; L432-L508 HydrophobicContact CD1-CG 3.78Å; L432-L508 HydrophobicContact CD2-CG 4.39Å; L432-L509 VanDerWaalsContact C-CG 3.45Å; L432-L509 HydrophobicContact CB-CD2 4.37Å; L432-L509 HydrophobicContact CB-CG 4.27Å; L432-L509 HydrophobicContact CD1-CD1 4.17Å; L432-L509 HydrophobicContact CD1-CG 3.82Å; L432-L509 HydrophobicContact CG-CD1 4.48Å; L432-L509 HydrophobicContact CG-CD2 4.15Å; L432-L509 HydrophobicContact CG-CG 3.71Å; L432-L509 WeakPolarHBondContact O-CD1 3.44Å; L432-L509 WeakPolarHBondContact O-CD2 3.46Å; L432-L509 WeakPolarHBondContact O-CG 3.2Å
433	S	58.2	Low	71.7	Confident	15 Å²	15	50.2 Å²	50.2	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-39.6	-49.4	174.9	-9.6	0	0	0	0	113.5	S431 L435 A437 L593	S431-S433 PolarHBondContact O-N 2.99Å; S431-S433 WeakPolarHBondContact OG-CB 3.46Å; S431-S433 PolarHBondContact OG-N 3.36Å; S431-S433 PolarHBondContact OG-OG 2.98Å; S433-L435 VanDerWaalsContact C-N 3.35Å; S433-L435 PolarHBondContact O-N 3.37Å; S433-A437 VanDerWaalsContact O-CB 3.29Å; S433-A437 WeakPolarHBondContact O-CB 3.29Å; S433-A437 PolarHBondContact O-N 2.96Å; S433-L593 VanDerWaalsContact CB-CD2 3.43Å
434	T	71.1	Confident	71.3	Confident	54 Å²	54	48.9 Å²	48.9	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-67.7	-32.8	-172.8	-45.8	0	0	0	0	111.7	A430 S431 L432 A437 L438	A430-T434 HydrophobicContact CB-CG2 3.61Å; S431-T434 WeakPolarHBondContact CB-OG1 3.28Å; S431-T434 PolarHBondContact N-OG1 3.04Å; S431-T434 CarbonylContact O-C 3.42Å; S431-T434 WeakPolarHBondContact O-CA 3.42Å; S431-T434 WeakPolarHBondContact O-CB 3.26Å; S431-T434 PolarHBondContact O-N 3.01Å; S431-T434 PolarHBondContact OG-N 3.22Å; S431-T434 VanDerWaalsContact OG-N 3.1Å; S431-T434 PolarHBondContact OG-OG1 3.05Å; L432-T434 PolarHBondContact O-N 3.01Å; T434-A437 CarbonylContact O-C 3.55Å; T434-A437 WeakPolarHBondContact O-CB 3.32Å; T434-A437 PolarHBondContact O-N 2.89Å; T434-L438 HydrophobicContact CG2-CD1 3.97Å; T434-L438 HydrophobicContact CG2-CG 4.46Å; T434-L438 WeakPolarHBondContact O-CB 3.4Å; T434-L438 WeakPolarHBondContact O-CD1 3.42Å; T434-L438 WeakPolarHBondContact O-CG 3.37Å; T434-L438 PolarHBondContact O-N 3.35Å
435	L	68.8	Low	71.3	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-76.2	-40.2	-175.6	-76.6	155.6	0	0	0	113.4	Y427 A430 S431 L432 S433 L438 A439 I502 I505 L506 L509	Y427-L435 WeakPolarHBondContact O-CD2 3.39Å; A430-L435 HydrophobicContact CB-CD1 4.18Å; A430-L435 HydrophobicContact CB-CD2 3.78Å; A430-L435 HydrophobicContact CB-CG 3.62Å; A430-L435 VanDerWaalsContact O-CD1 3.27Å; A430-L435 WeakPolarHBondContact O-CD1 3.3Å; S431-L435 PolarHBondContact O-N 3.04Å; L432-L435 PolarHBondContact O-N 3.15Å; S433-L435 VanDerWaalsContact C-N 3.35Å; S433-L435 PolarHBondContact O-N 3.37Å; L435-L438 CarbonylContact O-C 3.57Å; L435-L438 WeakPolarHBondContact O-CA 3.46Å; L435-L438 WeakPolarHBondContact O-CB 3.21Å; L435-L438 PolarHBondContact O-N 3.39Å; L435-A439 PolarHBondContact O-N 3.21Å; L435-I502 HydrophobicContact CD2-CG2 4.24Å; L435-I502 WeakPolarHBondContact O-CG2 3.27Å; L435-I505 HydrophobicContact CD1-CB 3.56Å; L435-I505 HydrophobicContact CD1-CD1 4.43Å; L435-I505 HydrophobicContact CD1-CG2 3.35Å; L435-I505 HydrophobicContact CD2-CB 3.8Å; L435-I505 HydrophobicContact CD2-CD1 3.78Å; L435-I505 HydrophobicContact CD2-CG1 4.16Å; L435-I505 HydrophobicContact CD2-CG2 4.46Å; L435-I505 HydrophobicContact CG-CB 4.15Å; L435-I505 HydrophobicContact CG-CG2 4.44Å; L435-L506 VanDerWaalsContact C-CD1 3.5Å; L435-L506 HydrophobicContact CB-CD1 4.43Å; L435-L506 WeakPolarHBondContact O-CD1 3.5Å; L435-L509 HydrophobicContact CB-CD1 4.03Å
436	R	69.3	Low	71.4	Confident	24 Å²	24	42.8 Å²	42.8	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-79.8	-22.6	169.5	-86.2	-154.6	173.6	101.2	-1	113.6	L438 Q440 L506 D507 L509 N510 D513 Y598	R436-L438 PolarHBondContact O-N 2.93Å; R436-Q440 WeakPolarHBondContact O-CB 3.31Å; R436-Q440 PolarHBondContact O-N 3.13Å; R436-L506 HydrophobicContact CB-CD1 4.4Å; R436-L506 HydrophobicContact CG-CD1 3.6Å; R436-L506 HydrophobicContact CG-CD2 3.8Å; R436-L506 HydrophobicContact CG-CG 3.35Å; R436-L506 PolarHBondContact NE-O 3.46Å; R436-L506 PolarHBondContact NH1-O 2.7Å; R436-L506 PolarHBondContact NH2-O 2.92Å; R436-D507 PolarHBondContact NH1-O 2.88Å; R436-D507 IonicContact NH2-OD1 3.66Å; R436-L509 HydrophobicContact CB-CB 4.28Å; R436-L509 HydrophobicContact CB-CD1 3.72Å; R436-L509 HydrophobicContact CB-CD2 4.02Å; R436-L509 HydrophobicContact CB-CG 4.12Å; R436-L509 HydrophobicContact CG-CB 4.08Å; R436-L509 HydrophobicContact CG-CD1 3.64Å; R436-L509 HydrophobicContact CG-CG 4.26Å; R436-N510 VanDerWaalsContact NH1-CA 3.33Å; R436-N510 VanDerWaalsContact NH1-CB 3.33Å; R436-N510 PolarHBondContact NH1-ND2 3.22Å; R436-N510 PolarHBondContact NH1-OD1 3.49Å; R436-N510 VanDerWaalsContact NH2-CG 3.27Å; R436-N510 PolarHBondContact NH2-ND2 3.35Å; R436-N510 PolarHBondContact NH2-OD1 3.17Å; R436-D513 WeakPolarHBondContact CD-OD1 3.26Å; R436-D513 IonicContact CZ-OD1 2.8Å; R436-D513 IonicContact NE-OD1 3.54Å; R436-D513 PolarHBondContact NE-OD1 3.39Å; R436-D513 IonicContact NH1-OD1 2.7Å; R436-Y598 HydrophobicContact CB-CE1 3.86Å; R436-Y598 WeakPolarHBondContact CB-OH 3.49Å; R436-Y598 HydrophobicContact CG-CE1 4.42Å
437	A	68.2	Low	71.4	Confident	31 Å²	31	42.2 Å²	42.2	26%	0.256	27%	0.266	S	S	.	.	H	α-helix	trans	-55.1	-45.3	157.3	0	0	0	0	0	109.8	S433 T434 K441 P597	S433-A437 VanDerWaalsContact O-CB 3.29Å; S433-A437 WeakPolarHBondContact O-CB 3.29Å; S433-A437 PolarHBondContact O-N 2.96Å; T434-A437 CarbonylContact O-C 3.55Å; T434-A437 WeakPolarHBondContact O-CB 3.32Å; T434-A437 PolarHBondContact O-N 2.89Å; A437-K441 WeakPolarHBondContact O-CA 3.43Å; A437-K441 WeakPolarHBondContact O-CB 3.3Å; A437-K441 PolarHBondContact O-N 3.25Å; A437-P597 WeakPolarHBondContact CA-O 3.46Å; A437-P597 HydrophobicContact CB-CB 3.8Å
438	L	77.2	Confident	71.5	Confident	9 Å²	9	43.8 Å²	43.8	5%	0.047	28%	0.275	C	S	.	.	H	α-helix	trans	-72.8	-48.6	-175	-72.3	165.4	0	0	0	113.7	D426 A430 T434 L435 R436 H442 I502	D426-L438 VanDerWaalsContact CG-CD2 3.44Å; D426-L438 VanDerWaalsContact O-CD1 3.26Å; D426-L438 WeakPolarHBondContact O-CD1 3.23Å; D426-L438 WeakPolarHBondContact OD2-CD2 3.3Å; A430-L438 HydrophobicContact CB-CD1 4.12Å; T434-L438 HydrophobicContact CG2-CD1 3.97Å; T434-L438 HydrophobicContact CG2-CG 4.46Å; T434-L438 WeakPolarHBondContact O-CB 3.4Å; T434-L438 WeakPolarHBondContact O-CD1 3.42Å; T434-L438 WeakPolarHBondContact O-CG 3.37Å; T434-L438 PolarHBondContact O-N 3.35Å; L435-L438 CarbonylContact O-C 3.57Å; L435-L438 WeakPolarHBondContact O-CA 3.46Å; L435-L438 WeakPolarHBondContact O-CB 3.21Å; L435-L438 PolarHBondContact O-N 3.39Å; R436-L438 PolarHBondContact O-N 2.93Å; L438-H442 WeakPolarHBondContact O-CB 3.39Å; L438-H442 PolarHBondContact O-N 2.9Å; L438-I502 HydrophobicContact CB-CD1 4.13Å; L438-I502 HydrophobicContact CB-CG1 4.43Å; L438-I502 HydrophobicContact CB-CG2 3.59Å
439	A	76.7	Confident	72.3	Confident	11 Å²	11	38.6 Å²	38.6	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-79.2	-27	179.7	0	0	0	0	0	112.9	L435 H442 A443 I502 L506	L435-A439 PolarHBondContact O-N 3.21Å; A439-H442 CarbonylContact O-C 3.59Å; A439-H442 PolarHBondContact O-N 2.99Å; A439-A443 WeakPolarHBondContact O-CB 3.43Å; A439-A443 PolarHBondContact O-N 3.24Å; A439-I502 HydrophobicContact CB-CB 3.99Å; A439-I502 HydrophobicContact CB-CG2 3.71Å; A439-L506 HydrophobicContact CB-CD1 3.28Å; A439-L506 HydrophobicContact CB-CD2 3.7Å; A439-L506 HydrophobicContact CB-CG 4.11Å
440	Q	70.6	Confident	73.3	Confident	58 Å²	58	36.7 Å²	36.7	27%	0.271	23%	0.231	S	C	.	.	H	α-helix	trans	-73.9	-40.2	170	-170.2	68.7	20	0	0	110.8	R436 H442 A443 S444 Y598	R436-Q440 WeakPolarHBondContact O-CB 3.31Å; R436-Q440 PolarHBondContact O-N 3.13Å; Q440-H442 PolarHBondContact O-N 3.35Å; Q440-A443 PolarHBondContact O-N 3.26Å; Q440-S444 VanDerWaalsContact O-CB 3.27Å; Q440-S444 WeakPolarHBondContact O-CB 3.37Å; Q440-S444 PolarHBondContact O-N 3.32Å; Q440-S444 PolarHBondContact O-OG 2.87Å; Q440-Y598 HydrophobicContact CB-CD1 3.64Å; Q440-Y598 HydrophobicContact CB-CE1 4.12Å; Q440-Y598 HydrophobicContact CB-CG 4.33Å; Q440-Y598 VanDerWaalsContact CG-CA 3.43Å; Q440-Y598 HydrophobicContact CG-CD1 3.53Å; Q440-Y598 HydrophobicContact CG-CE1 4.46Å; Q440-Y598 HydrophobicContact CG-CG 4.01Å
441	K	76.7	Confident	74	Confident	87 Å²	87	38.5 Å²	38.5	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-58.2	-34.9	168.4	-179.3	-176.7	178.1	-167.7	0	111.3	A437 F445 M600	A437-K441 WeakPolarHBondContact O-CA 3.43Å; A437-K441 WeakPolarHBondContact O-CB 3.3Å; A437-K441 PolarHBondContact O-N 3.25Å; K441-F445 WeakPolarHBondContact O-CB 3.46Å; K441-F445 PolarHBondContact O-N 2.9Å; K441-M600 HydrophobicContact CD-SD 3.87Å; K441-M600 HydrophobicContact CG-CG 4.29Å; K441-M600 HydrophobicContact CG-SD 3.93Å
442	H	83	Confident	75.2	Confident	5 Å²	5	37.2 Å²	37.2	2%	0.023	24%	0.236	C	C	.	.	H	α-helix	trans	-70.4	-46.2	174.9	-169.5	69.2	0	0	0	112.5	L438 A439 Q440 S444 F445 E446 S495 K499 I502	L438-H442 WeakPolarHBondContact O-CB 3.39Å; L438-H442 PolarHBondContact O-N 2.9Å; A439-H442 CarbonylContact O-C 3.59Å; A439-H442 PolarHBondContact O-N 2.99Å; Q440-H442 PolarHBondContact O-N 3.35Å; H442-S444 VanDerWaalsContact C-N 3.34Å; H442-S444 PolarHBondContact O-N 3.5Å; H442-F445 CarbonylContact O-C 3.55Å; H442-F445 WeakPolarHBondContact O-CA 3.3Å; H442-F445 WeakPolarHBondContact O-CB 3.25Å; H442-F445 PolarHBondContact O-N 2.97Å; H442-E446 IonicContact CD2-OE2 3.64Å; H442-E446 IonicContact NE2-OE2 2.81Å; H442-E446 PolarHBondContact O-N 3.19Å; H442-S495 PolarHBondContact CE1-O 3.15Å; H442-S495 PolarHBondContact CE1-OG 3.44Å; H442-S495 PolarHBondContact NE2-O 3.44Å; H442-S495 VanDerWaalsContact NE2-O 3.12Å; H442-S495 PolarHBondContact NE2-OG 2.78Å; H442-K499 VanDerWaalsContact NE2-CB 3.34Å; H442-K499 WeakPolarHBondContact NE2-CB 3.3Å; H442-K499 PolarHBondContact NE2-N 2.84Å; H442-I502 HydrophobicContact CB-CD1 3.94Å
443	A	77.5	Confident	76.7	Confident	42 Å²	42	36.9 Å²	36.9	35%	0.347	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-34.6	175.6	0	0	0	0	0	112.3	A439 Q440 F445 E446 G447	A439-A443 WeakPolarHBondContact O-CB 3.43Å; A439-A443 PolarHBondContact O-N 3.24Å; Q440-A443 PolarHBondContact O-N 3.26Å; A443-F445 VanDerWaalsContact C-N 3.31Å; A443-E446 PolarHBondContact O-N 2.92Å; A443-G447 PolarHBondContact O-N 2.93Å
444	S	73	Confident	78.2	Confident	44 Å²	44	40.8 Å²	40.8	31%	0.308	25%	0.251	S	S	.	.	H	α-helix	trans	-63.5	-37.7	167.9	-65.1	0	0	0	0	111.4	Q440 H442 G447 D448	Q440-S444 VanDerWaalsContact O-CB 3.27Å; Q440-S444 WeakPolarHBondContact O-CB 3.37Å; Q440-S444 PolarHBondContact O-N 3.32Å; Q440-S444 PolarHBondContact O-OG 2.87Å; H442-S444 VanDerWaalsContact C-N 3.34Å; H442-S444 PolarHBondContact O-N 3.5Å; S444-G447 PolarHBondContact O-N 3.48Å; S444-D448 VanDerWaalsContact O-CB 3.3Å; S444-D448 WeakPolarHBondContact O-CB 3.38Å; S444-D448 PolarHBondContact O-N 2.7Å
445	F	83.5	Confident	79	Confident	24 Å²	24	40.6 Å²	40.6	11%	0.105	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-38.5	172.4	175.4	-92.7	0	0	0	112.5	K418 L422 K441 H442 A443 G447 D448 L449	K418-F445 HydrophobicContact CB-CE2 4.45Å; K418-F445 HydrophobicContact CD-CD2 4.46Å; K418-F445 HydrophobicContact CD-CE2 3.96Å; L422-F445 HydrophobicContact CD1-CE1 3.7Å; L422-F445 HydrophobicContact CD1-CZ 3.76Å; L422-F445 HydrophobicContact CD2-CD1 3.7Å; L422-F445 HydrophobicContact CD2-CE1 3.6Å; L422-F445 HydrophobicContact CD2-CG 4.34Å; L422-F445 HydrophobicContact CD2-CZ 4.18Å; L422-F445 HydrophobicContact CG-CE1 4.12Å; L422-F445 HydrophobicContact CG-CZ 4.27Å; K441-F445 WeakPolarHBondContact O-CB 3.46Å; K441-F445 PolarHBondContact O-N 2.9Å; H442-F445 CarbonylContact O-C 3.55Å; H442-F445 WeakPolarHBondContact O-CA 3.3Å; H442-F445 WeakPolarHBondContact O-CB 3.25Å; H442-F445 PolarHBondContact O-N 2.97Å; A443-F445 VanDerWaalsContact C-N 3.31Å; F445-G447 VanDerWaalsContact C-N 3.28Å; F445-G447 PolarHBondContact O-N 2.71Å; F445-D448 PolarHBondContact O-N 3.23Å; F445-L449 HydrophobicContact CE1-CB 4.26Å; F445-L449 HydrophobicContact CE1-CD2 4.06Å; F445-L449 HydrophobicContact CZ-CB 4.33Å; F445-L449 HydrophobicContact CZ-CD1 4.33Å; F445-L449 HydrophobicContact CZ-CD2 4.47Å; F445-L449 WeakPolarHBondContact O-CB 3.32Å; F445-L449 PolarHBondContact O-N 3.24Å
446	E	82.3	Confident	80	Confident	55 Å²	55	40.6 Å²	40.6	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-34.2	172.5	-69.1	-169.4	98.2	0	0	111.5	H442 A443 G450 K499	H442-E446 IonicContact CD2-OE2 3.64Å; H442-E446 IonicContact NE2-OE2 2.81Å; H442-E446 PolarHBondContact O-N 3.19Å; A443-E446 PolarHBondContact O-N 2.92Å; E446-G450 PolarHBondContact O-N 2.72Å; E446-K499 WeakPolarHBondContact OE1-CD 3.47Å; E446-K499 WeakPolarHBondContact OE1-CE 3.49Å; E446-K499 IonicContact OE1-NZ 2.77Å; E446-K499 PolarHBondContact OE1-NZ 2.84Å; E446-K499 VanDerWaalsContact OE2-CE 3.25Å; E446-K499 WeakPolarHBondContact OE2-CE 3.48Å; E446-K499 IonicContact OE2-NZ 3.74Å
447	G	79.6	Confident	81.1	Confident	46 Å²	46	44.1 Å²	44.1	47%	0.474	26%	0.263	S	S	.	.	H	α-helix	trans	-68.6	-44.5	172	0	0	0	0	0	113.5	A443 S444 F445 G450 A451	A443-G447 PolarHBondContact O-N 2.93Å; S444-G447 PolarHBondContact O-N 3.48Å; F445-G447 VanDerWaalsContact C-N 3.28Å; F445-G447 PolarHBondContact O-N 2.71Å; G447-G450 PolarHBondContact O-N 2.81Å; G447-A451 WeakPolarHBondContact O-CB 3.36Å; G447-A451 PolarHBondContact O-N 3.4Å
448	D	77.2	Confident	82.2	Confident	45 Å²	45	49.7 Å²	49.7	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-48.7	172.4	174.8	39.9	0	0	0	110.9	W414 K418 S444 F445 A451 H452	W414-D448 VanDerWaalsContact NE1-CG 3.33Å; W414-D448 PolarHBondContact NE1-OD1 3.45Å; W414-D448 PolarHBondContact NE1-OD2 3.49Å; K418-D448 IonicContact NZ-OD2 2.78Å; K418-D448 PolarHBondContact NZ-OD2 3.07Å; S444-D448 VanDerWaalsContact O-CB 3.3Å; S444-D448 WeakPolarHBondContact O-CB 3.38Å; S444-D448 PolarHBondContact O-N 2.7Å; F445-D448 PolarHBondContact O-N 3.23Å; D448-A451 PolarHBondContact O-N 3.41Å; D448-H452 PolarHBondContact O-CD2 2.86Å; D448-H452 VanDerWaalsContact O-CD2 3.31Å; D448-H452 PolarHBondContact O-N 3.02Å; D448-H452 IonicContact OD1-CD2 3.83Å; D448-H452 IonicContact OD1-NE2 2.91Å
449	L	82.4	Confident	82.9	Confident	21 Å²	21	49.3 Å²	49.3	11%	0.11	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-44.9	173.8	-173.4	68.7	0	0	0	111.5	W414 F445 A451 H452 Q453 W488 L491	W414-L449 HydrophobicContact CH2-CD1 3.9Å; F445-L449 HydrophobicContact CE1-CB 4.26Å; F445-L449 HydrophobicContact CE1-CD2 4.06Å; F445-L449 HydrophobicContact CZ-CB 4.33Å; F445-L449 HydrophobicContact CZ-CD1 4.33Å; F445-L449 HydrophobicContact CZ-CD2 4.47Å; F445-L449 WeakPolarHBondContact O-CB 3.32Å; F445-L449 PolarHBondContact O-N 3.24Å; L449-A451 VanDerWaalsContact C-N 3.33Å; L449-A451 PolarHBondContact O-N 2.69Å; L449-H452 PolarHBondContact O-N 3.38Å; L449-Q453 PolarHBondContact O-N 3.4Å; L449-W488 HydrophobicContact CD1-CE3 4.19Å; L449-W488 HydrophobicContact CD1-CH2 3.66Å; L449-W488 HydrophobicContact CD1-CZ2 4.01Å; L449-W488 HydrophobicContact CD1-CZ3 3.76Å; L449-W488 HydrophobicContact CG-CH2 4.29Å; L449-W488 HydrophobicContact CG-CZ2 4.42Å; L449-W488 WeakPolarHBondContact O-CH2 3.45Å; L449-W488 WeakPolarHBondContact O-CZ2 3.25Å; L449-L491 HydrophobicContact CD1-CB 4.28Å
450	G	84.3	Confident	83.7	Confident	48 Å²	48	50.8 Å²	50.8	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-38.9	175.5	0	0	0	0	0	113.3	E446 G447 Q453	E446-G450 PolarHBondContact O-N 2.72Å; G447-G450 PolarHBondContact O-N 2.81Å; G450-Q453 WeakPolarHBondContact O-CB 3.43Å
451	A	80.3	Confident	84.8	Confident	58 Å²	58	50.4 Å²	50.4	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-38.3	177.4	0	0	0	0	0	112.4	G447 D448 L449 Q453	G447-A451 WeakPolarHBondContact O-CB 3.36Å; G447-A451 PolarHBondContact O-N 3.4Å; D448-A451 PolarHBondContact O-N 3.41Å; L449-A451 VanDerWaalsContact C-N 3.33Å; L449-A451 PolarHBondContact O-N 2.69Å; A451-Q453 VanDerWaalsContact C-N 3.3Å; A451-Q453 PolarHBondContact O-N 2.69Å
452	H	84	Confident	85.6	Confident	19 Å²	19	46.8 Å²	46.8	9%	0.088	27%	0.274	C	S	.	.	H	α-helix	trans	-73.3	-13.6	-177.7	-87.4	-115.1	0	0	0	114.9	W414 D448 L449 N454 R455 V456 W488	W414-H452 AromaticContact CD1-CE1 3.13Å; W414-H452 AromaticContact CD1-ND1 3.76Å; W414-H452 AromaticContact CD1-NE2 3.42Å; W414-H452 AromaticContact CD2-CE1 3.47Å; W414-H452 VanDerWaalsContact CD2-CE1 3.47Å; W414-H452 AromaticContact CD2-CG 3.96Å; W414-H452 AromaticContact CD2-ND1 3.27Å; W414-H452 VanDerWaalsContact CD2-ND1 3.27Å; W414-H452 AromaticContact CE2-CD2 3.9Å; W414-H452 AromaticContact CE2-CE1 3.64Å; W414-H452 AromaticContact CE2-CG 3.62Å; W414-H452 AromaticContact CE2-ND1 3.44Å; W414-H452 AromaticContact CE2-NE2 3.94Å; W414-H452 AromaticContact CE3-ND1 3.68Å; W414-H452 AromaticContact CG-CE1 3.18Å; W414-H452 AromaticContact CG-ND1 3.53Å; W414-H452 AromaticContact CG-NE2 3.94Å; W414-H452 HydrophobicContact CH2-CB 4.14Å; W414-H452 HydrophobicContact CZ2-CB 4Å; W414-H452 AromaticContact CZ2-CG 3.83Å; W414-H452 AromaticContact NE1-CD2 3.65Å; W414-H452 AromaticContact NE1-CE1 3.36Å; W414-H452 PolarHBondContact NE1-CE1 2.9Å; W414-H452 AromaticContact NE1-CG 3.84Å; W414-H452 AromaticContact NE1-ND1 3.66Å; W414-H452 AromaticContact NE1-NE2 3.37Å; W414-H452 PolarHBondContact NE1-NE2 3.46Å; D448-H452 PolarHBondContact O-CD2 2.86Å; D448-H452 VanDerWaalsContact O-CD2 3.31Å; D448-H452 PolarHBondContact O-N 3.02Å; D448-H452 IonicContact OD1-CD2 3.83Å; D448-H452 IonicContact OD1-NE2 2.91Å; L449-H452 PolarHBondContact O-N 3.38Å; H452-N454 VanDerWaalsContact C-N 3.34Å; H452-N454 PolarHBondContact O-N 2.88Å; H452-R455 PolarHBondContact CE1-NH1 3.48Å; H452-R455 VanDerWaalsContact CE1-NH1 3.31Å; H452-R455 WeakPolarHBondContact O-CA 3.48Å; H452-R455 WeakPolarHBondContact O-CB 3.45Å; H452-R455 PolarHBondContact O-N 3.01Å; H452-V456 PolarHBondContact O-N 2.87Å; H452-W488 HydrophobicContact CB-CH2 3.54Å; H452-W488 HydrophobicContact CB-CZ3 3.7Å
453	Q	87.8	Confident	86.1	Confident	72 Å²	72	46.7 Å²	46.7	34%	0.336	27%	0.274	S	S	.	.	H	α-helix	trans	-51.4	-50	176.7	177.2	64.5	30	0	0	112	L449 G450 A451 R455 V456 E457 W488	L449-Q453 PolarHBondContact O-N 3.4Å; G450-Q453 WeakPolarHBondContact O-CB 3.43Å; A451-Q453 VanDerWaalsContact C-N 3.3Å; A451-Q453 PolarHBondContact O-N 2.69Å; Q453-R455 PolarHBondContact O-N 2.63Å; Q453-R455 VanDerWaalsContact O-N 3.1Å; Q453-V456 PolarHBondContact O-N 3.5Å; Q453-V456 VanDerWaalsContact O-N 3.1Å; Q453-E457 WeakPolarHBondContact CG-OE1 3.36Å; Q453-E457 PolarHBondContact NE2-OE1 2.79Å; Q453-E457 PolarHBondContact O-N 2.88Å; Q453-E457 VanDerWaalsContact O-N 3.11Å; Q453-W488 VanDerWaalsContact CA-CZ2 3.5Å; Q453-W488 HydrophobicContact CB-CZ2 3.93Å; Q453-W488 VanDerWaalsContact N-CH2 3.34Å; Q453-W488 VanDerWaalsContact OE1-CZ2 3.31Å
454	N	88.3	Confident	86.9	Confident	96 Å²	96	50 Å²	50	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-58.6	-26.2	178.2	-66.8	-68.9	0	0	0	113.1	H452 R458	H452-N454 VanDerWaalsContact C-N 3.34Å; H452-N454 PolarHBondContact O-N 2.88Å; N454-R458 WeakPolarHBondContact O-CB 3.36Å; N454-R458 WeakPolarHBondContact O-CG 3.45Å; N454-R458 PolarHBondContact O-N 3.47Å
455	R	87.3	Confident	87.8	Confident	50 Å²	50	51 Å²	51	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-76.2	-39.7	179	-169.1	179.5	-69.9	174	4.5	111	T410 H452 Q453 R458 I459 E535	T410-R455 PolarHBondContact O-NH1 3.36Å; H452-R455 PolarHBondContact CE1-NH1 3.48Å; H452-R455 VanDerWaalsContact CE1-NH1 3.31Å; H452-R455 WeakPolarHBondContact O-CA 3.48Å; H452-R455 WeakPolarHBondContact O-CB 3.45Å; H452-R455 PolarHBondContact O-N 3.01Å; Q453-R455 PolarHBondContact O-N 2.63Å; Q453-R455 VanDerWaalsContact O-N 3.1Å; R455-R458 PolarHBondContact O-N 3.27Å; R455-I459 HydrophobicContact CG-CD1 4.49Å; R455-I459 WeakPolarHBondContact O-CG1 3.4Å; R455-I459 PolarHBondContact O-N 3.04Å; R455-I459 VanDerWaalsContact O-N 3.09Å; R455-E535 IonicContact CZ-OE1 3.95Å; R455-E535 IonicContact NH2-OE1 2.67Å; R455-E535 PolarHBondContact NH2-OE1 3.11Å
456	V	90.6	Very high	88.3	Confident	8 Å²	8	49.9 Å²	49.9	5%	0.048	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-48.6	175.3	179.5	0	0	0	0	110.3	H411 H452 Q453 R458 I459 V460 I484 V485 W488	H411-V456 WeakPolarHBondContact CE1-CG2 3.47Å; H452-V456 PolarHBondContact O-N 2.87Å; Q453-V456 PolarHBondContact O-N 3.5Å; Q453-V456 VanDerWaalsContact O-N 3.1Å; V456-R458 VanDerWaalsContact C-N 3.29Å; V456-R458 PolarHBondContact O-N 3.18Å; V456-I459 WeakPolarHBondContact O-CB 3.35Å; V456-I459 PolarHBondContact O-N 3.03Å; V456-V460 PolarHBondContact O-N 3.39Å; V456-I484 HydrophobicContact CG1-CG2 4.4Å; V456-I484 HydrophobicContact CG2-CG2 4.5Å; V456-V485 HydrophobicContact CG1-CG2 4.32Å; V456-W488 HydrophobicContact CG2-CD2 3.76Å; V456-W488 HydrophobicContact CG2-CE3 3.61Å; V456-W488 HydrophobicContact CG2-CG 4.21Å; V456-W488 HydrophobicContact CG2-CH2 4.42Å; V456-W488 HydrophobicContact CG2-CZ3 3.95Å
457	E	91.8	Very high	88.8	Confident	98 Å²	98	50 Å²	50	46%	0.458	28%	0.28	S	S	.	.	H	α-helix	trans	-56	-42	176.5	-68.8	172.2	-176.4	0	0	112.2	Q453 I459 V460 A461	Q453-E457 WeakPolarHBondContact CG-OE1 3.36Å; Q453-E457 PolarHBondContact NE2-OE1 2.79Å; Q453-E457 PolarHBondContact O-N 2.88Å; Q453-E457 VanDerWaalsContact O-N 3.11Å; E457-I459 PolarHBondContact O-N 3.06Å; E457-V460 PolarHBondContact O-N 3.1Å; E457-A461 WeakPolarHBondContact O-CB 3.48Å; E457-A461 PolarHBondContact O-N 2.98Å
458	R	91.9	Very high	89.4	Confident	148 Å²	148	55 Å²	55	56%	0.558	29%	0.291	S	S	*	.	H	α-helix	trans	-68.3	-29.3	175.2	-75	176.8	-174.5	-145.4	9.7	113.9	N454 R455 V456 I462	N454-R458 WeakPolarHBondContact O-CB 3.36Å; N454-R458 WeakPolarHBondContact O-CG 3.45Å; N454-R458 PolarHBondContact O-N 3.47Å; R455-R458 PolarHBondContact O-N 3.27Å; V456-R458 VanDerWaalsContact C-N 3.29Å; V456-R458 PolarHBondContact O-N 3.18Å; R458-I462 VanDerWaalsContact O-CD1 3.32Å; R458-I462 WeakPolarHBondContact O-CD1 3.45Å; R458-I462 VanDerWaalsContact O-CG1 3.23Å; R458-I462 WeakPolarHBondContact O-CG1 3.48Å; R458-I462 PolarHBondContact O-N 3.38Å
459	I	92.2	Very high	90.1	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-46.8	174.7	-72.4	166	0	0	0	109.5	F404 K407 H411 R455 V456 E457 A461 I462 A463 T481 I484	F404-I459 HydrophobicContact CD2-CG2 4.33Å; F404-I459 HydrophobicContact CE2-CG2 3.82Å; K407-I459 HydrophobicContact CB-CD1 4.23Å; K407-I459 HydrophobicContact CB-CG1 3.79Å; H411-I459 HydrophobicContact CB-CD1 3.79Å; R455-I459 HydrophobicContact CG-CD1 4.49Å; R455-I459 WeakPolarHBondContact O-CG1 3.4Å; R455-I459 PolarHBondContact O-N 3.04Å; R455-I459 VanDerWaalsContact O-N 3.09Å; V456-I459 WeakPolarHBondContact O-CB 3.35Å; V456-I459 PolarHBondContact O-N 3.03Å; E457-I459 PolarHBondContact O-N 3.06Å; I459-A461 PolarHBondContact O-N 3.46Å; I459-I462 PolarHBondContact O-N 3.34Å; I459-A463 PolarHBondContact O-N 3.16Å; I459-T481 HydrophobicContact CG2-CG2 4.48Å; I459-I484 HydrophobicContact CD1-CD1 4.36Å; I459-I484 HydrophobicContact CG2-CD1 4.32Å
460	V	94.2	Very high	90.4	Very high	41 Å²	41	59.2 Å²	59.2	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-58	-49.2	175.8	177.2	0	0	0	0	110.8	V456 E457 I462 A463 E464 T481 V485	V456-V460 PolarHBondContact O-N 3.39Å; E457-V460 PolarHBondContact O-N 3.1Å; V460-I462 VanDerWaalsContact C-N 3.34Å; V460-I462 PolarHBondContact O-N 3.05Å; V460-A463 WeakPolarHBondContact O-CB 3.34Å; V460-A463 PolarHBondContact O-N 3.43Å; V460-A463 VanDerWaalsContact O-N 3.11Å; V460-E464 HydrophobicContact CG1-CG 4.45Å; V460-E464 WeakPolarHBondContact O-CG 3.34Å; V460-E464 PolarHBondContact O-N 3.16Å; V460-T481 HydrophobicContact CB-CG2 4.44Å; V460-T481 HydrophobicContact CG2-CG2 3.86Å; V460-V485 HydrophobicContact CG2-CG2 4Å
461	A	94	Very high	90.6	Very high	50 Å²	50	59 Å²	59	41%	0.413	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-37.4	179.6	0	0	0	0	0	113.7	E457 I459 E464 E465	E457-A461 WeakPolarHBondContact O-CB 3.48Å; E457-A461 PolarHBondContact O-N 2.98Å; I459-A461 PolarHBondContact O-N 3.46Å; A461-E464 PolarHBondContact O-N 3.45Å; A461-E465 PolarHBondContact O-N 3.39Å
462	I	91.7	Very high	90.9	Very high	11 Å²	11	62.7 Å²	62.7	6%	0.056	31%	0.31	C	S	.	.	H	α-helix	trans	-71.5	-37.1	175.9	-66.5	163.8	0	0	0	111	L400 K403 F404 K407 R458 I459 V460 E465 L466	L400-I462 HydrophobicContact CB-CG2 4.48Å; L400-I462 HydrophobicContact CD2-CG2 4.35Å; K403-I462 HydrophobicContact CD-CD1 3.95Å; K403-I462 HydrophobicContact CG-CD1 3.97Å; F404-I462 HydrophobicContact CB-CG2 3.82Å; F404-I462 HydrophobicContact CD2-CG2 4.33Å; K407-I462 HydrophobicContact CD-CD1 3.83Å; R458-I462 VanDerWaalsContact O-CD1 3.32Å; R458-I462 WeakPolarHBondContact O-CD1 3.45Å; R458-I462 VanDerWaalsContact O-CG1 3.23Å; R458-I462 WeakPolarHBondContact O-CG1 3.48Å; R458-I462 PolarHBondContact O-N 3.38Å; I459-I462 PolarHBondContact O-N 3.34Å; V460-I462 VanDerWaalsContact C-N 3.34Å; V460-I462 PolarHBondContact O-N 3.05Å; I462-E465 PolarHBondContact O-N 3.25Å; I462-L466 HydrophobicContact CG2-CD1 4.23Å; I462-L466 WeakPolarHBondContact O-CG 3.24Å; I462-L466 PolarHBondContact O-N 3.39Å
463	A	93.9	Very high	91.2	Very high	3 Å²	3	67.5 Å²	67.5	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-44.8	173.1	0	0	0	0	0	110.9	F404 I459 V460 E465 L466 N467 V477 T481	F404-A463 HydrophobicContact CE2-CB 4.08Å; I459-A463 PolarHBondContact O-N 3.16Å; V460-A463 WeakPolarHBondContact O-CB 3.34Å; V460-A463 PolarHBondContact O-N 3.43Å; V460-A463 VanDerWaalsContact O-N 3.11Å; A463-E465 PolarHBondContact O-N 3.31Å; A463-L466 PolarHBondContact O-N 2.89Å; A463-N467 PolarHBondContact O-N 2.88Å; A463-N467 PolarHBondContact O-ND2 3.31Å; A463-V477 HydrophobicContact CB-CG1 3.7Å; A463-T481 HydrophobicContact CB-CG2 4.16Å; A463-T481 WeakPolarHBondContact CB-OG1 3.45Å
464	E	93.8	Very high	91.4	Very high	111 Å²	111	65.7 Å²	65.7	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-41.8	174.8	-71	176.5	170.4	0	0	112.5	V460 A461 N467 Q468	V460-E464 HydrophobicContact CG1-CG 4.45Å; V460-E464 WeakPolarHBondContact O-CG 3.34Å; V460-E464 PolarHBondContact O-N 3.16Å; A461-E464 PolarHBondContact O-N 3.45Å; E464-N467 WeakPolarHBondContact O-CB 3.38Å; E464-N467 PolarHBondContact O-N 3.48Å; E464-Q468 WeakPolarHBondContact O-CG 3.41Å; E464-Q468 PolarHBondContact O-N 2.76Å
465	E	93.1	Very high	91.6	Very high	66 Å²	66	68.4 Å²	68.4	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-41.6	175.2	-163.5	-178.7	168.2	0	0	111.8	Q396 L400 A461 I462 A463 N467 Q468 L469	Q396-E465 PolarHBondContact NE2-OE1 3.44Å; L400-E465 HydrophobicContact CD1-CB 4.27Å; L400-E465 VanDerWaalsContact CD1-CD 3.43Å; L400-E465 HydrophobicContact CD1-CG 3.69Å; L400-E465 WeakPolarHBondContact CD1-OE1 3.37Å; L400-E465 WeakPolarHBondContact CD2-OE2 3.37Å; A461-E465 PolarHBondContact O-N 3.39Å; I462-E465 PolarHBondContact O-N 3.25Å; A463-E465 PolarHBondContact O-N 3.31Å; E465-N467 VanDerWaalsContact C-N 3.35Å; E465-N467 PolarHBondContact O-N 2.85Å; E465-Q468 PolarHBondContact O-N 3.22Å; E465-L469 HydrophobicContact CG-CD1 4.34Å; E465-L469 WeakPolarHBondContact O-CG 3.28Å; E465-L469 PolarHBondContact O-N 3.05Å
466	L	93.5	Very high	91.9	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-34.2	174.2	-75.3	169	0	0	0	113	L400 F404 I462 A463 Y471 V477	L400-L466 HydrophobicContact CB-CD2 3.64Å; L400-L466 HydrophobicContact CB-CG 4Å; L400-L466 HydrophobicContact CD1-CD2 4.41Å; F404-L466 HydrophobicContact CB-CD1 4.05Å; F404-L466 HydrophobicContact CG-CD1 4.3Å; I462-L466 HydrophobicContact CG2-CD1 4.23Å; I462-L466 WeakPolarHBondContact O-CG 3.24Å; I462-L466 PolarHBondContact O-N 3.39Å; A463-L466 PolarHBondContact O-N 2.89Å; L466-Y471 HydrophobicContact CD2-CD1 4.12Å; L466-Y471 HydrophobicContact CD2-CG 4.2Å; L466-Y471 PolarHBondContact O-N 3.31Å; L466-V477 HydrophobicContact CD1-CG1 4.14Å; L466-V477 HydrophobicContact CD1-CG2 4.29Å
467	N	92.2	Very high	92	Very high	58 Å²	58	69.2 Å²	69.2	31%	0.31	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-48	170.8	-79.6	-96.6	0	0	0	110.6	A463 E464 E465 L469 N470 V474 N478	A463-N467 PolarHBondContact O-N 2.88Å; A463-N467 PolarHBondContact O-ND2 3.31Å; E464-N467 WeakPolarHBondContact O-CB 3.38Å; E464-N467 PolarHBondContact O-N 3.48Å; E465-N467 VanDerWaalsContact C-N 3.35Å; E465-N467 PolarHBondContact O-N 2.85Å; N467-L469 VanDerWaalsContact C-N 3.25Å; N467-L469 PolarHBondContact O-N 2.91Å; N467-N470 PolarHBondContact O-N 3.25Å; N467-N470 VanDerWaalsContact O-N 3.1Å; N467-V474 HydrophobicContact CB-CG2 4.09Å; N467-V474 WeakPolarHBondContact OD1-CG2 3.4Å; N467-N478 PolarHBondContact ND2-OD1 2.63Å; N467-N478 PolarHBondContact OD1-ND2 2.95Å
468	Q	93.2	Very high	92.1	Very high	152 Å²	152	67.5 Å²	67.5	71%	0.71	34%	0.343	S	S	*	.	H	α-helix	trans	-62.3	-31.5	-178.6	-70.9	171.6	33.4	0	0	113.1	E464 E465 N470	E464-Q468 WeakPolarHBondContact O-CG 3.41Å; E464-Q468 PolarHBondContact O-N 2.76Å; E465-Q468 PolarHBondContact O-N 3.22Å; Q468-N470 VanDerWaalsContact C-N 3.3Å
469	L	91	Very high	92.3	Very high	30 Å²	30	66.4 Å²	66.4	16%	0.157	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-2.1	178.2	-67	169.8	0	0	0	114.2	R393 Q396 I397 L400 E465 N467	R393-L469 HydrophobicContact CG-CD2 4.22Å; R393-L469 PolarHBondContact NH1-O 3.46Å; Q396-L469 HydrophobicContact CG-CD1 3.85Å; I397-L469 HydrophobicContact CD1-CB 4.05Å; I397-L469 HydrophobicContact CG1-CB 3.87Å; I397-L469 HydrophobicContact CG1-CD1 4.07Å; L400-L469 HydrophobicContact CD1-CD1 3.45Å; L400-L469 VanDerWaalsContact CD1-CD1 3.45Å; E465-L469 HydrophobicContact CG-CD1 4.34Å; E465-L469 WeakPolarHBondContact O-CG 3.28Å; E465-L469 PolarHBondContact O-N 3.05Å; N467-L469 VanDerWaalsContact C-N 3.25Å; N467-L469 PolarHBondContact O-N 2.91Å
470	N	89	Confident	92.4	Very high	124 Å²	124	69.4 Å²	69.4	66%	0.663	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	61.1	-173.2	-54.8	-66.3	0	0	0	112.3	R393 N467 Q468	R393-N470 PolarHBondContact NH1-O 3.42Å; N467-N470 PolarHBondContact O-N 3.25Å; N467-N470 VanDerWaalsContact O-N 3.1Å; Q468-N470 VanDerWaalsContact C-N 3.3Å
471	Y	89.5	Confident	92.5	Very high	42 Å²	42	68.1 Å²	68.1	17%	0.165	35%	0.347	C	S	.	.			trans	-73.6	138.1	171.8	178.2	-136.5	0	0	0	111.8	I397 A401 L466 E473 V474 V477	I397-Y471 HydrophobicContact CG2-CD2 3.35Å; I397-Y471 HydrophobicContact CG2-CE2 3.83Å; I397-Y471 HydrophobicContact CG2-CG 4.05Å; A401-Y471 HydrophobicContact CB-CE1 4.22Å; L466-Y471 HydrophobicContact CD2-CD1 4.12Å; L466-Y471 HydrophobicContact CD2-CG 4.2Å; L466-Y471 PolarHBondContact O-N 3.31Å; Y471-E473 HydrophobicContact CD1-CB 4.28Å; Y471-E473 HydrophobicContact CE1-CB 3.66Å; Y471-E473 HydrophobicContact CE1-CG 4.34Å; Y471-E473 PolarHBondContact O-N 3.23Å; Y471-E473 PolarHBondContact OH-OE2 3.48Å; Y471-E473 VanDerWaalsContact OH-OE2 3.13Å; Y471-V474 VanDerWaalsContact O-CB 3.24Å; Y471-V474 WeakPolarHBondContact O-CB 3.44Å; Y471-V474 WeakPolarHBondContact O-CG1 3.47Å; Y471-V474 PolarHBondContact O-N 2.94Å; Y471-V477 HydrophobicContact CD1-CG2 4.01Å; Y471-V477 HydrophobicContact CE1-CG2 3.93Å
472	D	87	Confident	92.5	Very high	137 Å²	137	71.3 Å²	71.3	73%	0.733	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-38.3	-174.4	-60.9	-41.6	0	0	0	113.5	V474	D472-V474 VanDerWaalsContact C-N 3.25Å; D472-V474 PolarHBondContact O-N 3.27Å
473	E	90.3	Very high	92.6	Very high	119 Å²	119	75.5 Å²	75.5	56%	0.556	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	20.2	179.9	-52.3	-175.1	165.2	0	0	113.3	Y471 Q475 S476 V477	Y471-E473 HydrophobicContact CD1-CB 4.28Å; Y471-E473 HydrophobicContact CE1-CB 3.66Å; Y471-E473 HydrophobicContact CE1-CG 4.34Å; Y471-E473 PolarHBondContact O-N 3.23Å; Y471-E473 PolarHBondContact OH-OE2 3.48Å; Y471-E473 VanDerWaalsContact OH-OE2 3.13Å; E473-Q475 PolarHBondContact O-N 2.65Å; E473-S476 PolarHBondContact O-N 3.43Å; E473-V477 PolarHBondContact O-N 3.49Å
474	V	91	Very high	92.6	Very high	34 Å²	34	75.5 Å²	75.5	21%	0.206	38%	0.376	C	S	.	.	H	α-helix	trans	-55	-31	-174.2	68.8	0	0	0	0	113.9	N467 Y471 D472 V477 N478	N467-V474 HydrophobicContact CB-CG2 4.09Å; N467-V474 WeakPolarHBondContact OD1-CG2 3.4Å; Y471-V474 VanDerWaalsContact O-CB 3.24Å; Y471-V474 WeakPolarHBondContact O-CB 3.44Å; Y471-V474 WeakPolarHBondContact O-CG1 3.47Å; Y471-V474 PolarHBondContact O-N 2.94Å; D472-V474 VanDerWaalsContact C-N 3.25Å; D472-V474 PolarHBondContact O-N 3.27Å; V474-V477 PolarHBondContact O-N 2.95Å; V474-N478 WeakPolarHBondContact O-CB 3.37Å; V474-N478 VanDerWaalsContact O-CG 3.24Å; V474-N478 PolarHBondContact O-N 2.81Å; V474-N478 PolarHBondContact O-ND2 2.95Å
475	Q	92.5	Very high	92.6	Very high	153 Å²	153	72.7 Å²	72.7	72%	0.715	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-46.7	175.1	-66.6	-178.9	-6.2	0	0	111.7	E473 V477 N478 E479	E473-Q475 PolarHBondContact O-N 2.65Å; Q475-V477 VanDerWaalsContact C-N 3.35Å; Q475-V477 PolarHBondContact O-N 3.36Å; Q475-N478 PolarHBondContact O-N 3Å; Q475-E479 WeakPolarHBondContact O-CG 3.33Å; Q475-E479 PolarHBondContact O-N 3.38Å
476	S	93.3	Very high	92.5	Very high	69 Å²	69	74.7 Å²	74.7	48%	0.483	38%	0.376	S	S	.	.	H	α-helix	trans	-67.3	-36.2	178.3	-170.8	0	0	0	0	112.1	E473 R480	E473-S476 PolarHBondContact O-N 3.43Å; S476-R480 VanDerWaalsContact O-CB 3.28Å; S476-R480 WeakPolarHBondContact O-CB 3.34Å; S476-R480 PolarHBondContact O-N 3.12Å
477	V	94.2	Very high	92.5	Very high	6 Å²	6	77.9 Å²	77.9	4%	0.036	39%	0.39	C	S	.	.	H	α-helix	trans	-61.1	-45.9	173	172.6	0	0	0	0	110.8	F404 A463 L466 Y471 E473 V474 Q475 T481	F404-V477 HydrophobicContact CD1-CG1 4.36Å; F404-V477 HydrophobicContact CD1-CG2 4.24Å; F404-V477 HydrophobicContact CD2-CG1 4.3Å; F404-V477 HydrophobicContact CE1-CB 4.18Å; F404-V477 HydrophobicContact CE1-CG1 3.96Å; F404-V477 HydrophobicContact CE1-CG2 4.04Å; F404-V477 HydrophobicContact CE2-CG1 3.9Å; F404-V477 HydrophobicContact CZ-CB 4.27Å; F404-V477 HydrophobicContact CZ-CG1 3.72Å; F404-V477 WeakPolarHBondContact CZ-O 3.28Å; A463-V477 HydrophobicContact CB-CG1 3.7Å; L466-V477 HydrophobicContact CD1-CG1 4.14Å; L466-V477 HydrophobicContact CD1-CG2 4.29Å; Y471-V477 HydrophobicContact CD1-CG2 4.01Å; Y471-V477 HydrophobicContact CE1-CG2 3.93Å; E473-V477 PolarHBondContact O-N 3.49Å; V474-V477 PolarHBondContact O-N 2.95Å; Q475-V477 VanDerWaalsContact C-N 3.35Å; Q475-V477 PolarHBondContact O-N 3.36Å; V477-T481 WeakPolarHBondContact O-CB 3.32Å; V477-T481 PolarHBondContact O-N 2.98Å; V477-T481 PolarHBondContact O-OG1 3.17Å
478	N	93.7	Very high	92.4	Very high	63 Å²	63	76.3 Å²	76.3	34%	0.337	38%	0.38	S	S	.	.	H	α-helix	trans	-68.7	-46.6	-179.4	-72.1	-16.1	0	0	0	112.4	N467 V474 Q475 R480 T481 Q482	N467-N478 PolarHBondContact ND2-OD1 2.63Å; N467-N478 PolarHBondContact OD1-ND2 2.95Å; V474-N478 WeakPolarHBondContact O-CB 3.37Å; V474-N478 VanDerWaalsContact O-CG 3.24Å; V474-N478 PolarHBondContact O-N 2.81Å; V474-N478 PolarHBondContact O-ND2 2.95Å; Q475-N478 PolarHBondContact O-N 3Å; N478-R480 VanDerWaalsContact C-N 3.34Å; N478-R480 PolarHBondContact O-N 3.18Å; N478-T481 PolarHBondContact O-N 3.31Å; N478-Q482 PolarHBondContact O-N 3.41Å
479	E	94.7	Very high	92.3	Very high	124 Å²	124	74.3 Å²	74.3	58%	0.579	37%	0.374	S	S	*	.	H	α-helix	trans	-57.1	-46.4	175.5	-73.6	175.3	176.9	0	0	111.7	Q475 T481 Q482 N483	Q475-E479 WeakPolarHBondContact O-CG 3.33Å; Q475-E479 PolarHBondContact O-N 3.38Å; E479-T481 VanDerWaalsContact C-N 3.34Å; E479-T481 PolarHBondContact O-N 3.02Å; E479-Q482 PolarHBondContact O-N 2.95Å; E479-N483 VanDerWaalsContact O-CG 3.29Å; E479-N483 PolarHBondContact O-N 3.15Å; E479-N483 PolarHBondContact O-ND2 3.37Å
480	R	95.4	Very high	92.3	Very high	65 Å²	65	75.8 Å²	75.8	25%	0.245	38%	0.383	C	S	.	.	H	α-helix	trans	-65	-37.7	178.2	-169.7	174	-171.7	174.5	1.4	112.4	F404 E412 S476 N478 I484	F404-R480 HydrophobicContact CZ-CB 4.33Å; E412-R480 IonicContact OE1-CZ 3.26Å; E412-R480 VanDerWaalsContact OE1-CZ 3.23Å; E412-R480 IonicContact OE1-NE 2.9Å; E412-R480 PolarHBondContact OE1-NE 3.09Å; E412-R480 IonicContact OE1-NH2 3.17Å; E412-R480 PolarHBondContact OE1-NH2 3.02Å; E412-R480 IonicContact OE2-CZ 3.94Å; E412-R480 IonicContact OE2-NE 2.64Å; E412-R480 IonicContact OE2-NH2 3.9Å; E412-R480 PolarHBondContact OE2-NH2 3.16Å; S476-R480 VanDerWaalsContact O-CB 3.28Å; S476-R480 WeakPolarHBondContact O-CB 3.34Å; S476-R480 PolarHBondContact O-N 3.12Å; N478-R480 VanDerWaalsContact C-N 3.34Å; N478-R480 PolarHBondContact O-N 3.18Å; R480-I484 HydrophobicContact CG-CD1 4.48Å; R480-I484 WeakPolarHBondContact O-CG1 3.48Å; R480-I484 PolarHBondContact O-N 3.49Å
481	T	95.1	Very high	92.3	Very high	13 Å²	13	69.9 Å²	69.9	8%	0.08	35%	0.351	C	S	.	.	H	α-helix	trans	-66.4	-44.3	176.6	-57.4	0	0	0	0	111.3	F404 I459 V460 A463 V477 N478 E479 N483 I484 V485	F404-T481 WeakPolarHBondContact CE2-OG1 3.35Å; F404-T481 WeakPolarHBondContact CZ-OG1 3.27Å; I459-T481 HydrophobicContact CG2-CG2 4.48Å; V460-T481 HydrophobicContact CB-CG2 4.44Å; V460-T481 HydrophobicContact CG2-CG2 3.86Å; A463-T481 HydrophobicContact CB-CG2 4.16Å; A463-T481 WeakPolarHBondContact CB-OG1 3.45Å; V477-T481 WeakPolarHBondContact O-CB 3.32Å; V477-T481 PolarHBondContact O-N 2.98Å; V477-T481 PolarHBondContact O-OG1 3.17Å; N478-T481 PolarHBondContact O-N 3.31Å; E479-T481 VanDerWaalsContact C-N 3.34Å; E479-T481 PolarHBondContact O-N 3.02Å; T481-N483 PolarHBondContact O-N 3.4Å; T481-I484 PolarHBondContact O-N 3.39Å; T481-V485 WeakPolarHBondContact O-CG2 3.43Å; T481-V485 PolarHBondContact O-N 2.94Å; T481-V485 VanDerWaalsContact O-N 3.09Å
482	Q	94.4	Very high	92.2	Very high	117 Å²	117	69.4 Å²	69.4	55%	0.547	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-46.8	176.5	-178.8	177.4	-15	0	0	111.6	N478 E479 I484 V485 E486	N478-Q482 PolarHBondContact O-N 3.41Å; E479-Q482 PolarHBondContact O-N 2.95Å; Q482-I484 VanDerWaalsContact C-N 3.26Å; Q482-I484 PolarHBondContact O-N 2.94Å; Q482-V485 PolarHBondContact O-N 3.24Å; Q482-V485 VanDerWaalsContact O-N 3.11Å; Q482-E486 HydrophobicContact CG-CG 4.38Å; Q482-E486 WeakPolarHBondContact CG-OE1 3.26Å; Q482-E486 PolarHBondContact NE2-OE1 3.14Å; Q482-E486 PolarHBondContact O-N 3.46Å
483	N	94.1	Very high	92.3	Very high	100 Å²	100	69.2 Å²	69.2	54%	0.535	35%	0.348	S	S	.	.	H	α-helix	trans	-56.9	-39.1	177.2	-71.9	-38.2	0	0	0	112.5	E479 T481 Q487	E479-N483 VanDerWaalsContact O-CG 3.29Å; E479-N483 PolarHBondContact O-N 3.15Å; E479-N483 PolarHBondContact O-ND2 3.37Å; T481-N483 PolarHBondContact O-N 3.4Å; N483-Q487 VanDerWaalsContact O-CB 3.3Å; N483-Q487 WeakPolarHBondContact O-CB 3.1Å; N483-Q487 PolarHBondContact O-N 2.91Å
484	I	92.9	Very high	92.2	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-42	176.6	-74.1	169.9	0	0	0	111.4	C408 V456 I459 R480 T481 Q482 Q487 W488	C408-I484 HydrophobicContact CB-CD1 3.91Å; V456-I484 HydrophobicContact CG1-CG2 4.4Å; V456-I484 HydrophobicContact CG2-CG2 4.5Å; I459-I484 HydrophobicContact CD1-CD1 4.36Å; I459-I484 HydrophobicContact CG2-CD1 4.32Å; R480-I484 HydrophobicContact CG-CD1 4.48Å; R480-I484 WeakPolarHBondContact O-CG1 3.48Å; R480-I484 PolarHBondContact O-N 3.49Å; T481-I484 PolarHBondContact O-N 3.39Å; Q482-I484 VanDerWaalsContact C-N 3.26Å; Q482-I484 PolarHBondContact O-N 2.94Å; I484-Q487 PolarHBondContact O-N 3.08Å; I484-W488 WeakPolarHBondContact O-CB 3.4Å; I484-W488 PolarHBondContact O-N 3.03Å
485	V	93.7	Very high	92	Very high	51 Å²	51	63.2 Å²	63.2	31%	0.309	32%	0.318	S	S	.	.	H	α-helix	trans	-67	-43.9	177.7	174.9	0	0	0	0	111.5	V456 V460 T481 Q482 Q487 W488 D489	V456-V485 HydrophobicContact CG1-CG2 4.32Å; V460-V485 HydrophobicContact CG2-CG2 4Å; T481-V485 WeakPolarHBondContact O-CG2 3.43Å; T481-V485 PolarHBondContact O-N 2.94Å; T481-V485 VanDerWaalsContact O-N 3.09Å; Q482-V485 PolarHBondContact O-N 3.24Å; Q482-V485 VanDerWaalsContact O-N 3.11Å; V485-Q487 VanDerWaalsContact C-N 3.33Å; V485-Q487 PolarHBondContact O-N 2.78Å; V485-W488 WeakPolarHBondContact O-CB 3.41Å; V485-W488 PolarHBondContact O-N 2.89Å; V485-W488 VanDerWaalsContact O-N 3.16Å; V485-D489 PolarHBondContact O-N 3.09Å
486	E	92.8	Very high	91.6	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	30%	0.302	S	S	.	.	H	α-helix	trans	-64.3	-37.6	176.6	-70	-178.5	-165.3	0	0	112.3	Q482 W488 N490	Q482-E486 HydrophobicContact CG-CG 4.38Å; Q482-E486 WeakPolarHBondContact CG-OE1 3.26Å; Q482-E486 PolarHBondContact NE2-OE1 3.14Å; Q482-E486 PolarHBondContact O-N 3.46Å; E486-W488 VanDerWaalsContact C-N 3.35Å; E486-N490 PolarHBondContact O-N 3.44Å
487	Q	91.9	Very high	91.1	Very high	67 Å²	67	60.7 Å²	60.7	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-41.1	173	-173.8	174.1	23	0	0	111.4	A415 N483 I484 V485 L491	A415-Q487 HydrophobicContact CB-CG 4.37Å; A415-Q487 VanDerWaalsContact CB-NE2 3.31Å; N483-Q487 VanDerWaalsContact O-CB 3.3Å; N483-Q487 WeakPolarHBondContact O-CB 3.1Å; N483-Q487 PolarHBondContact O-N 2.91Å; I484-Q487 PolarHBondContact O-N 3.08Å; V485-Q487 VanDerWaalsContact C-N 3.33Å; V485-Q487 PolarHBondContact O-N 2.78Å; Q487-L491 WeakPolarHBondContact O-CG 3.31Å; Q487-L491 PolarHBondContact O-N 2.81Å; Q487-L491 VanDerWaalsContact O-N 3.12Å
488	W	91.8	Very high	90.7	Very high	26 Å²	26	61.1 Å²	61.1	10%	0.098	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-53.3	178.5	-174.5	-105.8	0	0	0	113	H411 W414 L449 H452 Q453 V456 I484 V485 E486 N490 L491 G492	H411-W488 AromaticContact CE1-CE3 3.78Å; H411-W488 AromaticContact CE1-CZ3 3.96Å; W414-W488 HydrophobicContact CH2-CE3 4.24Å; W414-W488 HydrophobicContact CH2-CH2 4.34Å; W414-W488 AromaticContact CH2-CZ3 3.52Å; W414-W488 HydrophobicContact CH2-CZ3 3.52Å; W414-W488 HydrophobicContact CZ3-CE3 4.11Å; W414-W488 AromaticContact CZ3-CZ3 3.65Å; W414-W488 HydrophobicContact CZ3-CZ3 3.65Å; L449-W488 HydrophobicContact CD1-CE3 4.19Å; L449-W488 HydrophobicContact CD1-CH2 3.66Å; L449-W488 HydrophobicContact CD1-CZ2 4.01Å; L449-W488 HydrophobicContact CD1-CZ3 3.76Å; L449-W488 HydrophobicContact CG-CH2 4.29Å; L449-W488 HydrophobicContact CG-CZ2 4.42Å; L449-W488 WeakPolarHBondContact O-CH2 3.45Å; L449-W488 WeakPolarHBondContact O-CZ2 3.25Å; H452-W488 HydrophobicContact CB-CH2 3.54Å; H452-W488 HydrophobicContact CB-CZ3 3.7Å; Q453-W488 VanDerWaalsContact CA-CZ2 3.5Å; Q453-W488 HydrophobicContact CB-CZ2 3.93Å; Q453-W488 VanDerWaalsContact N-CH2 3.34Å; Q453-W488 VanDerWaalsContact OE1-CZ2 3.31Å; V456-W488 HydrophobicContact CG2-CD2 3.76Å; V456-W488 HydrophobicContact CG2-CE3 3.61Å; V456-W488 HydrophobicContact CG2-CG 4.21Å; V456-W488 HydrophobicContact CG2-CH2 4.42Å; V456-W488 HydrophobicContact CG2-CZ3 3.95Å; I484-W488 WeakPolarHBondContact O-CB 3.4Å; I484-W488 PolarHBondContact O-N 3.03Å; V485-W488 WeakPolarHBondContact O-CB 3.41Å; V485-W488 PolarHBondContact O-N 2.89Å; V485-W488 VanDerWaalsContact O-N 3.16Å; E486-W488 VanDerWaalsContact C-N 3.35Å; W488-N490 VanDerWaalsContact C-N 3.25Å; W488-N490 PolarHBondContact O-N 3.2Å; W488-L491 WeakPolarHBondContact O-CB 3.46Å; W488-L491 PolarHBondContact O-N 3.33Å; W488-G492 PolarHBondContact O-N 3.19Å
489	D	90.3	Very high	90.2	Very high	109 Å²	109	61.5 Å²	61.5	58%	0.583	30%	0.3	S	S	*	.	H	α-helix	trans	-60.4	-37.4	-178.5	-73.6	-15.7	0	0	0	111.7	V485 G492 R493	V485-D489 PolarHBondContact O-N 3.09Å; D489-G492 PolarHBondContact O-N 2.84Å; D489-R493 PolarHBondContact O-N 2.81Å; D489-R493 VanDerWaalsContact O-N 3.08Å
490	N	90.3	Very high	89.3	Confident	62 Å²	62	62.1 Å²	62.1	33%	0.332	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-37.9	175.6	-175.5	46	0	0	0	112.8	E486 W488 R493 L494	E486-N490 PolarHBondContact O-N 3.44Å; W488-N490 VanDerWaalsContact C-N 3.25Å; W488-N490 PolarHBondContact O-N 3.2Å; N490-R493 PolarHBondContact OD1-NH2 3.06Å; N490-L494 WeakPolarHBondContact O-CB 3.07Å; N490-L494 VanDerWaalsContact O-CG 3.31Å; N490-L494 WeakPolarHBondContact O-CG 3.3Å; N490-L494 PolarHBondContact O-N 2.99Å
491	L	89.2	Confident	88.3	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-44.5	174.2	-71.9	174.5	0	0	0	111.4	W414 A415 K418 A419 L422 L449 Q487 W488 R493 L494 S495	W414-L491 HydrophobicContact CH2-CD1 4.05Å; W414-L491 HydrophobicContact CZ3-CD1 3.88Å; A415-L491 HydrophobicContact CB-CD1 4.46Å; K418-L491 HydrophobicContact CB-CD1 4.45Å; K418-L491 HydrophobicContact CB-CD2 3.69Å; A419-L491 HydrophobicContact CB-CD2 3.92Å; L422-L491 HydrophobicContact CD1-CD2 3.91Å; L422-L491 WeakPolarHBondContact CD1-O 3.44Å; L449-L491 HydrophobicContact CD1-CB 4.28Å; Q487-L491 WeakPolarHBondContact O-CG 3.31Å; Q487-L491 PolarHBondContact O-N 2.81Å; Q487-L491 VanDerWaalsContact O-N 3.12Å; W488-L491 WeakPolarHBondContact O-CB 3.46Å; W488-L491 PolarHBondContact O-N 3.33Å; L491-R493 PolarHBondContact O-N 3.16Å; L491-L494 PolarHBondContact O-N 2.88Å; L491-S495 WeakPolarHBondContact O-CB 3.29Å; L491-S495 PolarHBondContact O-N 3.39Å
492	G	88.5	Confident	87.2	Confident	31 Å²	31	62.4 Å²	62.4	32%	0.32	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-49.3	175.7	0	0	0	0	0	112.6	W488 D489 L494 S495 E496	W488-G492 PolarHBondContact O-N 3.19Å; D489-G492 PolarHBondContact O-N 2.84Å; G492-L494 PolarHBondContact O-N 3.4Å; G492-S495 WeakPolarHBondContact O-CB 3.42Å; G492-S495 PolarHBondContact O-N 3.05Å; G492-E496 PolarHBondContact O-N 2.84Å
493	R	88.8	Confident	85.9	Confident	134 Å²	134	62.4 Å²	62.4	51%	0.506	31%	0.305	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177.9	-173.3	-167.5	62.3	73.6	6.3	113.1	D489 N490 L491 S495 I497	D489-R493 PolarHBondContact O-N 2.81Å; D489-R493 VanDerWaalsContact O-N 3.08Å; N490-R493 PolarHBondContact OD1-NH2 3.06Å; L491-R493 PolarHBondContact O-N 3.16Å; R493-S495 VanDerWaalsContact C-N 3.3Å; R493-I497 WeakPolarHBondContact O-CG1 3.31Å
494	L	88.5	Confident	84.3	Confident	24 Å²	24	61 Å²	61	13%	0.126	31%	0.314	C	S	.	.	H	α-helix	trans	-68.5	-30.8	177.1	-73.9	172.4	0	0	0	112.1	A419 L422 N490 L491 G492 R498	A419-L494 HydrophobicContact CB-CD1 4.09Å; L422-L494 HydrophobicContact CB-CB 3.82Å; L422-L494 HydrophobicContact CD1-CB 3.75Å; L422-L494 HydrophobicContact CG-CB 4.44Å; N490-L494 WeakPolarHBondContact O-CB 3.07Å; N490-L494 VanDerWaalsContact O-CG 3.31Å; N490-L494 WeakPolarHBondContact O-CG 3.3Å; N490-L494 PolarHBondContact O-N 2.99Å; L491-L494 PolarHBondContact O-N 2.88Å; G492-L494 PolarHBondContact O-N 3.4Å; L494-R498 PolarHBondContact O-N 3.02Å
495	S	86.5	Confident	82.8	Confident	3 Å²	3	65 Å²	65	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-63.6	-55.6	178.7	-157.5	0	0	0	0	111.6	H442 L491 G492 R493 I497 R498 K499	H442-S495 PolarHBondContact CE1-O 3.15Å; H442-S495 PolarHBondContact CE1-OG 3.44Å; H442-S495 PolarHBondContact NE2-O 3.44Å; H442-S495 VanDerWaalsContact NE2-O 3.12Å; H442-S495 PolarHBondContact NE2-OG 2.78Å; L491-S495 WeakPolarHBondContact O-CB 3.29Å; L491-S495 PolarHBondContact O-N 3.39Å; G492-S495 WeakPolarHBondContact O-CB 3.42Å; G492-S495 PolarHBondContact O-N 3.05Å; R493-S495 VanDerWaalsContact C-N 3.3Å; S495-I497 VanDerWaalsContact C-N 3.27Å; S495-I497 PolarHBondContact O-N 3Å; S495-R498 WeakPolarHBondContact O-CB 3.1Å; S495-R498 PolarHBondContact O-N 3.36Å; S495-K499 PolarHBondContact O-N 2.93Å; S495-K499 VanDerWaalsContact O-N 3.1Å
496	E	83.8	Confident	81.1	Confident	80 Å²	80	63 Å²	63	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-34.5	-174	-164.8	62.5	-153.3	0	0	112.9	G492 R498 K499 H500	G492-E496 PolarHBondContact O-N 2.84Å; E496-R498 PolarHBondContact O-N 2.94Å; E496-K499 WeakPolarHBondContact O-CB 3.5Å; E496-K499 IonicContact OE1-NZ 3.82Å; E496-K499 IonicContact OE2-NZ 3.25Å; E496-K499 PolarHBondContact OE2-NZ 3.32Å; E496-H500 PolarHBondContact O-CD2 3.03Å; E496-H500 IonicContact OE1-NE2 3.01Å
497	I	81.7	Confident	79.5	Confident	88 Å²	88	63.2 Å²	63.2	45%	0.451	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-41.9	175.5	-65.1	169.9	0	0	0	111.3	R493 S495	R493-I497 WeakPolarHBondContact O-CG1 3.31Å; S495-I497 VanDerWaalsContact C-N 3.27Å; S495-I497 PolarHBondContact O-N 3Å
498	R	86.5	Confident	77.5	Confident	15 Å²	15	67.2 Å²	67.2	6%	0.057	35%	0.35	C	S	.	.	H	α-helix	trans	-71.9	-41.4	-176.9	178.5	169.6	175.2	80.8	-2.4	111.7	L422 L424 D426 L494 S495 E496 H500 K501 I502	L422-R498 WeakPolarHBondContact O-CD 3.34Å; L424-R498 PolarHBondContact O-NH1 2.88Å; D426-R498 IonicContact OD1-CZ 2.7Å; D426-R498 IonicContact OD1-NH1 3.68Å; D426-R498 PolarHBondContact OD1-NH1 3.13Å; D426-R498 IonicContact OD1-NH2 3.84Å; D426-R498 PolarHBondContact OD1-NH2 2.92Å; D426-R498 IonicContact OD2-NH2 2.7Å; D426-R498 PolarHBondContact OD2-NH2 3.16Å; D426-R498 VanDerWaalsContact OD2-NH2 3.17Å; L494-R498 PolarHBondContact O-N 3.02Å; S495-R498 WeakPolarHBondContact O-CB 3.1Å; S495-R498 PolarHBondContact O-N 3.36Å; E496-R498 PolarHBondContact O-N 2.94Å; R498-H500 PolarHBondContact O-N 3.47Å; R498-K501 PolarHBondContact O-N 3.16Å; R498-I502 HydrophobicContact CG-CD1 3.63Å; R498-I502 HydrophobicContact CG-CG1 4.36Å; R498-I502 WeakPolarHBondContact O-CG1 3.41Å; R498-I502 PolarHBondContact O-N 2.9Å
499	K	83.8	Confident	76	Confident	72 Å²	72	66.5 Å²	66.5	31%	0.313	35%	0.348	S	S	.	.	H	α-helix	trans	-46.1	-55.6	174.7	-167	-175.6	-165.9	160.1	0	113.4	H442 E446 S495 E496 K501 I502 Q503	H442-K499 VanDerWaalsContact NE2-CB 3.34Å; H442-K499 WeakPolarHBondContact NE2-CB 3.3Å; H442-K499 PolarHBondContact NE2-N 2.84Å; E446-K499 WeakPolarHBondContact OE1-CD 3.47Å; E446-K499 WeakPolarHBondContact OE1-CE 3.49Å; E446-K499 IonicContact OE1-NZ 2.77Å; E446-K499 PolarHBondContact OE1-NZ 2.84Å; E446-K499 VanDerWaalsContact OE2-CE 3.25Å; E446-K499 WeakPolarHBondContact OE2-CE 3.48Å; E446-K499 IonicContact OE2-NZ 3.74Å; S495-K499 PolarHBondContact O-N 2.93Å; S495-K499 VanDerWaalsContact O-N 3.1Å; E496-K499 WeakPolarHBondContact O-CB 3.5Å; E496-K499 IonicContact OE1-NZ 3.82Å; E496-K499 IonicContact OE2-NZ 3.25Å; E496-K499 PolarHBondContact OE2-NZ 3.32Å; K499-K501 VanDerWaalsContact C-N 3.3Å; K499-K501 PolarHBondContact O-N 3.36Å; K499-I502 PolarHBondContact O-N 3.14Å; K499-Q503 PolarHBondContact O-N 3.27Å
500	H	74.6	Confident	74.5	Confident	137 Å²	137	64.2 Å²	64.2	63%	0.634	34%	0.335	S	S	*	.	H	α-helix	trans	-61.7	-35.8	-175.6	-78.7	-57.1	0	0	0	113	E496 R498	E496-H500 PolarHBondContact O-CD2 3.03Å; E496-H500 IonicContact OE1-NE2 3.01Å; R498-H500 PolarHBondContact O-N 3.47Å
501	K	74.8	Confident	72.9	Confident	84 Å²	84	69 Å²	69	37%	0.365	36%	0.356	S	S	.	.	H	α-helix	trans	-70.8	-42.7	179.7	-64.5	-165.5	-175.8	-169.8	0	112.4	E425 Y427 R498 K499	E425-K501 IonicContact OE1-NZ 3.8Å; E425-K501 PolarHBondContact OE1-NZ 3.19Å; Y427-K501 HydrophobicContact CD1-CB 4.4Å; Y427-K501 HydrophobicContact CD2-CB 4.32Å; Y427-K501 HydrophobicContact CE1-CB 4.11Å; Y427-K501 HydrophobicContact CE1-CD 3.8Å; Y427-K501 HydrophobicContact CE2-CB 4.06Å; Y427-K501 HydrophobicContact CE2-CD 3.83Å; Y427-K501 WeakPolarHBondContact OH-CD 3.28Å; Y427-K501 PolarHBondContact OH-NZ 3.44Å; R498-K501 PolarHBondContact O-N 3.16Å; K499-K501 VanDerWaalsContact C-N 3.3Å; K499-K501 PolarHBondContact O-N 3.36Å
502	I	71.6	Confident	71.5	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-76.8	-37.2	-171.8	-46.8	159.7	0	0	0	112.1	Y427 L435 L438 A439 H442 R498 K499 G504 I505 L506	Y427-I502 HydrophobicContact CD1-CG1 3.96Å; Y427-I502 HydrophobicContact CG-CG1 4.17Å; L435-I502 HydrophobicContact CD2-CG2 4.24Å; L435-I502 WeakPolarHBondContact O-CG2 3.27Å; L438-I502 HydrophobicContact CB-CD1 4.13Å; L438-I502 HydrophobicContact CB-CG1 4.43Å; L438-I502 HydrophobicContact CB-CG2 3.59Å; A439-I502 HydrophobicContact CB-CB 3.99Å; A439-I502 HydrophobicContact CB-CG2 3.71Å; H442-I502 HydrophobicContact CB-CD1 3.94Å; R498-I502 HydrophobicContact CG-CD1 3.63Å; R498-I502 HydrophobicContact CG-CG1 4.36Å; R498-I502 WeakPolarHBondContact O-CG1 3.41Å; R498-I502 PolarHBondContact O-N 2.9Å; K499-I502 PolarHBondContact O-N 3.14Å; I502-G504 PolarHBondContact O-N 3.26Å; I502-I505 PolarHBondContact O-N 3.11Å; I502-L506 HydrophobicContact CG2-CD1 4.01Å
503	Q	68.9	Low	70.2	Confident	117 Å²	117	69.5 Å²	69.5	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-57.1	-26.1	-177.8	-174.3	59.2	54.6	0	0	113.6	K499 I505 L506	K499-Q503 PolarHBondContact O-N 3.27Å; Q503-I505 PolarHBondContact O-N 2.6Å; Q503-L506 WeakPolarHBondContact O-CB 3.19Å; Q503-L506 PolarHBondContact O-N 3.26Å
504	G	58.7	Low	69.1	Low	71 Å²	71	69.2 Å²	69.2	73%	0.732	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-26.8	-178.5	0	0	0	0	0	115.3	I502	I502-G504 PolarHBondContact O-N 3.26Å
505	I	62.5	Low	68	Low	86 Å²	86	71.4 Å²	71.4	44%	0.441	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	13.1	-176.7	-25.7	174.6	0	0	0	111	L435 I502 Q503	L435-I505 HydrophobicContact CD1-CB 3.56Å; L435-I505 HydrophobicContact CD1-CD1 4.43Å; L435-I505 HydrophobicContact CD1-CG2 3.35Å; L435-I505 HydrophobicContact CD2-CB 3.8Å; L435-I505 HydrophobicContact CD2-CD1 3.78Å; L435-I505 HydrophobicContact CD2-CG1 4.16Å; L435-I505 HydrophobicContact CD2-CG2 4.46Å; L435-I505 HydrophobicContact CG-CB 4.15Å; L435-I505 HydrophobicContact CG-CG2 4.44Å; I502-I505 PolarHBondContact O-N 3.11Å; Q503-I505 PolarHBondContact O-N 2.6Å
506	L	57.9	Low	67.4	Low	9 Å²	9	71.5 Å²	71.5	5%	0.047	37%	0.367	C	S	.	.			trans	-93.3	-12.5	-157.4	-149.7	81.5	0	0	0	115.1	L435 R436 A439 I502 Q503	L435-L506 VanDerWaalsContact C-CD1 3.5Å; L435-L506 HydrophobicContact CB-CD1 4.43Å; L435-L506 WeakPolarHBondContact O-CD1 3.5Å; R436-L506 HydrophobicContact CB-CD1 4.4Å; R436-L506 HydrophobicContact CG-CD1 3.6Å; R436-L506 HydrophobicContact CG-CD2 3.8Å; R436-L506 HydrophobicContact CG-CG 3.35Å; R436-L506 PolarHBondContact NE-O 3.46Å; R436-L506 PolarHBondContact NH1-O 2.7Å; R436-L506 PolarHBondContact NH2-O 2.92Å; A439-L506 HydrophobicContact CB-CD1 3.28Å; A439-L506 HydrophobicContact CB-CD2 3.7Å; A439-L506 HydrophobicContact CB-CG 4.11Å; I502-L506 HydrophobicContact CG2-CD1 4.01Å; Q503-L506 WeakPolarHBondContact O-CB 3.19Å; Q503-L506 PolarHBondContact O-N 3.26Å
507	D	59.3	Low	66.8	Low	113 Å²	113	69.2 Å²	69.2	60%	0.604	36%	0.357	S	S	*	.	S	Bend	trans	-76.5	-54.1	-164.9	-145.1	-19.7	0	0	0	114.1	R436 L509 N510	R436-D507 PolarHBondContact NH1-O 2.88Å; R436-D507 IonicContact NH2-OD1 3.66Å; D507-L509 PolarHBondContact O-N 2.67Å; D507-N510 VanDerWaalsContact O-CB 3.22Å; D507-N510 WeakPolarHBondContact O-CB 3.37Å; D507-N510 PolarHBondContact O-N 3.01Å; D507-N510 VanDerWaalsContact O-N 3.11Å; D507-N510 PolarHBondContact OD1-ND2 3.36Å
508	L	49.9	Very low	66.5	Low	151 Å²	151	67 Å²	67	79%	0.791	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-10.7	-163	-175	68.6	0	0	0	116.4	L432	L432-L508 HydrophobicContact CD1-CB 3.58Å; L432-L508 HydrophobicContact CD1-CD2 3.99Å; L432-L508 HydrophobicContact CD1-CG 3.78Å; L432-L508 HydrophobicContact CD2-CG 4.39Å
509	L	59.9	Low	66	Low	11 Å²	11	66.5 Å²	66.5	6%	0.058	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.9	172	-86.2	129.7	0	0	0	117.7	L432 L435 R436 D507 Q511 I512 D513	L432-L509 VanDerWaalsContact C-CG 3.45Å; L432-L509 HydrophobicContact CB-CD2 4.37Å; L432-L509 HydrophobicContact CB-CG 4.27Å; L432-L509 HydrophobicContact CD1-CD1 4.17Å; L432-L509 HydrophobicContact CD1-CG 3.82Å; L432-L509 HydrophobicContact CG-CD1 4.48Å; L432-L509 HydrophobicContact CG-CD2 4.15Å; L432-L509 HydrophobicContact CG-CG 3.71Å; L432-L509 WeakPolarHBondContact O-CD1 3.44Å; L432-L509 WeakPolarHBondContact O-CD2 3.46Å; L432-L509 WeakPolarHBondContact O-CG 3.2Å; L435-L509 HydrophobicContact CB-CD1 4.03Å; R436-L509 HydrophobicContact CB-CB 4.28Å; R436-L509 HydrophobicContact CB-CD1 3.72Å; R436-L509 HydrophobicContact CB-CD2 4.02Å; R436-L509 HydrophobicContact CB-CG 4.12Å; R436-L509 HydrophobicContact CG-CB 4.08Å; R436-L509 HydrophobicContact CG-CD1 3.64Å; R436-L509 HydrophobicContact CG-CG 4.26Å; D507-L509 PolarHBondContact O-N 2.67Å; L509-Q511 PolarHBondContact O-N 3.05Å; L509-I512 PolarHBondContact O-N 3.11Å; L509-D513 WeakPolarHBondContact O-CB 3.27Å; L509-D513 PolarHBondContact O-N 2.9Å
510	N	59.4	Low	65.5	Low	61 Å²	61	63.4 Å²	63.4	33%	0.326	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	13.5	-140.4	-130.3	-18.2	0	0	0	117.1	R436 D507 D513 Q514	R436-N510 VanDerWaalsContact NH1-CA 3.33Å; R436-N510 VanDerWaalsContact NH1-CB 3.33Å; R436-N510 PolarHBondContact NH1-ND2 3.22Å; R436-N510 PolarHBondContact NH1-OD1 3.49Å; R436-N510 VanDerWaalsContact NH2-CG 3.27Å; R436-N510 PolarHBondContact NH2-ND2 3.35Å; R436-N510 PolarHBondContact NH2-OD1 3.17Å; D507-N510 VanDerWaalsContact O-CB 3.22Å; D507-N510 WeakPolarHBondContact O-CB 3.37Å; D507-N510 PolarHBondContact O-N 3.01Å; D507-N510 VanDerWaalsContact O-N 3.11Å; D507-N510 PolarHBondContact OD1-ND2 3.36Å; N510-D513 VanDerWaalsContact C-CB 3.45Å; N510-Q514 WeakPolarHBondContact O-CG 3.42Å
511	Q	55.4	Low	65.7	Low	163 Å²	163	63.4 Å²	63.4	76%	0.762	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-45.8	-172	-165	174.6	19	0	0	113.1	L509 Q514	L509-Q511 PolarHBondContact O-N 3.05Å; Q511-Q514 PolarHBondContact O-N 3.03Å; Q511-Q514 VanDerWaalsContact O-N 3.14Å
512	I	60.4	Low	66.2	Low	35 Å²	35	62 Å²	62	18%	0.179	33%	0.326	C	S	.	.	H	α-helix	trans	-68.7	-28.3	163.7	-65.3	169.1	0	0	0	109.7	L509 H516 L589 L593	L509-I512 PolarHBondContact O-N 3.11Å; I512-H516 PolarHBondContact O-N 3.15Å; I512-H516 PolarHBondContact O-ND1 3.41Å; I512-H516 VanDerWaalsContact O-ND1 3.12Å; I512-L589 HydrophobicContact CD1-CD1 3.18Å; I512-L593 HydrophobicContact CG2-CD2 4.16Å
513	D	60.9	Low	66.8	Low	6 Å²	6	62.1 Å²	62.1	3%	0.032	33%	0.326	C	S	.	.	H	α-helix	trans	-43.1	-65	156.7	177.7	112.7	0	0	0	112.3	R436 L509 N510 L515 H516 L517 Y598	R436-D513 WeakPolarHBondContact CD-OD1 3.26Å; R436-D513 IonicContact CZ-OD1 2.8Å; R436-D513 IonicContact NE-OD1 3.54Å; R436-D513 PolarHBondContact NE-OD1 3.39Å; R436-D513 IonicContact NH1-OD1 2.7Å; L509-D513 WeakPolarHBondContact O-CB 3.27Å; L509-D513 PolarHBondContact O-N 2.9Å; N510-D513 VanDerWaalsContact C-CB 3.45Å; D513-L515 PolarHBondContact O-N 3.07Å; D513-H516 CarbonylContact O-C 3.41Å; D513-H516 PolarHBondContact O-N 2.95Å; D513-L517 WeakPolarHBondContact O-CB 3.47Å; D513-L517 PolarHBondContact O-N 2.78Å; D513-L517 WeakPolarHBondContact OD2-CD2 3.46Å; D513-Y598 VanDerWaalsContact CA-CZ 3.47Å; D513-Y598 VanDerWaalsContact CA-OH 3.27Å; D513-Y598 WeakPolarHBondContact CA-OH 3.48Å; D513-Y598 HydrophobicContact CB-CE1 4.19Å; D513-Y598 HydrophobicContact CB-CE2 4.37Å; D513-Y598 WeakPolarHBondContact CB-OH 3.21Å; D513-Y598 WeakPolarHBondContact OD1-CE1 3.4Å; D513-Y598 VanDerWaalsContact OD1-CZ 3.23Å; D513-Y598 PolarHBondContact OD1-OH 3.36Å; D513-Y598 VanDerWaalsContact OD1-OH 3.12Å
514	Q	66.9	Low	67.2	Low	127 Å²	127	59 Å²	59	59%	0.593	32%	0.32	S	S	*	.	H	α-helix	trans	-56.2	-33.3	-162.9	-60.9	-138.6	-25.5	0	0	115.5	N510 Q511 S518	N510-Q514 WeakPolarHBondContact O-CG 3.42Å; Q511-Q514 PolarHBondContact O-N 3.03Å; Q511-Q514 VanDerWaalsContact O-N 3.14Å; Q514-S518 PolarHBondContact O-N 2.68Å
515	L	64.4	Low	68.5	Low	71 Å²	71	59.2 Å²	59.2	37%	0.372	31%	0.309	S	S	.	.	H	α-helix	trans	-84.3	-39.4	179.4	-73.8	165.5	0	0	0	112.7	D513 L517 S518 I519 V580 L583	D513-L515 PolarHBondContact O-N 3.07Å; L515-L517 PolarHBondContact O-N 3.3Å; L515-S518 WeakPolarHBondContact O-CB 3.22Å; L515-S518 PolarHBondContact O-N 2.64Å; L515-I519 PolarHBondContact O-N 2.92Å; L515-I519 VanDerWaalsContact O-N 3.14Å; L515-V580 HydrophobicContact CB-CG2 3.8Å; L515-L583 HydrophobicContact CD1-CD1 3.2Å
516	H	73.5	Confident	69.7	Low	4 Å²	4	55.8 Å²	55.8	2%	0.019	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-32.1	168.6	-74.9	136.9	0	0	0	112.4	I512 D513 I519 A520 V580 L593 N596 P597 Y598	I512-H516 PolarHBondContact O-N 3.15Å; I512-H516 PolarHBondContact O-ND1 3.41Å; I512-H516 VanDerWaalsContact O-ND1 3.12Å; D513-H516 CarbonylContact O-C 3.41Å; D513-H516 PolarHBondContact O-N 2.95Å; H516-I519 PolarHBondContact O-N 2.89Å; H516-A520 WeakPolarHBondContact O-CB 3.44Å; H516-A520 PolarHBondContact O-N 3.02Å; H516-V580 VanDerWaalsContact CD2-CG1 3.47Å; H516-V580 WeakPolarHBondContact CD2-CG1 3.34Å; H516-V580 VanDerWaalsContact CE1-CG1 3.41Å; H516-V580 WeakPolarHBondContact CE1-CG1 3.49Å; H516-V580 WeakPolarHBondContact NE2-CG1 3.37Å; H516-L593 PolarHBondContact CE1-O 2.9Å; H516-L593 PolarHBondContact NE2-O 2.74Å; H516-N596 WeakPolarHBondContact CB-OD1 3.39Å; H516-N596 VanDerWaalsContact CD2-CG 3.44Å; H516-N596 PolarHBondContact O-ND2 2.93Å; H516-N596 VanDerWaalsContact O-ND2 3.09Å; H516-P597 WeakPolarHBondContact ND1-CD 3.43Å; H516-Y598 HydrophobicContact CB-CD2 3.24Å; H516-Y598 HydrophobicContact CB-CE2 3.58Å; H516-Y598 HydrophobicContact CB-CG 4.3Å
517	L	71.1	Confident	71	Confident	32 Å²	32	55.6 Å²	55.6	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-35.6	171.9	178.7	73.9	0	0	0	110.9	D513 L515 K521 Y598	D513-L517 WeakPolarHBondContact O-CB 3.47Å; D513-L517 PolarHBondContact O-N 2.78Å; D513-L517 WeakPolarHBondContact OD2-CD2 3.46Å; L515-L517 PolarHBondContact O-N 3.3Å; L517-K521 HydrophobicContact CG-CD 4.14Å; L517-K521 HydrophobicContact CG-CG 4.48Å; L517-K521 WeakPolarHBondContact O-CB 3.37Å; L517-K521 WeakPolarHBondContact O-CD 3.43Å; L517-K521 WeakPolarHBondContact O-CG 3.43Å; L517-K521 PolarHBondContact O-N 3.46Å; L517-Y598 HydrophobicContact CB-CD1 4.37Å; L517-Y598 HydrophobicContact CB-CG 4.49Å; L517-Y598 HydrophobicContact CD1-CD1 4.21Å
518	S	75.4	Confident	72.1	Confident	42 Å²	42	54.6 Å²	54.6	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-54.7	168.9	-177	0	0	0	0	110.5	Q514 L515 A520 K521 R522 E576	Q514-S518 PolarHBondContact O-N 2.68Å; L515-S518 WeakPolarHBondContact O-CB 3.22Å; L515-S518 PolarHBondContact O-N 2.64Å; S518-A520 PolarHBondContact O-N 3.21Å; S518-K521 WeakPolarHBondContact O-CB 3.45Å; S518-K521 PolarHBondContact O-N 3.34Å; S518-K521 VanDerWaalsContact O-N 3.15Å; S518-R522 PolarHBondContact O-N 2.94Å; S518-R522 VanDerWaalsContact O-N 3.14Å; S518-E576 PolarHBondContact OG-OE2 3.32Å
519	I	77	Confident	74	Confident	5 Å²	5	51 Å²	51	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-56.7	-49.5	178	-65.8	157.4	0	0	0	110.3	L515 H516 K521 R522 I523 E576 A577 V580	L515-I519 PolarHBondContact O-N 2.92Å; L515-I519 VanDerWaalsContact O-N 3.14Å; H516-I519 PolarHBondContact O-N 2.89Å; I519-K521 VanDerWaalsContact C-N 3.35Å; I519-K521 PolarHBondContact O-N 3.33Å; I519-R522 PolarHBondContact O-N 3.35Å; I519-I523 HydrophobicContact CG2-CD1 3.56Å; I519-I523 HydrophobicContact CG2-CG1 4.02Å; I519-I523 WeakPolarHBondContact O-CG1 3.43Å; I519-I523 PolarHBondContact O-N 3.43Å; I519-E576 HydrophobicContact CD1-CB 4.25Å; I519-E576 HydrophobicContact CG1-CB 3.61Å; I519-A577 HydrophobicContact CD1-CB 4.48Å; I519-V580 HydrophobicContact CD1-CB 4.47Å; I519-V580 HydrophobicContact CD1-CG2 3.58Å
520	A	72.7	Confident	75.3	Confident	6 Å²	6	50.7 Å²	50.7	5%	0.05	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-33.8	179.7	0	0	0	0	0	113.6	H516 S518 R522 I523 A524 Y598	H516-A520 WeakPolarHBondContact O-CB 3.44Å; H516-A520 PolarHBondContact O-N 3.02Å; S518-A520 PolarHBondContact O-N 3.21Å; A520-R522 PolarHBondContact O-N 3.04Å; A520-I523 PolarHBondContact O-N 2.71Å; A520-A524 VanDerWaalsContact O-CB 3.31Å; A520-A524 WeakPolarHBondContact O-CB 3.28Å; A520-A524 PolarHBondContact O-N 2.93Å; A520-Y598 VanDerWaalsContact CB-O 3.27Å; A520-Y598 WeakPolarHBondContact CB-O 3.49Å
521	K	80.1	Confident	76.5	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	26%	0.261	S	S	*	.	H	α-helix	trans	-64.7	-23.3	171.7	-81.3	169.8	177	173.4	0	113.3	L517 S518 I519 P525	L517-K521 HydrophobicContact CG-CD 4.14Å; L517-K521 HydrophobicContact CG-CG 4.48Å; L517-K521 WeakPolarHBondContact O-CB 3.37Å; L517-K521 WeakPolarHBondContact O-CD 3.43Å; L517-K521 WeakPolarHBondContact O-CG 3.43Å; L517-K521 PolarHBondContact O-N 3.46Å; S518-K521 WeakPolarHBondContact O-CB 3.45Å; S518-K521 PolarHBondContact O-N 3.34Å; S518-K521 VanDerWaalsContact O-N 3.15Å; I519-K521 VanDerWaalsContact C-N 3.35Å; I519-K521 PolarHBondContact O-N 3.33Å; K521-P525 WeakPolarHBondContact O-CD 3.43Å; K521-P525 WeakPolarHBondContact O-CG 3.5Å
522	R	84	Confident	77.9	Confident	53 Å²	53	48.5 Å²	48.5	20%	0.2	25%	0.247	C	C	.	.	H	α-helix	trans	-89.5	-43.1	171.4	-61.5	-177.3	71.9	173.9	5.1	111.9	S518 I519 A520 A524 P525 F526 E569 D572 I573 E576	S518-R522 PolarHBondContact O-N 2.94Å; S518-R522 VanDerWaalsContact O-N 3.14Å; I519-R522 PolarHBondContact O-N 3.35Å; A520-R522 PolarHBondContact O-N 3.04Å; R522-A524 PolarHBondContact O-N 2.89Å; R522-P525 WeakPolarHBondContact O-CD 3.48Å; R522-P525 WeakPolarHBondContact O-CG 3.26Å; R522-F526 WeakPolarHBondContact O-CB 3.24Å; R522-F526 PolarHBondContact O-N 2.88Å; R522-F526 VanDerWaalsContact O-N 3.09Å; R522-E569 IonicContact CZ-OE1 3.8Å; R522-E569 VanDerWaalsContact CZ-OE1 3.25Å; R522-E569 IonicContact CZ-OE2 3.24Å; R522-E569 IonicContact NE-OE1 2.69Å; R522-E569 PolarHBondContact NE-OE1 3.03Å; R522-E569 IonicContact NH2-OE1 2.95Å; R522-E569 PolarHBondContact NH2-OE1 2.69Å; R522-E569 IonicContact NH2-OE2 3.18Å; R522-E569 PolarHBondContact NH2-OE2 2.82Å; R522-D572 IonicContact NH2-OD2 3.03Å; R522-I573 HydrophobicContact CB-CD1 3.96Å; R522-I573 HydrophobicContact CB-CG1 3.76Å; R522-E576 VanDerWaalsContact CD-OE1 3.23Å; R522-E576 WeakPolarHBondContact CD-OE1 3.49Å; R522-E576 IonicContact CZ-OE1 3.92Å; R522-E576 IonicContact NE-OE1 2.66Å; R522-E576 IonicContact NH1-OE1 3.94Å; R522-E576 PolarHBondContact NH1-OE1 2.88Å
523	I	84.6	Confident	79.3	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-42	178.9	-68.3	-171.3	0	0	0	111.9	I519 A520 F526 N527 I573 T599 I601 L606	I519-I523 HydrophobicContact CG2-CD1 3.56Å; I519-I523 HydrophobicContact CG2-CG1 4.02Å; I519-I523 WeakPolarHBondContact O-CG1 3.43Å; I519-I523 PolarHBondContact O-N 3.43Å; A520-I523 PolarHBondContact O-N 2.71Å; I523-F526 PolarHBondContact O-N 2.94Å; I523-N527 WeakPolarHBondContact O-CA 3.41Å; I523-N527 WeakPolarHBondContact O-CB 3.39Å; I523-N527 PolarHBondContact O-N 3.18Å; I523-I573 HydrophobicContact CD1-CG2 3.86Å; I523-I573 HydrophobicContact CG1-CD1 4.42Å; I523-I573 HydrophobicContact CG1-CG2 3.57Å; I523-T599 HydrophobicContact CD1-CG2 4.17Å; I523-T599 WeakPolarHBondContact CG2-OG1 3.39Å; I523-I601 HydrophobicContact CG2-CB 4.1Å; I523-I601 HydrophobicContact CG2-CG2 4.47Å; I523-L606 HydrophobicContact CB-CD1 4.36Å; I523-L606 HydrophobicContact CD1-CD1 3.87Å; I523-L606 HydrophobicContact CG1-CD1 3.73Å; I523-L606 HydrophobicContact CG2-CD1 4.05Å; I523-L606 HydrophobicContact CG2-CD2 4.43Å
524	A	77.7	Confident	80.6	Confident	51 Å²	51	49.8 Å²	49.8	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-59.2	-57.2	-179.5	0	0	0	0	0	113.4	A520 R522 F526 N527 N528	A520-A524 VanDerWaalsContact O-CB 3.31Å; A520-A524 WeakPolarHBondContact O-CB 3.28Å; A520-A524 PolarHBondContact O-N 2.93Å; R522-A524 PolarHBondContact O-N 2.89Å; A524-F526 PolarHBondContact O-N 3.36Å; A524-N527 PolarHBondContact O-N 2.94Å; A524-N528 WeakPolarHBondContact O-CB 3.29Å; A524-N528 PolarHBondContact O-N 2.97Å; A524-N528 PolarHBondContact O-OD1 3.36Å
525	P	85	Confident	81.4	Confident	77 Å²	77	47.7 Å²	47.7	50%	0.5	24%	0.243	S	C	.	.	H	α-helix	trans	-67	-35.1	177.4	27	-34.9	0	0	0	112.8	K521 R522 N528 W529	K521-P525 WeakPolarHBondContact O-CD 3.43Å; K521-P525 WeakPolarHBondContact O-CG 3.5Å; R522-P525 WeakPolarHBondContact O-CD 3.48Å; R522-P525 WeakPolarHBondContact O-CG 3.26Å; P525-N528 PolarHBondContact O-N 3.11Å; P525-W529 VanDerWaalsContact O-CB 3.28Å; P525-W529 WeakPolarHBondContact O-CB 3.29Å; P525-W529 PolarHBondContact O-N 2.91Å
526	F	88	Confident	82.4	Confident	13 Å²	13	48.3 Å²	48.3	6%	0.057	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-37.5	178.2	-171.7	-104.2	0	0	0	112.5	R522 I523 A524 W529 L530 A566 E569 L570 I573 L606 W610	R522-F526 WeakPolarHBondContact O-CB 3.24Å; R522-F526 PolarHBondContact O-N 2.88Å; R522-F526 VanDerWaalsContact O-N 3.09Å; I523-F526 PolarHBondContact O-N 2.94Å; A524-F526 PolarHBondContact O-N 3.36Å; F526-W529 HydrophobicContact CD2-CE3 4.27Å; F526-W529 AromaticContact CE2-CE3 3.97Å; F526-W529 HydrophobicContact CE2-CE3 3.97Å; F526-W529 HydrophobicContact CE2-CZ3 4.07Å; F526-W529 HydrophobicContact CZ-CE3 4.44Å; F526-W529 HydrophobicContact CZ-CZ3 4.31Å; F526-W529 PolarHBondContact O-N 3.48Å; F526-L530 HydrophobicContact CD1-CD1 4.05Å; F526-L530 HydrophobicContact CE1-CD1 3.66Å; F526-L530 HydrophobicContact CE1-CG 4.16Å; F526-L530 HydrophobicContact CZ-CD1 4.41Å; F526-L530 HydrophobicContact CZ-CG 4.5Å; F526-L530 PolarHBondContact O-N 3.29Å; F526-A566 HydrophobicContact CE2-CB 4.12Å; F526-A566 WeakPolarHBondContact CE2-O 3.39Å; F526-A566 WeakPolarHBondContact CZ-O 3.29Å; F526-E569 HydrophobicContact CD2-CB 4.02Å; F526-E569 HydrophobicContact CD2-CG 3.6Å; F526-E569 HydrophobicContact CE2-CB 3.92Å; F526-E569 HydrophobicContact CE2-CG 4.03Å; F526-E569 HydrophobicContact CG-CG 4.21Å; F526-L570 HydrophobicContact CE1-CB 3.94Å; F526-L570 HydrophobicContact CE1-CD1 4.04Å; F526-L570 HydrophobicContact CE1-CG 4.47Å; F526-L570 HydrophobicContact CZ-CB 3.83Å; F526-I573 HydrophobicContact CB-CD1 3.91Å; F526-I573 HydrophobicContact CD1-CD1 4.06Å; F526-I573 HydrophobicContact CG-CD1 3.99Å; F526-L606 HydrophobicContact CD1-CD2 4.22Å; F526-W610 AromaticContact CZ-CE3 3.96Å; F526-W610 HydrophobicContact CZ-CE3 3.96Å; F526-W610 HydrophobicContact CZ-CZ3 4.11Å
527	N	85.7	Confident	83.2	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-45.1	173.6	-177	76.5	0	0	0	111.9	I523 A524 W529 L530 E531 I601 L606 R609	I523-N527 WeakPolarHBondContact O-CA 3.41Å; I523-N527 WeakPolarHBondContact O-CB 3.39Å; I523-N527 PolarHBondContact O-N 3.18Å; A524-N527 PolarHBondContact O-N 2.94Å; N527-W529 PolarHBondContact O-N 2.97Å; N527-L530 WeakPolarHBondContact O-CB 3.2Å; N527-L530 PolarHBondContact O-N 2.91Å; N527-L530 VanDerWaalsContact O-N 3.08Å; N527-E531 VanDerWaalsContact ND2-CD 3.3Å; N527-E531 PolarHBondContact ND2-OE1 3.47Å; N527-E531 PolarHBondContact O-N 2.89Å; N527-I601 HydrophobicContact CB-CD1 3.87Å; N527-I601 WeakPolarHBondContact ND2-CD1 3.42Å; N527-I601 WeakPolarHBondContact OD1-CD1 3.48Å; N527-L606 HydrophobicContact CB-CD2 4.03Å; N527-R609 VanDerWaalsContact CG-NH1 3.33Å; N527-R609 PolarHBondContact ND2-NH1 3.21Å; N527-R609 PolarHBondContact OD1-NH1 2.76Å
528	N	82.2	Confident	84	Confident	93 Å²	93	52.6 Å²	52.6	50%	0.497	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-36.2	176.1	-69.2	7.2	0	0	0	110.7	A524 P525 Q532	A524-N528 WeakPolarHBondContact O-CB 3.29Å; A524-N528 PolarHBondContact O-N 2.97Å; A524-N528 PolarHBondContact O-OD1 3.36Å; P525-N528 PolarHBondContact O-N 3.11Å; N528-Q532 WeakPolarHBondContact O-CB 3.44Å; N528-Q532 PolarHBondContact O-N 3Å
529	W	89.1	Confident	84.4	Confident	76 Å²	76	54.4 Å²	54.4	29%	0.288	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-43.4	171.3	177.3	82.3	0	0	0	112.1	P525 F526 N527 Q532 V533 F559 L563 A566 W610	P525-W529 VanDerWaalsContact O-CB 3.28Å; P525-W529 WeakPolarHBondContact O-CB 3.29Å; P525-W529 PolarHBondContact O-N 2.91Å; F526-W529 HydrophobicContact CD2-CE3 4.27Å; F526-W529 AromaticContact CE2-CE3 3.97Å; F526-W529 HydrophobicContact CE2-CE3 3.97Å; F526-W529 HydrophobicContact CE2-CZ3 4.07Å; F526-W529 HydrophobicContact CZ-CE3 4.44Å; F526-W529 HydrophobicContact CZ-CZ3 4.31Å; F526-W529 PolarHBondContact O-N 3.48Å; N527-W529 PolarHBondContact O-N 2.97Å; W529-Q532 PolarHBondContact O-N 3.48Å; W529-V533 HydrophobicContact CD2-CG2 4.09Å; W529-V533 HydrophobicContact CG-CG2 4.43Å; W529-V533 HydrophobicContact CH2-CG2 4.44Å; W529-V533 HydrophobicContact CZ2-CG2 3.86Å; W529-V533 VanDerWaalsContact O-CB 3.3Å; W529-V533 WeakPolarHBondContact O-CB 3.34Å; W529-V533 WeakPolarHBondContact O-CG2 3.43Å; W529-V533 PolarHBondContact O-N 3.44Å; W529-F559 HydrophobicContact CZ2-CE2 4.25Å; W529-L563 HydrophobicContact CH2-CD2 4.47Å; W529-A566 HydrophobicContact CE3-CB 4.4Å; W529-A566 HydrophobicContact CH2-CB 3.26Å; W529-A566 HydrophobicContact CZ2-CB 3.85Å; W529-A566 HydrophobicContact CZ3-CB 3.59Å; W529-W610 HydrophobicContact CH2-CZ3 4.14Å; W529-W610 HydrophobicContact CZ3-CE3 4.44Å; W529-W610 AromaticContact CZ3-CZ3 3.9Å; W529-W610 HydrophobicContact CZ3-CZ3 3.9Å
530	L	88.4	Confident	84.8	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-43	174.5	-84.1	174.4	0	0	0	112.9	F526 N527 H534 L606 R609 W610 M613	F526-L530 HydrophobicContact CD1-CD1 4.05Å; F526-L530 HydrophobicContact CE1-CD1 3.66Å; F526-L530 HydrophobicContact CE1-CG 4.16Å; F526-L530 HydrophobicContact CZ-CD1 4.41Å; F526-L530 HydrophobicContact CZ-CG 4.5Å; F526-L530 PolarHBondContact O-N 3.29Å; N527-L530 WeakPolarHBondContact O-CB 3.2Å; N527-L530 PolarHBondContact O-N 2.91Å; N527-L530 VanDerWaalsContact O-N 3.08Å; L530-H534 VanDerWaalsContact O-CB 3.24Å; L530-H534 WeakPolarHBondContact O-CB 3.33Å; L530-H534 PolarHBondContact O-N 2.97Å; L530-L606 HydrophobicContact CD1-CD2 4.1Å; L530-R609 HydrophobicContact CD1-CB 4.17Å; L530-W610 HydrophobicContact CD2-CB 4.44Å; L530-W610 HydrophobicContact CD2-CE3 3.99Å; L530-M613 HydrophobicContact CD2-CB 4.18Å; L530-M613 HydrophobicContact CD2-CE 3.77Å; L530-M613 HydrophobicContact CD2-CG 4.25Å
531	E	84	Confident	85.4	Confident	78 Å²	78	60.9 Å²	60.9	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-67.3	-45.2	176.7	-73.2	177.5	-170.8	0	0	111.4	N527 V533 H534 E535 R609	N527-E531 VanDerWaalsContact ND2-CD 3.3Å; N527-E531 PolarHBondContact ND2-OE1 3.47Å; N527-E531 PolarHBondContact O-N 2.89Å; E531-V533 PolarHBondContact O-N 3.49Å; E531-H534 WeakPolarHBondContact O-CB 3.47Å; E531-H534 PolarHBondContact O-N 3.13Å; E531-E535 PolarHBondContact O-N 3.15Å; E531-R609 IonicContact OE1-CZ 3.73Å; E531-R609 IonicContact OE1-NH1 2.76Å; E531-R609 PolarHBondContact OE1-NH1 3.25Å; E531-R609 IonicContact OE1-NH2 2.72Å
532	Q	85.4	Confident	85.5	Confident	100 Å²	100	59.9 Å²	59.9	47%	0.467	30%	0.302	S	S	.	.	H	α-helix	trans	-60	-46.5	175.6	-176.4	63.8	56.3	0	0	111.5	N528 W529 H534 E535 D536	N528-Q532 WeakPolarHBondContact O-CB 3.44Å; N528-Q532 PolarHBondContact O-N 3Å; W529-Q532 PolarHBondContact O-N 3.48Å; Q532-H534 VanDerWaalsContact C-N 3.32Å; Q532-H534 PolarHBondContact O-N 2.86Å; Q532-E535 PolarHBondContact O-N 2.97Å; Q532-D536 PolarHBondContact NE2-OD1 2.82Å; Q532-D536 WeakPolarHBondContact O-CB 3.19Å; Q532-D536 PolarHBondContact O-N 3.29Å
533	V	89	Confident	85.5	Confident	6 Å²	6	58 Å²	58	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-38.9	177	168.4	0	0	0	0	111.1	W529 E531 D536 L537 F559 M613	W529-V533 HydrophobicContact CD2-CG2 4.09Å; W529-V533 HydrophobicContact CG-CG2 4.43Å; W529-V533 HydrophobicContact CH2-CG2 4.44Å; W529-V533 HydrophobicContact CZ2-CG2 3.86Å; W529-V533 VanDerWaalsContact O-CB 3.3Å; W529-V533 WeakPolarHBondContact O-CB 3.34Å; W529-V533 WeakPolarHBondContact O-CG2 3.43Å; W529-V533 PolarHBondContact O-N 3.44Å; E531-V533 PolarHBondContact O-N 3.49Å; V533-D536 PolarHBondContact O-N 2.64Å; V533-L537 HydrophobicContact CG1-CD1 3.9Å; V533-L537 HydrophobicContact CG1-CG 4.28Å; V533-L537 WeakPolarHBondContact O-CB 3.38Å; V533-L537 WeakPolarHBondContact O-CG 3.5Å; V533-L537 PolarHBondContact O-N 3.19Å; V533-F559 HydrophobicContact CB-CE2 4.31Å; V533-F559 HydrophobicContact CG1-CE1 4.4Å; V533-F559 HydrophobicContact CG1-CE2 3.47Å; V533-F559 VanDerWaalsContact CG1-CE2 3.47Å; V533-F559 HydrophobicContact CG1-CZ 3.32Å; V533-F559 HydrophobicContact CG2-CE2 3.76Å; V533-F559 HydrophobicContact CG2-CZ 4.47Å; V533-M613 HydrophobicContact CB-CG 4.32Å; V533-M613 HydrophobicContact CG1-CG 3.53Å; V533-M613 HydrophobicContact CG1-SD 3.82Å
534	H	87.8	Confident	85.3	Confident	61 Å²	61	64.1 Å²	64.1	28%	0.282	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-38.9	174.4	-175.1	-64.4	0	0	0	111.7	L530 E531 Q532 Q538	L530-H534 VanDerWaalsContact O-CB 3.24Å; L530-H534 WeakPolarHBondContact O-CB 3.33Å; L530-H534 PolarHBondContact O-N 2.97Å; E531-H534 WeakPolarHBondContact O-CB 3.47Å; E531-H534 PolarHBondContact O-N 3.13Å; Q532-H534 VanDerWaalsContact C-N 3.32Å; Q532-H534 PolarHBondContact O-N 2.86Å; H534-Q538 VanDerWaalsContact CE1-CD 3.44Å; H534-Q538 PolarHBondContact CE1-NE2 3.01Å; H534-Q538 PolarHBondContact CE1-OE1 2.96Å; H534-Q538 PolarHBondContact ND1-OE1 2.8Å; H534-Q538 VanDerWaalsContact O-CG 3.3Å; H534-Q538 WeakPolarHBondContact O-CG 3.4Å; H534-Q538 PolarHBondContact O-N 3.1Å
535	E	84.3	Confident	85.7	Confident	84 Å²	84	67.8 Å²	67.8	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-65.3	-47.7	171	-71.3	-161.2	174.2	0	0	111.9	R455 E531 Q532 L537 Q538 D539	R455-E535 IonicContact CZ-OE1 3.95Å; R455-E535 IonicContact NH2-OE1 2.67Å; R455-E535 PolarHBondContact NH2-OE1 3.11Å; E531-E535 PolarHBondContact O-N 3.15Å; Q532-E535 PolarHBondContact O-N 2.97Å; E535-L537 VanDerWaalsContact C-N 3.35Å; E535-L537 PolarHBondContact O-N 3.36Å; E535-Q538 CarbonylContact O-C 3.59Å; E535-Q538 WeakPolarHBondContact O-CA 3.25Å; E535-Q538 PolarHBondContact O-N 3.04Å; E535-D539 PolarHBondContact O-N 3.02Å
536	D	86.4	Confident	85.9	Confident	83 Å²	83	65.3 Å²	65.3	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-38.9	-178.1	-68.4	-17.5	0	0	0	112.4	Q532 V533 Q538 D539	Q532-D536 PolarHBondContact NE2-OD1 2.82Å; Q532-D536 WeakPolarHBondContact O-CB 3.19Å; Q532-D536 PolarHBondContact O-N 3.29Å; V533-D536 PolarHBondContact O-N 2.64Å; D536-Q538 VanDerWaalsContact C-N 3.26Å; D536-Q538 PolarHBondContact O-N 2.74Å; D536-D539 PolarHBondContact O-N 3.28Å
537	L	89.5	Confident	85.9	Confident	13 Å²	13	70.5 Å²	70.5	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-29.6	174.4	-69.6	172.8	0	0	0	111.9	V533 E535 H556 F559 M613 L616 I617 R620	V533-L537 HydrophobicContact CG1-CD1 3.9Å; V533-L537 HydrophobicContact CG1-CG 4.28Å; V533-L537 WeakPolarHBondContact O-CB 3.38Å; V533-L537 WeakPolarHBondContact O-CG 3.5Å; V533-L537 PolarHBondContact O-N 3.19Å; E535-L537 VanDerWaalsContact C-N 3.35Å; E535-L537 PolarHBondContact O-N 3.36Å; L537-H556 VanDerWaalsContact CD2-CE1 3.49Å; L537-H556 WeakPolarHBondContact CD2-CE1 3.45Å; L537-F559 HydrophobicContact CD2-CE1 4.11Å; L537-M613 HydrophobicContact CD1-CG 4.14Å; L537-M613 HydrophobicContact CD1-SD 4.34Å; L537-L616 HydrophobicContact CB-CB 4.14Å; L537-L616 HydrophobicContact CB-CD1 4.45Å; L537-L616 HydrophobicContact CD1-CB 3.93Å; L537-I617 HydrophobicContact CD1-CG1 4.05Å; L537-R620 HydrophobicContact CD2-CB 3.91Å; L537-R620 HydrophobicContact CD2-CG 3.92Å; L537-R620 PolarHBondContact O-NH1 3.36Å
538	Q	86.9	Confident	86.1	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	36%	0.36	S	S	.	.	H	α-helix	trans	-90.8	-12.3	177.8	-68.9	-174.5	-32.9	0	0	114.2	H534 E535 D536 L616	H534-Q538 VanDerWaalsContact CE1-CD 3.44Å; H534-Q538 PolarHBondContact CE1-NE2 3.01Å; H534-Q538 PolarHBondContact CE1-OE1 2.96Å; H534-Q538 PolarHBondContact ND1-OE1 2.8Å; H534-Q538 VanDerWaalsContact O-CG 3.3Å; H534-Q538 WeakPolarHBondContact O-CG 3.4Å; H534-Q538 PolarHBondContact O-N 3.1Å; E535-Q538 CarbonylContact O-C 3.59Å; E535-Q538 WeakPolarHBondContact O-CA 3.25Å; E535-Q538 PolarHBondContact O-N 3.04Å; D536-Q538 VanDerWaalsContact C-N 3.26Å; D536-Q538 PolarHBondContact O-N 2.74Å; Q538-L616 HydrophobicContact CG-CD1 3.98Å; Q538-L616 HydrophobicContact CG-CD2 4.45Å
539	D	85.6	Confident	86.5	Confident	81 Å²	81	69.2 Å²	69.2	43%	0.433	34%	0.336	S	S	.	.			trans	-69.6	140.5	-172.7	-166.6	28.9	0	0	0	112.9	E535 D536 R620	E535-D539 PolarHBondContact O-N 3.02Å; D536-D539 PolarHBondContact O-N 3.28Å; D539-R620 PolarHBondContact O-NH1 3.25Å; D539-R620 PolarHBondContact O-NH2 3.43Å
540	M	84	Confident	86.6	Confident	99 Å²	99	70.3 Å²	70.3	49%	0.488	35%	0.346	S	S	.	.			trans	-86.5	132.3	-176.1	-67	-170.7	70.3	0	0	111.4	Y399	Y399-M540 HydrophobicContact CD2-CE 4.36Å; Y399-M540 HydrophobicContact CE2-CB 4.44Å; Y399-M540 HydrophobicContact CE2-CE 3.96Å; Y399-M540 HydrophobicContact CE2-SD 4.09Å
541	F	84.9	Confident	86.8	Confident	48 Å²	48	74.1 Å²	74.1	21%	0.211	37%	0.373	C	S	.	.			trans	-109.3	143.5	176.7	48.9	-81.9	0	0	0	111	V543 L552 A623 L624 E627	F541-V543 HydrophobicContact CD2-CG2 4.21Å; F541-L552 HydrophobicContact CB-CD1 3.8Å; F541-L552 HydrophobicContact CD2-CD1 3.74Å; F541-L552 HydrophobicContact CE2-CD1 4.5Å; F541-L552 HydrophobicContact CG-CD1 3.82Å; F541-A623 HydrophobicContact CZ-CB 4.44Å; F541-L624 HydrophobicContact CE1-CD2 3.99Å; F541-L624 HydrophobicContact CE2-CD2 3.99Å; F541-L624 HydrophobicContact CZ-CD2 3.68Å; F541-L624 HydrophobicContact CZ-CG 4.24Å; F541-E627 HydrophobicContact CD2-CG 4.37Å; F541-E627 HydrophobicContact CE2-CB 3.71Å; F541-E627 HydrophobicContact CE2-CG 3.84Å; F541-E627 HydrophobicContact CZ-CB 4.43Å
542	I	83.1	Confident	87.2	Confident	116 Å²	116	73.3 Å²	73.3	60%	0.595	37%	0.371	S	S	*	.			trans	-121.3	124	169.3	-60	176.6	0	0	0	106.4	Y399	Y399-I542 HydrophobicContact CD1-CD1 4.05Å; Y399-I542 HydrophobicContact CE1-CD1 3.61Å; Y399-I542 HydrophobicContact CE2-CD1 4.27Å
543	V	83.7	Confident	87.6	Confident	14 Å²	14	70.1 Å²	70.1	9%	0.085	36%	0.357	C	S	.	.			trans	-140.8	141.1	-174.3	-72.9	0	0	0	0	108.4	F541 D548 V549 L552 E627 Q631	F541-V543 HydrophobicContact CD2-CG2 4.21Å; V543-D548 HydrophobicContact CB-CB 3.96Å; V543-D548 HydrophobicContact CG1-CB 3.72Å; V543-V549 HydrophobicContact CB-CG2 4.24Å; V543-V549 HydrophobicContact CG2-CG2 3.59Å; V543-L552 HydrophobicContact CG1-CD1 3.79Å; V543-E627 HydrophobicContact CG2-CG 3.53Å; V543-Q631 PolarHBondContact O-NE2 3.18Å
544	N	81.7	Confident	87.8	Confident	132 Å²	132	74.4 Å²	74.4	71%	0.706	38%	0.379	S	S	*	.			trans	-120.3	6.4	-173.8	-64.4	-35.8	0	0	0	112.4
545	K	84.7	Confident	88	Confident	127 Å²	127	73.5 Å²	73.5	55%	0.552	39%	0.386	S	S	*	.	S	Bend	trans	-146.7	155.2	-175.1	-56.2	-176.6	178.4	-179.9	0	111.1	E547 D548 V549	K545-E547 WeakPolarHBondContact CB-OE2 3.27Å; K545-D548 WeakPolarHBondContact CB-OD2 3.18Å; K545-D548 PolarHBondContact O-N 3.11Å; K545-V549 PolarHBondContact O-N 3.47Å
546	V	88.7	Confident	88.4	Confident	25 Å²	25	70.2 Å²	70.2	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-68.8	-35.8	178.6	-173.7	0	0	0	0	110.9	D548 V549 M550 L628 Q631 Q632 D635	V546-D548 VanDerWaalsContact C-N 3.33Å; V546-D548 PolarHBondContact O-N 3.5Å; V546-V549 PolarHBondContact O-N 3.02Å; V546-M550 HydrophobicContact CG1-CE 4.12Å; V546-M550 HydrophobicContact CG1-CG 4.38Å; V546-M550 HydrophobicContact CG1-SD 4.36Å; V546-M550 WeakPolarHBondContact O-CG 3.24Å; V546-M550 PolarHBondContact O-N 3.4Å; V546-L628 HydrophobicContact CG1-CD1 3.96Å; V546-Q631 HydrophobicContact CG2-CB 4.1Å; V546-Q632 HydrophobicContact CG1-CG 4.27Å; V546-Q632 HydrophobicContact CG2-CG 4.44Å; V546-D635 HydrophobicContact CG2-CB 4.24Å
547	E	89.2	Confident	88.7	Confident	122 Å²	122	69.9 Å²	69.9	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-61.9	-39.5	177.7	-60.4	84	174.7	0	0	112.5	K545 M550 S551	K545-E547 WeakPolarHBondContact CB-OE2 3.27Å; E547-M550 HydrophobicContact CB-CE 4.48Å; E547-M550 HydrophobicContact CG-CE 4.25Å; E547-M550 PolarHBondContact O-N 2.9Å; E547-S551 PolarHBondContact O-N 3.18Å
548	D	89.8	Confident	88.9	Confident	71 Å²	71	72.7 Å²	72.7	38%	0.38	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-43	178.6	-58.2	-29.1	0	0	0	110.4	V543 K545 V546 S551 L552	V543-D548 HydrophobicContact CB-CB 3.96Å; V543-D548 HydrophobicContact CG1-CB 3.72Å; K545-D548 WeakPolarHBondContact CB-OD2 3.18Å; K545-D548 PolarHBondContact O-N 3.11Å; V546-D548 VanDerWaalsContact C-N 3.33Å; V546-D548 PolarHBondContact O-N 3.5Å; D548-S551 WeakPolarHBondContact O-CB 3.31Å; D548-S551 PolarHBondContact O-N 3.17Å; D548-L552 PolarHBondContact O-N 3.35Å
549	V	90.7	Very high	89.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-44.4	175	-171.8	0	0	0	0	111.4	V543 K545 V546 S551 L552 I553 E627 L628 Q631	V543-V549 HydrophobicContact CB-CG2 4.24Å; V543-V549 HydrophobicContact CG2-CG2 3.59Å; K545-V549 PolarHBondContact O-N 3.47Å; V546-V549 PolarHBondContact O-N 3.02Å; V549-S551 PolarHBondContact O-N 3.31Å; V549-L552 WeakPolarHBondContact O-CB 3.38Å; V549-L552 PolarHBondContact O-N 2.95Å; V549-L552 VanDerWaalsContact O-N 3.12Å; V549-I553 HydrophobicContact CG1-CD1 3.94Å; V549-I553 HydrophobicContact CG1-CG1 4.39Å; V549-I553 WeakPolarHBondContact O-CG1 3.3Å; V549-I553 PolarHBondContact O-N 3.14Å; V549-E627 HydrophobicContact CG2-CG 4.18Å; V549-L628 HydrophobicContact CB-CD1 4.11Å; V549-L628 HydrophobicContact CG1-CB 3.75Å; V549-L628 HydrophobicContact CG1-CD1 3.94Å; V549-L628 HydrophobicContact CG1-CG 4.45Å; V549-Q631 HydrophobicContact CG2-CB 4.18Å; V549-Q631 HydrophobicContact CG2-CG 3.77Å
550	M	91.9	Very high	89.5	Confident	99 Å²	99	67.3 Å²	67.3	49%	0.488	35%	0.353	S	S	.	.	H	α-helix	trans	-61.7	-34.4	178.4	-72	-171.7	-63.4	0	0	112	V546 E547 I553 N554 L628	V546-M550 HydrophobicContact CG1-CE 4.12Å; V546-M550 HydrophobicContact CG1-CG 4.38Å; V546-M550 HydrophobicContact CG1-SD 4.36Å; V546-M550 WeakPolarHBondContact O-CG 3.24Å; V546-M550 PolarHBondContact O-N 3.4Å; E547-M550 HydrophobicContact CB-CE 4.48Å; E547-M550 HydrophobicContact CG-CE 4.25Å; E547-M550 PolarHBondContact O-N 2.9Å; M550-I553 PolarHBondContact O-N 2.88Å; M550-N554 WeakPolarHBondContact O-CB 3.4Å; M550-N554 PolarHBondContact O-N 3.39Å; M550-L628 HydrophobicContact CG-CD1 4.24Å
551	S	91.7	Very high	89.9	Confident	84 Å²	84	69.1 Å²	69.1	59%	0.587	36%	0.358	S	S	*	.	H	α-helix	trans	-62.7	-45.8	172.6	-166.9	0	0	0	0	111.7	E547 D548 V549 N554 G555	E547-S551 PolarHBondContact O-N 3.18Å; D548-S551 WeakPolarHBondContact O-CB 3.31Å; D548-S551 PolarHBondContact O-N 3.17Å; V549-S551 PolarHBondContact O-N 3.31Å; S551-N554 PolarHBondContact O-N 3.31Å; S551-G555 PolarHBondContact O-N 3.1Å
552	L	93	Very high	90.3	Very high	61 Å²	61	69.9 Å²	69.9	32%	0.319	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-42.7	175.9	-66.2	174	0	0	0	112.5	F541 V543 D548 V549 G555 H556 L624	F541-L552 HydrophobicContact CB-CD1 3.8Å; F541-L552 HydrophobicContact CD2-CD1 3.74Å; F541-L552 HydrophobicContact CE2-CD1 4.5Å; F541-L552 HydrophobicContact CG-CD1 3.82Å; V543-L552 HydrophobicContact CG1-CD1 3.79Å; D548-L552 PolarHBondContact O-N 3.35Å; V549-L552 WeakPolarHBondContact O-CB 3.38Å; V549-L552 PolarHBondContact O-N 2.95Å; V549-L552 VanDerWaalsContact O-N 3.12Å; L552-G555 PolarHBondContact O-N 3.14Å; L552-H556 PolarHBondContact O-N 3.03Å; L552-L624 HydrophobicContact CB-CD2 3.72Å; L552-L624 HydrophobicContact CD1-CD2 4.26Å
553	I	92.7	Very high	90.7	Very high	34 Å²	34	65.2 Å²	65.2	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-48	176.3	-69.8	169.3	0	0	0	110.8	V549 M550 G555 H556 E557 L624 L628	V549-I553 HydrophobicContact CG1-CD1 3.94Å; V549-I553 HydrophobicContact CG1-CG1 4.39Å; V549-I553 WeakPolarHBondContact O-CG1 3.3Å; V549-I553 PolarHBondContact O-N 3.14Å; M550-I553 PolarHBondContact O-N 2.88Å; I553-G555 VanDerWaalsContact C-N 3.31Å; I553-G555 PolarHBondContact O-N 2.76Å; I553-H556 PolarHBondContact O-N 3.48Å; I553-H556 VanDerWaalsContact O-N 3.17Å; I553-E557 PolarHBondContact O-N 3.18Å; I553-L624 HydrophobicContact CG1-CB 3.93Å; I553-L624 HydrophobicContact CG1-CD1 4.44Å; I553-L628 HydrophobicContact CD1-CB 4.19Å; I553-L628 HydrophobicContact CD1-CD1 4.38Å; I553-L628 HydrophobicContact CD1-CD2 3.82Å; I553-L628 HydrophobicContact CD1-CG 4.35Å
554	N	93.2	Very high	91	Very high	95 Å²	95	69.2 Å²	69.2	51%	0.508	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-39.3	176.7	-174.9	19.2	0	0	0	111.6	M550 S551 E557 N558	M550-N554 WeakPolarHBondContact O-CB 3.4Å; M550-N554 PolarHBondContact O-N 3.39Å; S551-N554 PolarHBondContact O-N 3.31Å; N554-E557 PolarHBondContact O-N 3.03Å; N554-N558 WeakPolarHBondContact O-CB 3.35Å; N554-N558 VanDerWaalsContact O-CG 3.25Å; N554-N558 PolarHBondContact O-N 2.82Å; N554-N558 PolarHBondContact O-ND2 3.09Å; N554-N558 PolarHBondContact OD1-ND2 3.38Å
555	G	92.8	Very high	91.4	Very high	42 Å²	42	66.3 Å²	66.3	43%	0.433	36%	0.364	S	S	.	.	H	α-helix	trans	-56.8	-48.2	171.6	0	0	0	0	0	112.5	S551 L552 I553 N558 F559	S551-G555 PolarHBondContact O-N 3.1Å; L552-G555 PolarHBondContact O-N 3.14Å; I553-G555 VanDerWaalsContact C-N 3.31Å; I553-G555 PolarHBondContact O-N 2.76Å; G555-N558 PolarHBondContact O-N 2.69Å; G555-F559 PolarHBondContact O-N 2.99Å
556	H	93.4	Very high	91.7	Very high	15 Å²	15	60.9 Å²	60.9	7%	0.069	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-39.9	179.1	-171.6	62.3	0	0	0	113	L537 L552 I553 N558 F559 K560 D621 L624	L537-H556 VanDerWaalsContact CD2-CE1 3.49Å; L537-H556 WeakPolarHBondContact CD2-CE1 3.45Å; L552-H556 PolarHBondContact O-N 3.03Å; I553-H556 PolarHBondContact O-N 3.48Å; I553-H556 VanDerWaalsContact O-N 3.17Å; H556-N558 VanDerWaalsContact C-N 3.32Å; H556-N558 PolarHBondContact O-N 2.9Å; H556-F559 AromaticContact CE1-CD1 3.97Å; H556-F559 AromaticContact ND1-CD1 3.85Å; H556-F559 WeakPolarHBondContact O-CB 3.35Å; H556-F559 PolarHBondContact O-N 3.16Å; H556-K560 WeakPolarHBondContact O-CG 3.11Å; H556-K560 PolarHBondContact O-N 3.09Å; H556-D621 IonicContact CD2-OD1 2.63Å; H556-D621 PolarHBondContact CD2-OD1 2.99Å; H556-D621 IonicContact NE2-OD1 3.96Å; H556-D621 PolarHBondContact NE2-OD1 3.31Å; H556-D621 IonicContact NE2-OD2 2.69Å; H556-L624 HydrophobicContact CB-CD1 3.82Å
557	E	92.7	Very high	91.8	Very high	77 Å²	77	62.7 Å²	62.7	36%	0.36	35%	0.349	S	S	.	.	H	α-helix	trans	-61.4	-37.6	171.9	-76.2	-58.7	148.1	0	0	112.7	I553 N554 K560 K561	I553-E557 PolarHBondContact O-N 3.18Å; N554-E557 PolarHBondContact O-N 3.03Å; E557-K560 VanDerWaalsContact CD-CE 3.41Å; E557-K560 PolarHBondContact O-N 3.39Å; E557-K560 WeakPolarHBondContact OE1-CE 3.44Å; E557-K560 IonicContact OE1-NZ 2.93Å; E557-K560 PolarHBondContact OE1-NZ 2.98Å; E557-K560 WeakPolarHBondContact OE2-CE 3.4Å; E557-K560 IonicContact OE2-NZ 3.1Å; E557-K561 WeakPolarHBondContact O-CE 3.38Å; E557-K561 WeakPolarHBondContact O-CG 2.92Å; E557-K561 PolarHBondContact O-N 2.95Å
558	N	92.6	Very high	91.9	Very high	72 Å²	72	63.1 Å²	63.1	39%	0.385	35%	0.349	S	S	.	.	H	α-helix	trans	-71.3	-35.6	175.3	-68.1	-41.3	0	0	0	112.2	N554 G555 H556 K561	N554-N558 WeakPolarHBondContact O-CB 3.35Å; N554-N558 VanDerWaalsContact O-CG 3.25Å; N554-N558 PolarHBondContact O-N 2.82Å; N554-N558 PolarHBondContact O-ND2 3.09Å; N554-N558 PolarHBondContact OD1-ND2 3.38Å; G555-N558 PolarHBondContact O-N 2.69Å; H556-N558 VanDerWaalsContact C-N 3.32Å; H556-N558 PolarHBondContact O-N 2.9Å; N558-K561 PolarHBondContact O-N 3.07Å; N558-K561 PolarHBondContact OD1-NZ 2.84Å
559	F	92.9	Very high	91.9	Very high	39 Å²	39	62.6 Å²	62.6	17%	0.171	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-48.1	168.9	159.7	-100.5	0	0	0	111.8	W529 V533 L537 G555 H556 K561 T562 L563 M613 I617	W529-F559 HydrophobicContact CZ2-CE2 4.25Å; V533-F559 HydrophobicContact CB-CE2 4.31Å; V533-F559 HydrophobicContact CG1-CE1 4.4Å; V533-F559 HydrophobicContact CG1-CE2 3.47Å; V533-F559 VanDerWaalsContact CG1-CE2 3.47Å; V533-F559 HydrophobicContact CG1-CZ 3.32Å; V533-F559 HydrophobicContact CG2-CE2 3.76Å; V533-F559 HydrophobicContact CG2-CZ 4.47Å; L537-F559 HydrophobicContact CD2-CE1 4.11Å; G555-F559 PolarHBondContact O-N 2.99Å; H556-F559 AromaticContact CE1-CD1 3.97Å; H556-F559 AromaticContact ND1-CD1 3.85Å; H556-F559 WeakPolarHBondContact O-CB 3.35Å; H556-F559 PolarHBondContact O-N 3.16Å; F559-K561 PolarHBondContact O-N 3.36Å; F559-K561 VanDerWaalsContact O-N 3.13Å; F559-T562 WeakPolarHBondContact O-CB 3.35Å; F559-T562 PolarHBondContact O-N 3.42Å; F559-T562 PolarHBondContact O-OG1 3.38Å; F559-L563 HydrophobicContact CE1-CD2 4.29Å; F559-L563 HydrophobicContact CE2-CD2 4.27Å; F559-L563 HydrophobicContact CZ-CD2 3.74Å; F559-L563 HydrophobicContact CZ-CG 4.42Å; F559-M613 HydrophobicContact CZ-SD 4.39Å; F559-I617 HydrophobicContact CE1-CD1 4.47Å; F559-I617 HydrophobicContact CE1-CG1 4.38Å
560	K	92.7	Very high	91.8	Very high	42 Å²	42	62.6 Å²	62.6	18%	0.183	34%	0.344	C	S	.	.	H	α-helix	trans	-57.4	-31.5	-179.7	-73.3	-174.9	-64.2	-165.4	0	112.9	H556 E557 T562 L563 I617 D621	H556-K560 WeakPolarHBondContact O-CG 3.11Å; H556-K560 PolarHBondContact O-N 3.09Å; E557-K560 VanDerWaalsContact CD-CE 3.41Å; E557-K560 PolarHBondContact O-N 3.39Å; E557-K560 WeakPolarHBondContact OE1-CE 3.44Å; E557-K560 IonicContact OE1-NZ 2.93Å; E557-K560 PolarHBondContact OE1-NZ 2.98Å; E557-K560 WeakPolarHBondContact OE2-CE 3.4Å; E557-K560 IonicContact OE2-NZ 3.1Å; K560-T562 PolarHBondContact O-N 2.94Å; K560-L563 HydrophobicContact CB-CD1 4.24Å; K560-L563 HydrophobicContact CG-CD1 4.25Å; K560-L563 WeakPolarHBondContact O-CB 3.39Å; K560-L563 WeakPolarHBondContact O-CG 3.26Å; K560-L563 PolarHBondContact O-N 3.29Å; K560-I617 HydrophobicContact CD-CG2 3.71Å; K560-I617 HydrophobicContact CG-CG2 4.08Å; K560-D621 IonicContact NZ-OD1 2.69Å; K560-D621 PolarHBondContact NZ-OD1 3.26Å; K560-D621 IonicContact NZ-OD2 2.71Å; K560-D621 PolarHBondContact NZ-OD2 3.26Å
561	K	92.9	Very high	91.6	Very high	137 Å²	137	61.6 Å²	61.6	60%	0.596	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.5	174	-64.6	164.6	-159.2	165.2	0	114.2	E557 N558 F559 P564	E557-K561 WeakPolarHBondContact O-CE 3.38Å; E557-K561 WeakPolarHBondContact O-CG 2.92Å; E557-K561 PolarHBondContact O-N 2.95Å; N558-K561 PolarHBondContact O-N 3.07Å; N558-K561 PolarHBondContact OD1-NZ 2.84Å; F559-K561 PolarHBondContact O-N 3.36Å; F559-K561 VanDerWaalsContact O-N 3.13Å; K561-P564 WeakPolarHBondContact O-CD 3.48Å
562	T	91.6	Very high	91.4	Very high	64 Å²	64	60.2 Å²	60.2	39%	0.393	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-21.7	178.1	71.1	0	0	0	0	113.4	F559 K560 P564 A565 A566	F559-T562 WeakPolarHBondContact O-CB 3.35Å; F559-T562 PolarHBondContact O-N 3.42Å; F559-T562 PolarHBondContact O-OG1 3.38Å; K560-T562 PolarHBondContact O-N 2.94Å; T562-P564 VanDerWaalsContact C-CD 3.46Å; T562-A565 WeakPolarHBondContact O-CB 3.3Å; T562-A565 PolarHBondContact O-N 3.23Å; T562-A566 PolarHBondContact O-N 3.31Å
563	L	91.8	Very high	91.1	Very high	18 Å²	18	57.3 Å²	57.3	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-55.3	-40.1	-174.5	-62.8	166.9	0	0	0	114.4	W529 F559 K560 A565 A566 Q567 W610 M613 I617	W529-L563 HydrophobicContact CH2-CD2 4.47Å; F559-L563 HydrophobicContact CE1-CD2 4.29Å; F559-L563 HydrophobicContact CE2-CD2 4.27Å; F559-L563 HydrophobicContact CZ-CD2 3.74Å; F559-L563 HydrophobicContact CZ-CG 4.42Å; K560-L563 HydrophobicContact CB-CD1 4.24Å; K560-L563 HydrophobicContact CG-CD1 4.25Å; K560-L563 WeakPolarHBondContact O-CB 3.39Å; K560-L563 WeakPolarHBondContact O-CG 3.26Å; K560-L563 PolarHBondContact O-N 3.29Å; L563-A565 VanDerWaalsContact C-N 3.26Å; L563-A565 PolarHBondContact O-N 2.85Å; L563-A566 PolarHBondContact O-N 2.87Å; L563-Q567 WeakPolarHBondContact O-CB 3.41Å; L563-Q567 PolarHBondContact O-N 3.34Å; L563-W610 HydrophobicContact CD2-CH2 4.39Å; L563-M613 HydrophobicContact CD2-CE 4.21Å; L563-M613 HydrophobicContact CD2-SD 4.26Å; L563-I617 HydrophobicContact CD1-CD1 3.6Å; L563-I617 HydrophobicContact CD2-CD1 4.23Å
564	P	90.8	Very high	90.7	Very high	97 Å²	97	58.3 Å²	58.3	63%	0.63	32%	0.317	S	S	*	.	H	α-helix	trans	-62.4	-31.2	177.1	-23.6	35.3	0	0	0	113.7	K561 T562 K568	K561-P564 WeakPolarHBondContact O-CD 3.48Å; T562-P564 VanDerWaalsContact C-CD 3.46Å; P564-K568 PolarHBondContact O-N 2.79Å
565	A	89.6	Confident	90.2	Very high	72 Å²	72	57.4 Å²	57.4	60%	0.595	32%	0.315	S	S	*	.	H	α-helix	trans	-74.9	-40.3	176.2	0	0	0	0	0	111.4	T562 L563 K568 E569	T562-A565 WeakPolarHBondContact O-CB 3.3Å; T562-A565 PolarHBondContact O-N 3.23Å; L563-A565 VanDerWaalsContact C-N 3.26Å; L563-A565 PolarHBondContact O-N 2.85Å; A565-K568 WeakPolarHBondContact O-CB 3.33Å; A565-K568 PolarHBondContact O-N 3.38Å; A565-E569 PolarHBondContact O-N 3.28Å
566	A	90.9	Very high	89.6	Confident	12 Å²	12	57.1 Å²	57.1	10%	0.099	30%	0.303	C	S	.	.	H	α-helix	trans	-68.3	-37.2	176.5	0	0	0	0	0	112.7	F526 W529 T562 L563 K568 E569 L570 W610	F526-A566 HydrophobicContact CE2-CB 4.12Å; F526-A566 WeakPolarHBondContact CE2-O 3.39Å; F526-A566 WeakPolarHBondContact CZ-O 3.29Å; W529-A566 HydrophobicContact CE3-CB 4.4Å; W529-A566 HydrophobicContact CH2-CB 3.26Å; W529-A566 HydrophobicContact CZ2-CB 3.85Å; W529-A566 HydrophobicContact CZ3-CB 3.59Å; T562-A566 PolarHBondContact O-N 3.31Å; L563-A566 PolarHBondContact O-N 2.87Å; A566-K568 PolarHBondContact O-N 2.84Å; A566-E569 PolarHBondContact O-N 2.8Å; A566-L570 PolarHBondContact O-N 3.45Å; A566-L570 VanDerWaalsContact O-N 3.13Å; A566-W610 HydrophobicContact CB-CH2 3.99Å; A566-W610 HydrophobicContact CB-CZ3 3.7Å
567	Q	91.7	Very high	89	Confident	63 Å²	63	58 Å²	58	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-34	172.6	180	63.6	82.7	0	0	112	L563 N571 W610	L563-Q567 WeakPolarHBondContact O-CB 3.41Å; L563-Q567 PolarHBondContact O-N 3.34Å; Q567-N571 PolarHBondContact NE2-OD1 3.46Å; Q567-N571 VanDerWaalsContact O-CG 3.24Å; Q567-N571 PolarHBondContact O-N 3.44Å; Q567-N571 PolarHBondContact O-ND2 2.87Å; Q567-N571 PolarHBondContact O-OD1 3.35Å; Q567-W610 HydrophobicContact CB-CH2 3.81Å; Q567-W610 HydrophobicContact CB-CZ2 3.76Å; Q567-W610 HydrophobicContact CG-CZ2 4.34Å; Q567-W610 VanDerWaalsContact OE1-CE2 3.28Å; Q567-W610 VanDerWaalsContact OE1-NE1 3.1Å
568	K	90.8	Very high	88.4	Confident	132 Å²	132	59.8 Å²	59.8	57%	0.574	32%	0.321	S	S	*	.	H	α-helix	trans	-68.2	-44.5	174.7	-173.3	-165.1	167.4	-163.5	0	111.4	P564 A565 A566 L570 N571 D572	P564-K568 PolarHBondContact O-N 2.79Å; A565-K568 WeakPolarHBondContact O-CB 3.33Å; A565-K568 PolarHBondContact O-N 3.38Å; A566-K568 PolarHBondContact O-N 2.84Å; K568-L570 VanDerWaalsContact C-N 3.3Å; K568-L570 PolarHBondContact O-N 3.34Å; K568-N571 WeakPolarHBondContact O-CB 3.28Å; K568-N571 PolarHBondContact O-N 2.82Å; K568-N571 VanDerWaalsContact O-N 3.11Å; K568-D572 PolarHBondContact O-N 2.99Å
569	E	89.2	Confident	87.5	Confident	59 Å²	59	61 Å²	61	28%	0.276	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-42.3	177.7	-176	61	-157.5	0	0	111.7	R522 F526 A565 A566 N571 D572 I573	R522-E569 IonicContact CZ-OE1 3.8Å; R522-E569 VanDerWaalsContact CZ-OE1 3.25Å; R522-E569 IonicContact CZ-OE2 3.24Å; R522-E569 IonicContact NE-OE1 2.69Å; R522-E569 PolarHBondContact NE-OE1 3.03Å; R522-E569 IonicContact NH2-OE1 2.95Å; R522-E569 PolarHBondContact NH2-OE1 2.69Å; R522-E569 IonicContact NH2-OE2 3.18Å; R522-E569 PolarHBondContact NH2-OE2 2.82Å; F526-E569 HydrophobicContact CD2-CB 4.02Å; F526-E569 HydrophobicContact CD2-CG 3.6Å; F526-E569 HydrophobicContact CE2-CB 3.92Å; F526-E569 HydrophobicContact CE2-CG 4.03Å; F526-E569 HydrophobicContact CG-CG 4.21Å; A565-E569 PolarHBondContact O-N 3.28Å; A566-E569 PolarHBondContact O-N 2.8Å; E569-N571 PolarHBondContact O-N 2.77Å; E569-D572 PolarHBondContact O-N 3.2Å; E569-I573 HydrophobicContact CG-CD1 4.14Å; E569-I573 WeakPolarHBondContact O-CG1 3.44Å; E569-I573 PolarHBondContact O-N 3.37Å
570	L	89.1	Confident	86.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-57	-46.4	173.4	179.6	58	0	0	0	112.3	F526 A566 K568 D572 I573 I574 L606 W610	F526-L570 HydrophobicContact CE1-CB 3.94Å; F526-L570 HydrophobicContact CE1-CD1 4.04Å; F526-L570 HydrophobicContact CE1-CG 4.47Å; F526-L570 HydrophobicContact CZ-CB 3.83Å; A566-L570 PolarHBondContact O-N 3.45Å; A566-L570 VanDerWaalsContact O-N 3.13Å; K568-L570 VanDerWaalsContact C-N 3.3Å; K568-L570 PolarHBondContact O-N 3.34Å; L570-D572 PolarHBondContact O-N 3.38Å; L570-I573 PolarHBondContact O-N 3.27Å; L570-I574 HydrophobicContact CD1-CD1 4.21Å; L570-I574 HydrophobicContact CG-CD1 4.13Å; L570-I574 WeakPolarHBondContact O-CD1 3.17Å; L570-I574 VanDerWaalsContact O-CG1 3.3Å; L570-I574 WeakPolarHBondContact O-CG1 3.33Å; L570-I574 PolarHBondContact O-N 2.66Å; L570-I574 VanDerWaalsContact O-N 3.09Å; L570-L606 HydrophobicContact CD1-CB 3.91Å; L570-W610 HydrophobicContact CD2-CB 3.9Å; L570-W610 HydrophobicContact CD2-CD2 3.97Å; L570-W610 HydrophobicContact CD2-CE3 4.28Å; L570-W610 HydrophobicContact CD2-CG 3.75Å
571	N	88.4	Confident	85.7	Confident	78 Å²	78	63.2 Å²	63.2	42%	0.417	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-38.3	179.4	-64.2	-16	0	0	0	112.4	Q567 K568 E569 I574 T575	Q567-N571 PolarHBondContact NE2-OD1 3.46Å; Q567-N571 VanDerWaalsContact O-CG 3.24Å; Q567-N571 PolarHBondContact O-N 3.44Å; Q567-N571 PolarHBondContact O-ND2 2.87Å; Q567-N571 PolarHBondContact O-OD1 3.35Å; K568-N571 WeakPolarHBondContact O-CB 3.28Å; K568-N571 PolarHBondContact O-N 2.82Å; K568-N571 VanDerWaalsContact O-N 3.11Å; E569-N571 PolarHBondContact O-N 2.77Å; N571-I574 PolarHBondContact O-N 2.96Å; N571-T575 PolarHBondContact O-N 3.49Å; N571-T575 VanDerWaalsContact O-N 3.12Å; N571-T575 PolarHBondContact O-OG1 3.28Å
572	D	87.5	Confident	84.6	Confident	56 Å²	56	63.3 Å²	63.3	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-39.5	178.1	-70.5	-14.5	0	0	0	111.2	R522 K568 E569 L570 T575 E576	R522-D572 IonicContact NH2-OD2 3.03Å; K568-D572 PolarHBondContact O-N 2.99Å; E569-D572 PolarHBondContact O-N 3.2Å; L570-D572 PolarHBondContact O-N 3.38Å; D572-T575 WeakPolarHBondContact O-CB 3.21Å; D572-T575 PolarHBondContact O-N 2.87Å; D572-E576 PolarHBondContact O-N 3.09Å; D572-E576 VanDerWaalsContact O-N 3.09Å
573	I	85.8	Confident	83.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-45.6	173.4	-73	169	0	0	0	111.3	R522 I523 F526 E569 L570 T575 E576 A577 L606	R522-I573 HydrophobicContact CB-CD1 3.96Å; R522-I573 HydrophobicContact CB-CG1 3.76Å; I523-I573 HydrophobicContact CD1-CG2 3.86Å; I523-I573 HydrophobicContact CG1-CD1 4.42Å; I523-I573 HydrophobicContact CG1-CG2 3.57Å; F526-I573 HydrophobicContact CB-CD1 3.91Å; F526-I573 HydrophobicContact CD1-CD1 4.06Å; F526-I573 HydrophobicContact CG-CD1 3.99Å; E569-I573 HydrophobicContact CG-CD1 4.14Å; E569-I573 WeakPolarHBondContact O-CG1 3.44Å; E569-I573 PolarHBondContact O-N 3.37Å; L570-I573 PolarHBondContact O-N 3.27Å; I573-T575 PolarHBondContact O-N 3.27Å; I573-E576 PolarHBondContact O-N 3.1Å; I573-A577 PolarHBondContact O-N 3.38Å; I573-L606 HydrophobicContact CG2-CD1 4.08Å
574	I	85.5	Confident	82.3	Confident	54 Å²	54	62.5 Å²	62.5	28%	0.277	33%	0.327	S	S	.	.	H	α-helix	trans	-58.1	-40.9	176.1	-69.3	163.2	0	0	0	110.2	L570 N571 A577 E578 C603	L570-I574 HydrophobicContact CD1-CD1 4.21Å; L570-I574 HydrophobicContact CG-CD1 4.13Å; L570-I574 WeakPolarHBondContact O-CD1 3.17Å; L570-I574 VanDerWaalsContact O-CG1 3.3Å; L570-I574 WeakPolarHBondContact O-CG1 3.33Å; L570-I574 PolarHBondContact O-N 2.66Å; L570-I574 VanDerWaalsContact O-N 3.09Å; N571-I574 PolarHBondContact O-N 2.96Å; I574-A577 PolarHBondContact O-N 3.23Å; I574-E578 PolarHBondContact O-N 3.2Å; I574-C603 HydrophobicContact CG1-CB 4.11Å
575	T	82.6	Confident	81.2	Confident	77 Å²	77	64.2 Å²	64.2	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	-35.6	-180	-54.6	0	0	0	0	113.2	N571 D572 I573	N571-T575 PolarHBondContact O-N 3.49Å; N571-T575 VanDerWaalsContact O-N 3.12Å; N571-T575 PolarHBondContact O-OG1 3.28Å; D572-T575 WeakPolarHBondContact O-CB 3.21Å; D572-T575 PolarHBondContact O-N 2.87Å; I573-T575 PolarHBondContact O-N 3.27Å
576	E	79.5	Confident	80	Confident	36 Å²	36	64.3 Å²	64.3	17%	0.168	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-37.7	173.5	-80.1	-175.2	-137.1	0	0	112.4	S518 I519 R522 D572 I573 E578 Q579	S518-E576 PolarHBondContact OG-OE2 3.32Å; I519-E576 HydrophobicContact CD1-CB 4.25Å; I519-E576 HydrophobicContact CG1-CB 3.61Å; R522-E576 VanDerWaalsContact CD-OE1 3.23Å; R522-E576 WeakPolarHBondContact CD-OE1 3.49Å; R522-E576 IonicContact CZ-OE1 3.92Å; R522-E576 IonicContact NE-OE1 2.66Å; R522-E576 IonicContact NH1-OE1 3.94Å; R522-E576 PolarHBondContact NH1-OE1 2.88Å; D572-E576 PolarHBondContact O-N 3.09Å; D572-E576 VanDerWaalsContact O-N 3.09Å; I573-E576 PolarHBondContact O-N 3.1Å; E576-E578 PolarHBondContact O-N 2.86Å; E576-Q579 VanDerWaalsContact O-CB 3.28Å; E576-Q579 WeakPolarHBondContact O-CB 3.43Å; E576-Q579 PolarHBondContact O-N 3.02Å
577	A	81.1	Confident	78.4	Confident	33 Å²	33	69.5 Å²	69.5	27%	0.273	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-33.4	178.1	0	0	0	0	0	112.7	I519 I573 I574 Q579	I519-A577 HydrophobicContact CD1-CB 4.48Å; I573-A577 PolarHBondContact O-N 3.38Å; I574-A577 PolarHBondContact O-N 3.23Å; A577-Q579 PolarHBondContact O-N 3.29Å
578	E	78.9	Confident	76.7	Confident	115 Å²	115	74.2 Å²	74.2	54%	0.537	37%	0.372	S	S	.	.	H	α-helix	trans	-66.1	-19	172.8	-62.4	-168.5	155.5	0	0	114.1	I574 E576 K582	I574-E578 PolarHBondContact O-N 3.2Å; E576-E578 PolarHBondContact O-N 2.86Å; E578-K582 WeakPolarHBondContact O-CE 3.47Å
579	Q	75	Confident	75.2	Confident	98 Å²	98	71.4 Å²	71.4	46%	0.458	36%	0.363	S	S	.	.	H	α-helix	trans	-79.5	-45.4	178.6	-56.1	-176	20.7	0	0	111.9	E576 A577 K581 K582	E576-Q579 VanDerWaalsContact O-CB 3.28Å; E576-Q579 WeakPolarHBondContact O-CB 3.43Å; E576-Q579 PolarHBondContact O-N 3.02Å; A577-Q579 PolarHBondContact O-N 3.29Å; Q579-K581 PolarHBondContact O-N 3.43Å; Q579-K582 VanDerWaalsContact O-CB 3.31Å; Q579-K582 WeakPolarHBondContact O-CB 3.4Å; Q579-K582 PolarHBondContact O-N 2.96Å
580	V	72.6	Confident	74	Confident	4 Å²	4	71 Å²	71	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-67.2	-31.9	-178.5	-171.8	0	0	0	0	111.5	L515 H516 I519 K582 L583 I584	L515-V580 HydrophobicContact CB-CG2 3.8Å; H516-V580 VanDerWaalsContact CD2-CG1 3.47Å; H516-V580 WeakPolarHBondContact CD2-CG1 3.34Å; H516-V580 VanDerWaalsContact CE1-CG1 3.41Å; H516-V580 WeakPolarHBondContact CE1-CG1 3.49Å; H516-V580 WeakPolarHBondContact NE2-CG1 3.37Å; I519-V580 HydrophobicContact CD1-CB 4.47Å; I519-V580 HydrophobicContact CD1-CG2 3.58Å; V580-K582 PolarHBondContact O-N 2.78Å; V580-L583 PolarHBondContact O-N 3.19Å; V580-I584 HydrophobicContact CG1-CD1 3.77Å; V580-I584 HydrophobicContact CG1-CG1 4.39Å; V580-I584 PolarHBondContact O-N 2.9Å
581	K	75.1	Confident	72.8	Confident	123 Å²	123	75.3 Å²	75.3	54%	0.535	40%	0.397	S	S	.	.	H	α-helix	trans	-50.2	-28.9	168.7	-172.5	172.8	-178	179	0	113.5	Q579 Q585 L594	Q579-K581 PolarHBondContact O-N 3.43Å; K581-Q585 VanDerWaalsContact O-CG 3.26Å; K581-Q585 WeakPolarHBondContact O-CG 3.41Å; K581-Q585 PolarHBondContact O-OE1 3.02Å; K581-L594 HydrophobicContact CB-CD2 4.07Å; K581-L594 HydrophobicContact CG-CD2 3.86Å
582	K	69.4	Low	71.7	Confident	138 Å²	138	77.8 Å²	77.8	60%	0.6	41%	0.406	S	S	*	.	H	α-helix	trans	-83.1	-28.6	178.2	-58.5	169.9	-174.4	171	0	113.8	E578 Q579 V580	E578-K582 WeakPolarHBondContact O-CE 3.47Å; Q579-K582 VanDerWaalsContact O-CB 3.31Å; Q579-K582 WeakPolarHBondContact O-CB 3.4Å; Q579-K582 PolarHBondContact O-N 2.96Å; V580-K582 PolarHBondContact O-N 2.78Å
583	L	65.9	Low	70.7	Confident	61 Å²	61	75.6 Å²	75.6	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-81.5	-34.1	-176.7	-83.2	167	0	0	0	113.9	L515 V580 Q585 S586	L515-L583 HydrophobicContact CD1-CD1 3.2Å; V580-L583 PolarHBondContact O-N 3.19Å; L583-Q585 VanDerWaalsContact C-N 3.27Å; L583-Q585 PolarHBondContact O-N 3.26Å; L583-S586 PolarHBondContact O-N 3.1Å; L583-S586 VanDerWaalsContact O-N 3.17Å; L583-S586 PolarHBondContact O-OG 3.31Å
584	I	68	Low	69.9	Low	5 Å²	5	79.5 Å²	79.5	3%	0.026	42%	0.415	C	S	.	.	H	α-helix	trans	-68.7	-36.5	178.7	-65.4	149.7	0	0	0	110	V580 S586 L593 L594	V580-I584 HydrophobicContact CG1-CD1 3.77Å; V580-I584 HydrophobicContact CG1-CG1 4.39Å; V580-I584 PolarHBondContact O-N 2.9Å; I584-S586 PolarHBondContact O-N 3.21Å; I584-L593 HydrophobicContact CB-CB 4.47Å; I584-L593 HydrophobicContact CD1-CB 4.01Å; I584-L593 WeakPolarHBondContact CD1-O 3.44Å; I584-L593 HydrophobicContact CG1-CB 3.81Å; I584-L593 HydrophobicContact CG2-CB 3.82Å; I584-L594 HydrophobicContact CB-CD2 4.48Å; I584-L594 HydrophobicContact CD1-CB 4.49Å; I584-L594 HydrophobicContact CD1-CD2 3.85Å; I584-L594 HydrophobicContact CD1-CG 4.17Å; I584-L594 HydrophobicContact CG2-CG 4.35Å
585	Q	67.7	Low	69	Low	132 Å²	132	84.7 Å²	84.7	62%	0.617	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.9	173.4	-68.1	175.8	-10.2	0	0	113.6	K581 L583	K581-Q585 VanDerWaalsContact O-CG 3.26Å; K581-Q585 WeakPolarHBondContact O-CG 3.41Å; K581-Q585 PolarHBondContact O-OE1 3.02Å; L583-Q585 VanDerWaalsContact C-N 3.27Å; L583-Q585 PolarHBondContact O-N 3.26Å
586	S	65.5	Low	68.4	Low	74 Å²	74	82.2 Å²	82.2	52%	0.517	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-15.1	-175.7	69.5	0	0	0	0	116	L583 I584	L583-S586 PolarHBondContact O-N 3.1Å; L583-S586 VanDerWaalsContact O-N 3.17Å; L583-S586 PolarHBondContact O-OG 3.31Å; I584-S586 PolarHBondContact O-N 3.21Å
587	H	57.4	Low	67.8	Low	121 Å²	121	81 Å²	81	56%	0.56	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	8	-175.2	-76.5	-79	0	0	0	114.9	L589	H587-L589 HydrophobicContact CB-CD1 3.66Å; H587-L589 HydrophobicContact CB-CG 3.65Å; H587-L589 PolarHBondContact O-N 2.9Å; H587-L589 VanDerWaalsContact O-N 3.08Å
588	N	55.5	Low	67	Low	162 Å²	162	79.7 Å²	79.7	87%	0.866	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	26.5	-173.6	-71.6	-17	0	0	0	113.9
589	L	59.9	Low	66.8	Low	74 Å²	74	75.4 Å²	75.4	39%	0.387	38%	0.384	S	S	.	.			trans	-82.2	158.6	175	-52.5	168.5	0	0	0	108.8	I512 H587 S591 L593	I512-L589 HydrophobicContact CD1-CD1 3.18Å; H587-L589 HydrophobicContact CB-CD1 3.66Å; H587-L589 HydrophobicContact CB-CG 3.65Å; H587-L589 PolarHBondContact O-N 2.9Å; H587-L589 VanDerWaalsContact O-N 3.08Å; L589-S591 PolarHBondContact O-N 3.03Å; L589-L593 HydrophobicContact CB-CD1 3.21Å; L589-L593 HydrophobicContact CD1-CD1 3.87Å; L589-L593 HydrophobicContact CG-CD1 4.13Å
590	S	63.1	Low	66.4	Low	49 Å²	49	76.7 Å²	76.7	34%	0.343	39%	0.392	S	S	.	.			trans	-51.9	139.6	-176.1	-172.1	0	0	0	0	112.3	E592 L593	S590-E592 VanDerWaalsContact CB-OE2 3.26Å; S590-E592 WeakPolarHBondContact CB-OE2 3.37Å; S590-E592 PolarHBondContact O-N 3.3Å; S590-E592 WeakPolarHBondContact OG-CB 3.29Å; S590-E592 WeakPolarHBondContact OG-CG 3.45Å; S590-E592 PolarHBondContact OG-N 3.49Å; S590-E592 PolarHBondContact OG-OE2 3.29Å; S590-L593 WeakPolarHBondContact O-CB 3.27Å; S590-L593 PolarHBondContact O-N 3.01Å
591	S	65.1	Low	66.4	Low	91 Å²	91	78 Å²	78	64%	0.636	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-59.8	-17	172.3	52.1	0	0	0	0	112.5	L589 L593 L594	L589-S591 PolarHBondContact O-N 3.03Å; S591-L593 PolarHBondContact O-N 3.35Å; S591-L594 WeakPolarHBondContact O-CB 3.49Å; S591-L594 PolarHBondContact O-N 2.96Å
592	E	65.2	Low	66.6	Low	131 Å²	131	76.1 Å²	76.1	61%	0.612	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-53.1	-28.3	167.2	-65.2	165.8	140.4	0	0	113.1	S590 L594 K595	S590-E592 VanDerWaalsContact CB-OE2 3.26Å; S590-E592 WeakPolarHBondContact CB-OE2 3.37Å; S590-E592 PolarHBondContact O-N 3.3Å; S590-E592 WeakPolarHBondContact OG-CB 3.29Å; S590-E592 WeakPolarHBondContact OG-CG 3.45Å; S590-E592 PolarHBondContact OG-N 3.49Å; S590-E592 PolarHBondContact OG-OE2 3.29Å; E592-L594 PolarHBondContact O-N 3.21Å; E592-K595 WeakPolarHBondContact O-CB 3.47Å; E592-K595 PolarHBondContact O-N 3.12Å
593	L	65.3	Low	67.2	Low	9 Å²	9	71.1 Å²	71.1	5%	0.047	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-69.3	-15.8	176.1	-76.6	150.4	0	0	0	113.6	S433 I512 H516 I584 L589 S590 S591 K595	S433-L593 VanDerWaalsContact CB-CD2 3.43Å; I512-L593 HydrophobicContact CG2-CD2 4.16Å; H516-L593 PolarHBondContact CE1-O 2.9Å; H516-L593 PolarHBondContact NE2-O 2.74Å; I584-L593 HydrophobicContact CB-CB 4.47Å; I584-L593 HydrophobicContact CD1-CB 4.01Å; I584-L593 WeakPolarHBondContact CD1-O 3.44Å; I584-L593 HydrophobicContact CG1-CB 3.81Å; I584-L593 HydrophobicContact CG2-CB 3.82Å; L589-L593 HydrophobicContact CB-CD1 3.21Å; L589-L593 HydrophobicContact CD1-CD1 3.87Å; L589-L593 HydrophobicContact CG-CD1 4.13Å; S590-L593 WeakPolarHBondContact O-CB 3.27Å; S590-L593 PolarHBondContact O-N 3.01Å; S591-L593 PolarHBondContact O-N 3.35Å; L593-K595 PolarHBondContact O-N 3.4Å
594	L	69	Low	68.1	Low	82 Å²	82	71.8 Å²	71.8	43%	0.429	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-64	-23.7	173	-75	168.6	0	0	0	112.1	K581 I584 S591 E592 N596	K581-L594 HydrophobicContact CB-CD2 4.07Å; K581-L594 HydrophobicContact CG-CD2 3.86Å; I584-L594 HydrophobicContact CB-CD2 4.48Å; I584-L594 HydrophobicContact CD1-CB 4.49Å; I584-L594 HydrophobicContact CD1-CD2 3.85Å; I584-L594 HydrophobicContact CD1-CG 4.17Å; I584-L594 HydrophobicContact CG2-CG 4.35Å; S591-L594 WeakPolarHBondContact O-CB 3.49Å; S591-L594 PolarHBondContact O-N 2.96Å; E592-L594 PolarHBondContact O-N 3.21Å; L594-N596 PolarHBondContact O-N 2.92Å; L594-N596 VanDerWaalsContact O-N 3.17Å
595	K	67.6	Low	68.9	Low	164 Å²	164	73.8 Å²	73.8	71%	0.713	40%	0.399	S	S	*	.	S	Bend	trans	-74.6	102.4	169.9	-172.7	173.8	-176	172.5	0	107.6	E592 L593 P597	E592-K595 WeakPolarHBondContact O-CB 3.47Å; E592-K595 PolarHBondContact O-N 3.12Å; L593-K595 PolarHBondContact O-N 3.4Å; K595-P597 WeakPolarHBondContact O-CD 3.23Å
596	N	69.9	Low	69.7	Low	25 Å²	25	67.5 Å²	67.5	13%	0.134	37%	0.369	C	S	.	.			trans	-48.7	111.6	177.6	-177.9	-33.5	0	0	0	109.4	H516 L594 Y598 T599	H516-N596 WeakPolarHBondContact CB-OD1 3.39Å; H516-N596 VanDerWaalsContact CD2-CG 3.44Å; H516-N596 PolarHBondContact O-ND2 2.93Å; H516-N596 VanDerWaalsContact O-ND2 3.09Å; L594-N596 PolarHBondContact O-N 2.92Å; L594-N596 VanDerWaalsContact O-N 3.17Å; N596-Y598 PolarHBondContact O-N 2.8Å; N596-Y598 VanDerWaalsContact O-N 3.12Å; N596-Y598 WeakPolarHBondContact OD1-CA 3.37Å; N596-Y598 WeakPolarHBondContact OD1-CB 3.38Å; N596-Y598 WeakPolarHBondContact OD1-CD2 3.49Å; N596-Y598 PolarHBondContact OD1-N 3.05Å; N596-T599 HydrophobicContact CB-CG2 3.83Å; N596-T599 VanDerWaalsContact O-O 3.14Å
597	P	65.9	Low	70.7	Confident	11 Å²	11	66.9 Å²	66.9	7%	0.071	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-14.7	-175.6	-19	28.7	0	0	0	113.6	A437 H516 K595	A437-P597 WeakPolarHBondContact CA-O 3.46Å; A437-P597 HydrophobicContact CB-CB 3.8Å; H516-P597 WeakPolarHBondContact ND1-CD 3.43Å; K595-P597 WeakPolarHBondContact O-CD 3.23Å
598	Y	66.1	Low	72.2	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.016	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-5.5	-164.2	-54	-91.6	0	0	0	113.8	R436 Q440 D513 H516 L517 A520 N596	R436-Y598 HydrophobicContact CB-CE1 3.86Å; R436-Y598 WeakPolarHBondContact CB-OH 3.49Å; R436-Y598 HydrophobicContact CG-CE1 4.42Å; Q440-Y598 HydrophobicContact CB-CD1 3.64Å; Q440-Y598 HydrophobicContact CB-CE1 4.12Å; Q440-Y598 HydrophobicContact CB-CG 4.33Å; Q440-Y598 VanDerWaalsContact CG-CA 3.43Å; Q440-Y598 HydrophobicContact CG-CD1 3.53Å; Q440-Y598 HydrophobicContact CG-CE1 4.46Å; Q440-Y598 HydrophobicContact CG-CG 4.01Å; D513-Y598 VanDerWaalsContact CA-CZ 3.47Å; D513-Y598 VanDerWaalsContact CA-OH 3.27Å; D513-Y598 WeakPolarHBondContact CA-OH 3.48Å; D513-Y598 HydrophobicContact CB-CE1 4.19Å; D513-Y598 HydrophobicContact CB-CE2 4.37Å; D513-Y598 WeakPolarHBondContact CB-OH 3.21Å; D513-Y598 WeakPolarHBondContact OD1-CE1 3.4Å; D513-Y598 VanDerWaalsContact OD1-CZ 3.23Å; D513-Y598 PolarHBondContact OD1-OH 3.36Å; D513-Y598 VanDerWaalsContact OD1-OH 3.12Å; H516-Y598 HydrophobicContact CB-CD2 3.24Å; H516-Y598 HydrophobicContact CB-CE2 3.58Å; H516-Y598 HydrophobicContact CB-CG 4.3Å; L517-Y598 HydrophobicContact CB-CD1 4.37Å; L517-Y598 HydrophobicContact CB-CG 4.49Å; L517-Y598 HydrophobicContact CD1-CD1 4.21Å; A520-Y598 VanDerWaalsContact CB-O 3.27Å; A520-Y598 WeakPolarHBondContact CB-O 3.49Å; N596-Y598 PolarHBondContact O-N 2.8Å; N596-Y598 VanDerWaalsContact O-N 3.12Å; N596-Y598 WeakPolarHBondContact OD1-CA 3.37Å; N596-Y598 WeakPolarHBondContact OD1-CB 3.38Å; N596-Y598 WeakPolarHBondContact OD1-CD2 3.49Å; N596-Y598 PolarHBondContact OD1-N 3.05Å
599	T	73.4	Confident	73.8	Confident	25 Å²	25	61.2 Å²	61.2	15%	0.153	33%	0.331	C	S	.	.			trans	-139.4	133.4	175.7	177.6	0	0	0	0	109.1	I523 N596 I601	I523-T599 HydrophobicContact CD1-CG2 4.17Å; I523-T599 WeakPolarHBondContact CG2-OG1 3.39Å; N596-T599 HydrophobicContact CB-CG2 3.83Å; N596-T599 VanDerWaalsContact O-O 3.14Å; T599-I601 WeakPolarHBondContact CG2-O 3.29Å; T599-I601 PolarHBondContact O-N 3.21Å; T599-I601 WeakPolarHBondContact OG1-CB 3.3Å; T599-I601 PolarHBondContact OG1-N 3.12Å; T599-I601 PolarHBondContact OG1-O 3.34Å
600	M	66.3	Low	75.3	Confident	126 Å²	126	58.1 Å²	58.1	62%	0.621	31%	0.314	S	S	*	.	S	Bend	trans	-79	-6.4	168	-69.1	-67.8	-63	0	0	112	K441	K441-M600 HydrophobicContact CD-SD 3.87Å; K441-M600 HydrophobicContact CG-CG 4.29Å; K441-M600 HydrophobicContact CG-SD 3.93Å
601	I	73.8	Confident	76.6	Confident	30 Å²	30	59.9 Å²	59.9	15%	0.154	32%	0.319	C	S	.	.			trans	-109	113.8	-171.6	-48.9	-178.1	0	0	0	108	I523 N527 T599 T605 L606	I523-I601 HydrophobicContact CG2-CB 4.1Å; I523-I601 HydrophobicContact CG2-CG2 4.47Å; N527-I601 HydrophobicContact CB-CD1 3.87Å; N527-I601 WeakPolarHBondContact ND2-CD1 3.42Å; N527-I601 WeakPolarHBondContact OD1-CD1 3.48Å; T599-I601 WeakPolarHBondContact CG2-O 3.29Å; T599-I601 PolarHBondContact O-N 3.21Å; T599-I601 WeakPolarHBondContact OG1-CB 3.3Å; T599-I601 PolarHBondContact OG1-N 3.12Å; T599-I601 PolarHBondContact OG1-O 3.34Å; I601-T605 HydrophobicContact CG2-CG2 3.79Å; I601-L606 HydrophobicContact CG2-CD2 3.98Å; I601-L606 HydrophobicContact CG2-CG 3.87Å
602	D	78.6	Confident	77.7	Confident	84 Å²	84	57.4 Å²	57.4	45%	0.449	30%	0.304	S	S	.	.			trans	-83.4	167.2	172.4	62.5	35.7	0	0	0	111.9	S604 T605 L606	D602-S604 PolarHBondContact O-N 3.37Å; D602-S604 PolarHBondContact OD1-N 3.44Å; D602-S604 PolarHBondContact OD1-OG 3.48Å; D602-T605 WeakPolarHBondContact O-CB 3.5Å; D602-T605 PolarHBondContact O-N 2.87Å; D602-T605 VanDerWaalsContact O-N 3.07Å; D602-T605 WeakPolarHBondContact OD1-CB 3.47Å; D602-T605 PolarHBondContact OD1-N 3.13Å; D602-T605 PolarHBondContact OD1-OG1 3Å; D602-L606 PolarHBondContact O-N 3.15Å
603	C	81.8	Confident	79	Confident	34 Å²	34	51.2 Å²	51.2	23%	0.23	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-27.1	-176.7	-52.9	0	0	0	0	112.7	I574 Q607	I574-C603 HydrophobicContact CG1-CB 4.11Å; C603-Q607 PolarHBondContact O-N 3.3Å
604	S	84.1	Confident	80.2	Confident	74 Å²	74	57.2 Å²	57.2	52%	0.517	30%	0.298	S	S	.	.	H	α-helix	trans	-67.9	-35.7	171.8	27.2	0	0	0	0	112.8	D602 Q607 S608	D602-S604 PolarHBondContact O-N 3.37Å; D602-S604 PolarHBondContact OD1-N 3.44Å; D602-S604 PolarHBondContact OD1-OG 3.48Å; S604-Q607 PolarHBondContact O-N 3.33Å; S604-S608 WeakPolarHBondContact O-CB 3.5Å; S604-S608 PolarHBondContact O-N 3.25Å; S604-S608 PolarHBondContact O-OG 3.04Å
605	T	84.8	Confident	81.2	Confident	48 Å²	48	57.3 Å²	57.3	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-70.2	-41.3	175.5	-55.3	0	0	0	0	110.3	I601 D602 S608 R609	I601-T605 HydrophobicContact CG2-CG2 3.79Å; D602-T605 WeakPolarHBondContact O-CB 3.5Å; D602-T605 PolarHBondContact O-N 2.87Å; D602-T605 VanDerWaalsContact O-N 3.07Å; D602-T605 WeakPolarHBondContact OD1-CB 3.47Å; D602-T605 PolarHBondContact OD1-N 3.13Å; D602-T605 PolarHBondContact OD1-OG1 3Å; T605-S608 PolarHBondContact O-N 3.49Å; T605-R609 WeakPolarHBondContact O-CB 3.35Å; T605-R609 VanDerWaalsContact O-CG 3.28Å; T605-R609 WeakPolarHBondContact O-CG 3.05Å; T605-R609 PolarHBondContact O-N 3.3Å
606	L	84.9	Confident	82.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-44.2	171.6	-75.2	178.1	0	0	0	112.4	I523 F526 N527 L530 L570 I573 I601 D602 R609 W610	I523-L606 HydrophobicContact CB-CD1 4.36Å; I523-L606 HydrophobicContact CD1-CD1 3.87Å; I523-L606 HydrophobicContact CG1-CD1 3.73Å; I523-L606 HydrophobicContact CG2-CD1 4.05Å; I523-L606 HydrophobicContact CG2-CD2 4.43Å; F526-L606 HydrophobicContact CD1-CD2 4.22Å; N527-L606 HydrophobicContact CB-CD2 4.03Å; L530-L606 HydrophobicContact CD1-CD2 4.1Å; L570-L606 HydrophobicContact CD1-CB 3.91Å; I573-L606 HydrophobicContact CG2-CD1 4.08Å; I601-L606 HydrophobicContact CG2-CD2 3.98Å; I601-L606 HydrophobicContact CG2-CG 3.87Å; D602-L606 PolarHBondContact O-N 3.15Å; L606-R609 PolarHBondContact O-N 3.02Å; L606-W610 WeakPolarHBondContact O-CB 3.38Å; L606-W610 PolarHBondContact O-N 3.48Å
607	Q	88.1	Confident	83.4	Confident	61 Å²	61	51 Å²	51	29%	0.285	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-46.9	175.4	-172.5	63.3	57.4	0	0	111.2	C603 S604 R609 W610 D611	C603-Q607 PolarHBondContact O-N 3.3Å; S604-Q607 PolarHBondContact O-N 3.33Å; Q607-R609 VanDerWaalsContact C-N 3.29Å; Q607-R609 PolarHBondContact O-N 3.4Å; Q607-W610 WeakPolarHBondContact O-CB 3.42Å; Q607-W610 PolarHBondContact O-N 3.04Å; Q607-D611 PolarHBondContact NE2-OD1 3.46Å; Q607-D611 PolarHBondContact O-N 2.91Å
608	S	88.9	Confident	84.6	Confident	73 Å²	73	54 Å²	54	51%	0.51	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-37.8	177.8	-55.3	0	0	0	0	112.5	S604 T605 A612	S604-S608 WeakPolarHBondContact O-CB 3.5Å; S604-S608 PolarHBondContact O-N 3.25Å; S604-S608 PolarHBondContact O-OG 3.04Å; T605-S608 PolarHBondContact O-N 3.49Å; S608-A612 WeakPolarHBondContact O-CB 3.29Å; S608-A612 PolarHBondContact O-N 3.44Å
609	R	88.4	Confident	85.8	Confident	90 Å²	90	55.9 Å²	55.9	34%	0.34	32%	0.321	S	S	.	.	H	α-helix	trans	-72.6	-38.2	176.4	-74.7	172.7	173.5	-148.7	-16.7	112.5	N527 L530 E531 T605 L606 Q607 A612 M613	N527-R609 VanDerWaalsContact CG-NH1 3.33Å; N527-R609 PolarHBondContact ND2-NH1 3.21Å; N527-R609 PolarHBondContact OD1-NH1 2.76Å; L530-R609 HydrophobicContact CD1-CB 4.17Å; E531-R609 IonicContact OE1-CZ 3.73Å; E531-R609 IonicContact OE1-NH1 2.76Å; E531-R609 PolarHBondContact OE1-NH1 3.25Å; E531-R609 IonicContact OE1-NH2 2.72Å; T605-R609 WeakPolarHBondContact O-CB 3.35Å; T605-R609 VanDerWaalsContact O-CG 3.28Å; T605-R609 WeakPolarHBondContact O-CG 3.05Å; T605-R609 PolarHBondContact O-N 3.3Å; L606-R609 PolarHBondContact O-N 3.02Å; Q607-R609 VanDerWaalsContact C-N 3.29Å; Q607-R609 PolarHBondContact O-N 3.4Å; R609-A612 PolarHBondContact O-N 3.21Å; R609-M613 VanDerWaalsContact O-CB 3.28Å; R609-M613 WeakPolarHBondContact O-CB 3.39Å; R609-M613 PolarHBondContact O-N 3.37Å
610	W	91.1	Very high	86.7	Confident	9 Å²	9	56.3 Å²	56.3	3%	0.034	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-50.1	170.6	175.5	-87	0	0	0	110.7	F526 W529 L530 L563 A566 Q567 L570 L606 Q607 A612 M613 Y614	F526-W610 AromaticContact CZ-CE3 3.96Å; F526-W610 HydrophobicContact CZ-CE3 3.96Å; F526-W610 HydrophobicContact CZ-CZ3 4.11Å; W529-W610 HydrophobicContact CH2-CZ3 4.14Å; W529-W610 HydrophobicContact CZ3-CE3 4.44Å; W529-W610 AromaticContact CZ3-CZ3 3.9Å; W529-W610 HydrophobicContact CZ3-CZ3 3.9Å; L530-W610 HydrophobicContact CD2-CB 4.44Å; L530-W610 HydrophobicContact CD2-CE3 3.99Å; L563-W610 HydrophobicContact CD2-CH2 4.39Å; A566-W610 HydrophobicContact CB-CH2 3.99Å; A566-W610 HydrophobicContact CB-CZ3 3.7Å; Q567-W610 HydrophobicContact CB-CH2 3.81Å; Q567-W610 HydrophobicContact CB-CZ2 3.76Å; Q567-W610 HydrophobicContact CG-CZ2 4.34Å; Q567-W610 VanDerWaalsContact OE1-CE2 3.28Å; Q567-W610 VanDerWaalsContact OE1-NE1 3.1Å; L570-W610 HydrophobicContact CD2-CB 3.9Å; L570-W610 HydrophobicContact CD2-CD2 3.97Å; L570-W610 HydrophobicContact CD2-CE3 4.28Å; L570-W610 HydrophobicContact CD2-CG 3.75Å; L606-W610 WeakPolarHBondContact O-CB 3.38Å; L606-W610 PolarHBondContact O-N 3.48Å; Q607-W610 WeakPolarHBondContact O-CB 3.42Å; Q607-W610 PolarHBondContact O-N 3.04Å; W610-A612 VanDerWaalsContact C-N 3.35Å; W610-A612 PolarHBondContact O-N 3.06Å; W610-M613 HydrophobicContact CD2-CE 3.94Å; W610-M613 HydrophobicContact CE3-CE 3.72Å; W610-M613 HydrophobicContact CH2-CE 4.17Å; W610-M613 HydrophobicContact CZ2-CE 4.41Å; W610-M613 HydrophobicContact CZ3-CE 3.84Å; W610-M613 PolarHBondContact O-N 3.13Å; W610-Y614 HydrophobicContact CZ2-CD2 4.28Å; W610-Y614 VanDerWaalsContact O-CB 3.29Å; W610-Y614 WeakPolarHBondContact O-CB 3.34Å; W610-Y614 PolarHBondContact O-N 3.22Å
611	D	90.5	Very high	87.9	Confident	86 Å²	86	52 Å²	52	46%	0.46	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-40.9	180	-60.4	-20.3	0	0	0	111.6	Q607 Y614 S615	Q607-D611 PolarHBondContact NE2-OD1 3.46Å; Q607-D611 PolarHBondContact O-N 2.91Å; D611-Y614 PolarHBondContact O-N 3.32Å; D611-S615 PolarHBondContact O-N 3.06Å
612	A	88.6	Confident	88.8	Confident	39 Å²	39	55 Å²	55	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-49.5	174.7	0	0	0	0	0	112.3	S608 R609 W610 Y614 S615 L616	S608-A612 WeakPolarHBondContact O-CB 3.29Å; S608-A612 PolarHBondContact O-N 3.44Å; R609-A612 PolarHBondContact O-N 3.21Å; W610-A612 VanDerWaalsContact C-N 3.35Å; W610-A612 PolarHBondContact O-N 3.06Å; A612-Y614 VanDerWaalsContact C-N 3.32Å; A612-Y614 PolarHBondContact O-N 2.94Å; A612-S615 PolarHBondContact O-N 3.37Å; A612-S615 PolarHBondContact O-OG 3.46Å; A612-L616 PolarHBondContact O-N 3.08Å
613	M	91.9	Very high	89.4	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-45	174.5	174.6	-78.8	-61.9	0	0	111.4	L530 V533 L537 F559 L563 R609 W610 S615 L616 I617	L530-M613 HydrophobicContact CD2-CB 4.18Å; L530-M613 HydrophobicContact CD2-CE 3.77Å; L530-M613 HydrophobicContact CD2-CG 4.25Å; V533-M613 HydrophobicContact CB-CG 4.32Å; V533-M613 HydrophobicContact CG1-CG 3.53Å; V533-M613 HydrophobicContact CG1-SD 3.82Å; L537-M613 HydrophobicContact CD1-CG 4.14Å; L537-M613 HydrophobicContact CD1-SD 4.34Å; F559-M613 HydrophobicContact CZ-SD 4.39Å; L563-M613 HydrophobicContact CD2-CE 4.21Å; L563-M613 HydrophobicContact CD2-SD 4.26Å; R609-M613 VanDerWaalsContact O-CB 3.28Å; R609-M613 WeakPolarHBondContact O-CB 3.39Å; R609-M613 PolarHBondContact O-N 3.37Å; W610-M613 HydrophobicContact CD2-CE 3.94Å; W610-M613 HydrophobicContact CE3-CE 3.72Å; W610-M613 HydrophobicContact CH2-CE 4.17Å; W610-M613 HydrophobicContact CZ2-CE 4.41Å; W610-M613 HydrophobicContact CZ3-CE 3.84Å; W610-M613 PolarHBondContact O-N 3.13Å; M613-S615 VanDerWaalsContact C-N 3.27Å; M613-S615 PolarHBondContact O-N 2.9Å; M613-L616 WeakPolarHBondContact O-CB 3.42Å; M613-L616 PolarHBondContact O-N 2.86Å; M613-L616 VanDerWaalsContact O-N 3.1Å; M613-I617 HydrophobicContact SD-CD1 4.18Å; M613-I617 HydrophobicContact SD-CG1 4.49Å
614	Y	90.5	Very high	89.9	Confident	135 Å²	135	51.2 Å²	51.2	53%	0.529	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-34.7	-179.9	-158.8	-86	0	0	0	112	W610 D611 A612 L616 I617	W610-Y614 HydrophobicContact CZ2-CD2 4.28Å; W610-Y614 VanDerWaalsContact O-CB 3.29Å; W610-Y614 WeakPolarHBondContact O-CB 3.34Å; W610-Y614 PolarHBondContact O-N 3.22Å; D611-Y614 PolarHBondContact O-N 3.32Å; A612-Y614 VanDerWaalsContact C-N 3.32Å; A612-Y614 PolarHBondContact O-N 2.94Å; Y614-L616 VanDerWaalsContact C-N 3.3Å; Y614-L616 PolarHBondContact O-N 2.94Å; Y614-I617 HydrophobicContact CD2-CD1 4.03Å; Y614-I617 HydrophobicContact CE2-CD1 4.4Å; Y614-I617 HydrophobicContact CG-CD1 4.27Å; Y614-I617 PolarHBondContact O-N 3.36Å
615	S	90.4	Very high	90.3	Very high	84 Å²	84	52.2 Å²	52.2	59%	0.587	30%	0.295	S	S	*	.	H	α-helix	trans	-66.1	-28.8	175.8	80.5	0	0	0	0	113.8	D611 A612 M613 I617	D611-S615 PolarHBondContact O-N 3.06Å; A612-S615 PolarHBondContact O-N 3.37Å; A612-S615 PolarHBondContact O-OG 3.46Å; M613-S615 VanDerWaalsContact C-N 3.27Å; M613-S615 PolarHBondContact O-N 2.9Å; S615-I617 VanDerWaalsContact C-N 3.34Å
616	L	91.1	Very high	90.6	Very high	41 Å²	41	56.6 Å²	56.6	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-74.7	-22.2	179.8	-67	174.4	0	0	0	113.4	L537 Q538 A612 M613 Y614 S618 G619 R620	L537-L616 HydrophobicContact CB-CB 4.14Å; L537-L616 HydrophobicContact CB-CD1 4.45Å; L537-L616 HydrophobicContact CD1-CB 3.93Å; Q538-L616 HydrophobicContact CG-CD1 3.98Å; Q538-L616 HydrophobicContact CG-CD2 4.45Å; A612-L616 PolarHBondContact O-N 3.08Å; M613-L616 WeakPolarHBondContact O-CB 3.42Å; M613-L616 PolarHBondContact O-N 2.86Å; M613-L616 VanDerWaalsContact O-N 3.1Å; Y614-L616 VanDerWaalsContact C-N 3.3Å; Y614-L616 PolarHBondContact O-N 2.94Å; L616-S618 VanDerWaalsContact C-N 3.35Å; L616-S618 PolarHBondContact O-N 2.73Å; L616-G619 PolarHBondContact O-N 3.44Å; L616-G619 VanDerWaalsContact O-N 3.17Å; L616-R620 PolarHBondContact O-N 2.88Å
617	I	92.2	Very high	90.9	Very high	15 Å²	15	58 Å²	58	8%	0.077	32%	0.319	C	S	.	.	H	α-helix	trans	-58.1	-47.3	-176.1	-60.6	172	0	0	0	110.7	L537 F559 K560 L563 M613 Y614 S615 G619 R620 D621	L537-I617 HydrophobicContact CD1-CG1 4.05Å; F559-I617 HydrophobicContact CE1-CD1 4.47Å; F559-I617 HydrophobicContact CE1-CG1 4.38Å; K560-I617 HydrophobicContact CD-CG2 3.71Å; K560-I617 HydrophobicContact CG-CG2 4.08Å; L563-I617 HydrophobicContact CD1-CD1 3.6Å; L563-I617 HydrophobicContact CD2-CD1 4.23Å; M613-I617 HydrophobicContact SD-CD1 4.18Å; M613-I617 HydrophobicContact SD-CG1 4.49Å; Y614-I617 HydrophobicContact CD2-CD1 4.03Å; Y614-I617 HydrophobicContact CE2-CD1 4.4Å; Y614-I617 HydrophobicContact CG-CD1 4.27Å; Y614-I617 PolarHBondContact O-N 3.36Å; S615-I617 VanDerWaalsContact C-N 3.34Å; I617-G619 VanDerWaalsContact C-N 3.34Å; I617-G619 PolarHBondContact O-N 2.88Å; I617-R620 PolarHBondContact O-N 2.86Å; I617-R620 VanDerWaalsContact O-N 3.16Å; I617-D621 PolarHBondContact O-N 2.87Å
618	S	91.7	Very high	91.1	Very high	75 Å²	75	56.3 Å²	56.3	52%	0.524	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-41	178.4	-167.7	0	0	0	0	112.3	L616 R620 D621 D622	L616-S618 VanDerWaalsContact C-N 3.35Å; L616-S618 PolarHBondContact O-N 2.73Å; S618-R620 VanDerWaalsContact C-N 3.3Å; S618-R620 PolarHBondContact O-N 3.03Å; S618-D621 PolarHBondContact O-N 2.78Å; S618-D622 PolarHBondContact O-N 3.08Å
619	G	91.2	Very high	91.2	Very high	43 Å²	43	57.1 Å²	57.1	44%	0.443	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-29.9	177.5	0	0	0	0	0	113	L616 I617 A623	L616-G619 PolarHBondContact O-N 3.44Å; L616-G619 VanDerWaalsContact O-N 3.17Å; I617-G619 VanDerWaalsContact C-N 3.34Å; I617-G619 PolarHBondContact O-N 2.88Å; G619-A623 WeakPolarHBondContact O-CB 3.4Å; G619-A623 PolarHBondContact O-N 3.28Å
620	R	91.9	Very high	91.3	Very high	35 Å²	35	57.5 Å²	57.5	13%	0.132	32%	0.317	C	S	.	.	H	α-helix	trans	-72.8	-41.9	173.8	-175.2	52	161.4	-141.3	7	112	L537 D539 L616 I617 S618 A623 L624	L537-R620 HydrophobicContact CD2-CB 3.91Å; L537-R620 HydrophobicContact CD2-CG 3.92Å; L537-R620 PolarHBondContact O-NH1 3.36Å; D539-R620 PolarHBondContact O-NH1 3.25Å; D539-R620 PolarHBondContact O-NH2 3.43Å; L616-R620 PolarHBondContact O-N 2.88Å; I617-R620 PolarHBondContact O-N 2.86Å; I617-R620 VanDerWaalsContact O-N 3.16Å; S618-R620 VanDerWaalsContact C-N 3.3Å; S618-R620 PolarHBondContact O-N 3.03Å; R620-A623 PolarHBondContact O-N 2.96Å; R620-L624 HydrophobicContact CG-CD1 4.13Å; R620-L624 WeakPolarHBondContact O-CG 3.39Å; R620-L624 PolarHBondContact O-N 2.91Å
621	D	91.7	Very high	91.2	Very high	36 Å²	36	57.6 Å²	57.6	19%	0.193	32%	0.318	C	S	.	.	H	α-helix	trans	-55.1	-51.9	170.5	-85.8	-37.5	0	0	0	110.1	H556 K560 I617 S618 A623 L624 H625	H556-D621 IonicContact CD2-OD1 2.63Å; H556-D621 PolarHBondContact CD2-OD1 2.99Å; H556-D621 IonicContact NE2-OD1 3.96Å; H556-D621 PolarHBondContact NE2-OD1 3.31Å; H556-D621 IonicContact NE2-OD2 2.69Å; K560-D621 IonicContact NZ-OD1 2.69Å; K560-D621 PolarHBondContact NZ-OD1 3.26Å; K560-D621 IonicContact NZ-OD2 2.71Å; K560-D621 PolarHBondContact NZ-OD2 3.26Å; I617-D621 PolarHBondContact O-N 2.87Å; S618-D621 PolarHBondContact O-N 2.78Å; D621-A623 PolarHBondContact O-N 3.35Å; D621-L624 PolarHBondContact O-N 3.13Å; D621-H625 PolarHBondContact O-N 2.88Å; D621-H625 PolarHBondContact O-ND1 2.7Å
622	D	92.1	Very high	91.3	Very high	91 Å²	91	58.2 Å²	58.2	49%	0.487	32%	0.318	S	S	.	.	H	α-helix	trans	-58.3	-45.1	179	-72.8	-31.9	0	0	0	112.8	S618 H625 Q626	S618-D622 PolarHBondContact O-N 3.08Å; D622-H625 PolarHBondContact O-N 3.49Å; D622-Q626 VanDerWaalsContact O-CG 3.31Å; D622-Q626 WeakPolarHBondContact O-CG 3.47Å; D622-Q626 PolarHBondContact O-N 3.27Å
623	A	91.2	Very high	91.4	Very high	37 Å²	37	61.1 Å²	61.1	31%	0.306	33%	0.325	S	S	.	.	H	α-helix	trans	-63.9	-41.1	179.8	0	0	0	0	0	112.8	F541 G619 R620 D621 Q626 E627	F541-A623 HydrophobicContact CZ-CB 4.44Å; G619-A623 WeakPolarHBondContact O-CB 3.4Å; G619-A623 PolarHBondContact O-N 3.28Å; R620-A623 PolarHBondContact O-N 2.96Å; D621-A623 PolarHBondContact O-N 3.35Å; A623-Q626 PolarHBondContact O-N 3Å; A623-E627 PolarHBondContact O-N 3.32Å; A623-E627 VanDerWaalsContact O-N 3.13Å
624	L	92.6	Very high	91.3	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-38.7	176.6	-72.8	169.2	0	0	0	111.8	F541 L552 I553 H556 R620 D621 L628	F541-L624 HydrophobicContact CE1-CD2 3.99Å; F541-L624 HydrophobicContact CE2-CD2 3.99Å; F541-L624 HydrophobicContact CZ-CD2 3.68Å; F541-L624 HydrophobicContact CZ-CG 4.24Å; L552-L624 HydrophobicContact CB-CD2 3.72Å; L552-L624 HydrophobicContact CD1-CD2 4.26Å; I553-L624 HydrophobicContact CG1-CB 3.93Å; I553-L624 HydrophobicContact CG1-CD1 4.44Å; H556-L624 HydrophobicContact CB-CD1 3.82Å; R620-L624 HydrophobicContact CG-CD1 4.13Å; R620-L624 WeakPolarHBondContact O-CG 3.39Å; R620-L624 PolarHBondContact O-N 2.91Å; D621-L624 PolarHBondContact O-N 3.13Å; L624-L628 WeakPolarHBondContact O-CB 3.35Å; L624-L628 PolarHBondContact O-N 3.38Å
625	H	92.6	Very high	91.3	Very high	96 Å²	96	58.5 Å²	58.5	44%	0.444	32%	0.32	S	S	.	.	H	α-helix	trans	-67.3	-38.7	175.1	-74.7	87.3	0	0	0	112.3	D621 D622 L628 V629	D621-H625 PolarHBondContact O-N 2.88Å; D621-H625 PolarHBondContact O-ND1 2.7Å; D622-H625 PolarHBondContact O-N 3.49Å; H625-L628 WeakPolarHBondContact O-CB 3.48Å; H625-L628 PolarHBondContact O-N 3.01Å; H625-V629 WeakPolarHBondContact O-CG2 3.27Å; H625-V629 PolarHBondContact O-N 3.1Å
626	Q	91.5	Very high	91.4	Very high	139 Å²	139	60.5 Å²	60.5	65%	0.65	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-45.6	175.7	-74.5	173.5	30.5	0	0	112.1	D622 A623 L628 V629 K630	D622-Q626 VanDerWaalsContact O-CG 3.31Å; D622-Q626 WeakPolarHBondContact O-CG 3.47Å; D622-Q626 PolarHBondContact O-N 3.27Å; A623-Q626 PolarHBondContact O-N 3Å; Q626-L628 VanDerWaalsContact C-N 3.33Å; Q626-V629 PolarHBondContact O-N 2.85Å; Q626-K630 PolarHBondContact O-N 3.45Å
627	E	90.1	Very high	91.5	Very high	29 Å²	29	58.8 Å²	58.8	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-68.3	-33.5	176.5	-169.9	62.7	-151	0	0	111.8	F541 V543 V549 A623 K630 Q631	F541-E627 HydrophobicContact CD2-CG 4.37Å; F541-E627 HydrophobicContact CE2-CB 3.71Å; F541-E627 HydrophobicContact CE2-CG 3.84Å; F541-E627 HydrophobicContact CZ-CB 4.43Å; V543-E627 HydrophobicContact CG2-CG 3.53Å; V549-E627 HydrophobicContact CG2-CG 4.18Å; A623-E627 PolarHBondContact O-N 3.32Å; A623-E627 VanDerWaalsContact O-N 3.13Å; E627-K630 PolarHBondContact O-N 2.9Å; E627-K630 IonicContact OE1-NZ 2.75Å; E627-K630 PolarHBondContact OE1-NZ 3.48Å; E627-K630 WeakPolarHBondContact OE2-CD 3.45Å; E627-K630 IonicContact OE2-NZ 2.74Å; E627-K630 PolarHBondContact OE2-NZ 3.41Å; E627-Q631 HydrophobicContact CG-CG 4.37Å; E627-Q631 WeakPolarHBondContact O-CG 3.21Å; E627-Q631 PolarHBondContact O-N 3.02Å; E627-Q631 PolarHBondContact OE1-NE2 3.22Å
628	L	92.4	Very high	91.5	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-47.9	172.8	-176.7	67.8	0	0	0	111.3	V546 V549 M550 I553 L624 H625 Q626 K630 Q631 Q632	V546-L628 HydrophobicContact CG1-CD1 3.96Å; V549-L628 HydrophobicContact CB-CD1 4.11Å; V549-L628 HydrophobicContact CG1-CB 3.75Å; V549-L628 HydrophobicContact CG1-CD1 3.94Å; V549-L628 HydrophobicContact CG1-CG 4.45Å; M550-L628 HydrophobicContact CG-CD1 4.24Å; I553-L628 HydrophobicContact CD1-CB 4.19Å; I553-L628 HydrophobicContact CD1-CD1 4.38Å; I553-L628 HydrophobicContact CD1-CD2 3.82Å; I553-L628 HydrophobicContact CD1-CG 4.35Å; L624-L628 WeakPolarHBondContact O-CB 3.35Å; L624-L628 PolarHBondContact O-N 3.38Å; H625-L628 WeakPolarHBondContact O-CB 3.48Å; H625-L628 PolarHBondContact O-N 3.01Å; Q626-L628 VanDerWaalsContact C-N 3.33Å; L628-K630 VanDerWaalsContact C-N 3.33Å; L628-K630 PolarHBondContact O-N 2.88Å; L628-Q631 PolarHBondContact O-N 3.44Å; L628-Q632 HydrophobicContact CD1-CG 4.49Å; L628-Q632 HydrophobicContact CG-CG 4.48Å; L628-Q632 WeakPolarHBondContact O-CB 3.35Å; L628-Q632 VanDerWaalsContact O-CG 3.23Å; L628-Q632 WeakPolarHBondContact O-CG 3.48Å; L628-Q632 PolarHBondContact O-N 2.97Å
629	V	92.6	Very high	91.6	Very high	89 Å²	89	56.9 Å²	56.9	54%	0.539	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-43.8	177	169.9	0	0	0	0	110.8	H625 Q626 Q632 E633	H625-V629 WeakPolarHBondContact O-CG2 3.27Å; H625-V629 PolarHBondContact O-N 3.1Å; Q626-V629 PolarHBondContact O-N 2.85Å; V629-Q632 PolarHBondContact O-N 2.97Å; V629-E633 PolarHBondContact O-N 2.88Å
630	K	89.4	Confident	91.8	Very high	99 Å²	99	58.4 Å²	58.4	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-46.6	176.2	172	176.2	156.6	-122.9	0	112.6	Q626 E627 L628 E633 N634	Q626-K630 PolarHBondContact O-N 3.45Å; E627-K630 PolarHBondContact O-N 2.9Å; E627-K630 IonicContact OE1-NZ 2.75Å; E627-K630 PolarHBondContact OE1-NZ 3.48Å; E627-K630 WeakPolarHBondContact OE2-CD 3.45Å; E627-K630 IonicContact OE2-NZ 2.74Å; E627-K630 PolarHBondContact OE2-NZ 3.41Å; L628-K630 VanDerWaalsContact C-N 3.33Å; L628-K630 PolarHBondContact O-N 2.88Å; K630-E633 PolarHBondContact O-N 2.77Å; K630-N634 VanDerWaalsContact O-CG 3.31Å; K630-N634 PolarHBondContact O-N 3.49Å
631	Q	89.9	Confident	92	Very high	10 Å²	10	57 Å²	57	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-71	-31.2	179	-63.9	-57.6	-24.9	0	0	112.6	V543 V546 V549 E627 L628 N634 D635	V543-Q631 PolarHBondContact O-NE2 3.18Å; V546-Q631 HydrophobicContact CG2-CB 4.1Å; V549-Q631 HydrophobicContact CG2-CB 4.18Å; V549-Q631 HydrophobicContact CG2-CG 3.77Å; E627-Q631 HydrophobicContact CG-CG 4.37Å; E627-Q631 WeakPolarHBondContact O-CG 3.21Å; E627-Q631 PolarHBondContact O-N 3.02Å; E627-Q631 PolarHBondContact OE1-NE2 3.22Å; L628-Q631 PolarHBondContact O-N 3.44Å; Q631-N634 PolarHBondContact O-N 3.41Å; Q631-N634 PolarHBondContact OE1-ND2 2.88Å; Q631-D635 PolarHBondContact O-N 3.17Å
632	Q	91.3	Very high	92.1	Very high	99 Å²	99	55.4 Å²	55.4	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-37.3	169.3	-74	173.2	-7.9	0	0	112.1	V546 L628 V629 K636	V546-Q632 HydrophobicContact CG1-CG 4.27Å; V546-Q632 HydrophobicContact CG2-CG 4.44Å; L628-Q632 HydrophobicContact CD1-CG 4.49Å; L628-Q632 HydrophobicContact CG-CG 4.48Å; L628-Q632 WeakPolarHBondContact O-CB 3.35Å; L628-Q632 VanDerWaalsContact O-CG 3.23Å; L628-Q632 WeakPolarHBondContact O-CG 3.48Å; L628-Q632 PolarHBondContact O-N 2.97Å; V629-Q632 PolarHBondContact O-N 2.97Å; Q632-K636 VanDerWaalsContact O-CB 3.25Å; Q632-K636 WeakPolarHBondContact O-CB 3.48Å; Q632-K636 PolarHBondContact O-N 3.3Å
633	E	91	Very high	92.3	Very high	100 Å²	100	57.2 Å²	57.2	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-40.3	173.4	-173	165.4	-160.9	0	0	111.9	V629 K630 K636 V637 F704	V629-E633 PolarHBondContact O-N 2.88Å; K630-E633 PolarHBondContact O-N 2.77Å; E633-K636 WeakPolarHBondContact O-CB 3.5Å; E633-K636 PolarHBondContact O-N 3.47Å; E633-V637 WeakPolarHBondContact O-CG2 3.42Å; E633-V637 PolarHBondContact O-N 3.29Å; E633-F704 HydrophobicContact CG-CE2 4Å; E633-F704 HydrophobicContact CG-CZ 4.4Å
634	N	90.9	Very high	92.5	Very high	17 Å²	17	57.3 Å²	57.3	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-50.7	173.2	-71.3	-14.4	0	0	0	112	K630 Q631 K636 V637 N638 F704 I706	K630-N634 VanDerWaalsContact O-CG 3.31Å; K630-N634 PolarHBondContact O-N 3.49Å; Q631-N634 PolarHBondContact O-N 3.41Å; Q631-N634 PolarHBondContact OE1-ND2 2.88Å; N634-K636 VanDerWaalsContact C-N 3.32Å; N634-K636 PolarHBondContact O-N 3.47Å; N634-V637 PolarHBondContact O-N 3.14Å; N634-N638 PolarHBondContact O-N 3.3Å; N634-F704 WeakPolarHBondContact OD1-CB 3.15Å; N634-F704 WeakPolarHBondContact OD1-CD2 3.44Å; N634-I706 HydrophobicContact CB-CD1 3.68Å; N634-I706 HydrophobicContact CB-CG1 4.23Å
635	D	90.3	Very high	92.7	Very high	64 Å²	64	57.2 Å²	57.2	34%	0.342	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-35.6	178.3	-176.9	59.6	0	0	0	112.2	V546 Q631 N638 T639 H711	V546-D635 HydrophobicContact CG2-CB 4.24Å; Q631-D635 PolarHBondContact O-N 3.17Å; D635-N638 PolarHBondContact O-N 3.15Å; D635-T639 VanDerWaalsContact O-CB 3.3Å; D635-T639 WeakPolarHBondContact O-CB 3.37Å; D635-T639 PolarHBondContact O-N 3.18Å; D635-T639 PolarHBondContact O-OG1 2.93Å; D635-H711 IonicContact OD1-CD2 3.5Å; D635-H711 IonicContact OD1-CE1 3.55Å; D635-H711 IonicContact OD1-NE2 3.43Å; D635-H711 PolarHBondContact OD1-NE2 3.03Å
636	K	92.2	Very high	92.8	Very high	126 Å²	126	56.1 Å²	56.1	55%	0.548	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-45.3	172.6	-179.7	-175.7	177.5	-173.7	0	112	Q632 E633 N634 T639 Q640	Q632-K636 VanDerWaalsContact O-CB 3.25Å; Q632-K636 WeakPolarHBondContact O-CB 3.48Å; Q632-K636 PolarHBondContact O-N 3.3Å; E633-K636 WeakPolarHBondContact O-CB 3.5Å; E633-K636 PolarHBondContact O-N 3.47Å; N634-K636 VanDerWaalsContact C-N 3.32Å; N634-K636 PolarHBondContact O-N 3.47Å; K636-T639 PolarHBondContact O-N 2.92Å; K636-Q640 WeakPolarHBondContact O-CB 3.48Å; K636-Q640 VanDerWaalsContact O-CG 3.28Å; K636-Q640 WeakPolarHBondContact O-CG 3.23Å; K636-Q640 PolarHBondContact O-N 3.35Å
637	V	93	Very high	93	Very high	5 Å²	5	56 Å²	56	3%	0.03	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-43.3	176	172.8	0	0	0	0	110.8	E633 N634 T639 Q640 F641 L697 K700 Q701 F704	E633-V637 WeakPolarHBondContact O-CG2 3.42Å; E633-V637 PolarHBondContact O-N 3.29Å; N634-V637 PolarHBondContact O-N 3.14Å; V637-T639 PolarHBondContact O-N 3.5Å; V637-Q640 PolarHBondContact O-N 2.85Å; V637-F641 WeakPolarHBondContact O-CB 3.38Å; V637-F641 PolarHBondContact O-N 2.94Å; V637-L697 HydrophobicContact CG1-CD2 4.33Å; V637-K700 HydrophobicContact CG1-CB 4.04Å; V637-K700 HydrophobicContact CG2-CD 4.43Å; V637-Q701 HydrophobicContact CG1-CG 3.8Å; V637-F704 HydrophobicContact CG2-CD2 4.32Å; V637-F704 HydrophobicContact CG2-CE2 3.94Å
638	N	92.5	Very high	93.2	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-46.2	174.4	-96.6	-12.4	0	0	0	112.1	N634 D635 F641 A642 Q701 I706 H708 N709	N634-N638 PolarHBondContact O-N 3.3Å; D635-N638 PolarHBondContact O-N 3.15Å; N638-F641 PolarHBondContact O-N 3.23Å; N638-A642 VanDerWaalsContact O-CB 3.27Å; N638-A642 WeakPolarHBondContact O-CB 3.32Å; N638-A642 PolarHBondContact O-N 3.48Å; N638-Q701 PolarHBondContact OD1-NE2 3.19Å; N638-I706 WeakPolarHBondContact ND2-CG2 3.25Å; N638-I706 WeakPolarHBondContact OD1-CG2 3.47Å; N638-H708 PolarHBondContact ND2-O 2.85Å; N638-H708 VanDerWaalsContact ND2-O 3.14Å; N638-N709 VanDerWaalsContact CG-CG 3.5Å; N638-N709 PolarHBondContact O-ND2 2.86Å; N638-N709 WeakPolarHBondContact OD1-CB 3.41Å; N638-N709 VanDerWaalsContact OD1-CG 3.3Å; N638-N709 PolarHBondContact OD1-ND2 2.86Å
639	T	93.5	Very high	93.3	Very high	40 Å²	40	53.5 Å²	53.5	25%	0.245	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-43.9	177.5	-63	0	0	0	0	111.5	D635 K636 V637 A642 Q643	D635-T639 VanDerWaalsContact O-CB 3.3Å; D635-T639 WeakPolarHBondContact O-CB 3.37Å; D635-T639 PolarHBondContact O-N 3.18Å; D635-T639 PolarHBondContact O-OG1 2.93Å; K636-T639 PolarHBondContact O-N 2.92Å; V637-T639 PolarHBondContact O-N 3.5Å; T639-A642 PolarHBondContact O-N 3.04Å; T639-Q643 WeakPolarHBondContact O-CB 3.33Å; T639-Q643 VanDerWaalsContact O-CG 3.27Å; T639-Q643 WeakPolarHBondContact O-CG 3.45Å; T639-Q643 PolarHBondContact O-N 3.36Å
640	Q	94.7	Very high	93.4	Very high	75 Å²	75	52 Å²	52	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-45.6	176.6	-75.6	178.8	-24.6	0	0	112.1	K636 V637 A642 Q643 L644 L697	K636-Q640 WeakPolarHBondContact O-CB 3.48Å; K636-Q640 VanDerWaalsContact O-CG 3.28Å; K636-Q640 WeakPolarHBondContact O-CG 3.23Å; K636-Q640 PolarHBondContact O-N 3.35Å; V637-Q640 PolarHBondContact O-N 2.85Å; Q640-A642 PolarHBondContact O-N 2.81Å; Q640-Q643 PolarHBondContact O-N 3.4Å; Q640-L644 PolarHBondContact O-N 3.33Å; Q640-L697 HydrophobicContact CB-CD1 4.11Å; Q640-L697 HydrophobicContact CB-CD2 4Å
641	F	95.7	Very high	93.7	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-59.7	-47.7	175.3	-178.8	-86.2	0	0	0	110.7	V637 N638 Q643 L644 A645 L694 L697 H698 T712 M716 L719	V637-F641 WeakPolarHBondContact O-CB 3.38Å; V637-F641 PolarHBondContact O-N 2.94Å; N638-F641 PolarHBondContact O-N 3.23Å; F641-Q643 PolarHBondContact O-N 3.39Å; F641-L644 PolarHBondContact O-N 3.28Å; F641-A645 HydrophobicContact CD1-CB 4.21Å; F641-A645 HydrophobicContact CE1-CB 3.97Å; F641-A645 WeakPolarHBondContact O-CB 3.36Å; F641-A645 PolarHBondContact O-N 3.46Å; F641-L694 HydrophobicContact CD2-CD2 3.74Å; F641-L694 HydrophobicContact CE2-CB 4.41Å; F641-L694 HydrophobicContact CE2-CD2 3.66Å; F641-L694 HydrophobicContact CG-CD2 4.26Å; F641-L694 HydrophobicContact CZ-CD2 4.13Å; F641-L697 HydrophobicContact CB-CB 4.27Å; F641-L697 HydrophobicContact CD2-CB 4.04Å; F641-H698 HydrophobicContact CE2-CB 4.09Å; F641-T712 HydrophobicContact CD1-CG2 4.09Å; F641-T712 HydrophobicContact CE1-CG2 4.2Å; F641-M716 HydrophobicContact CE2-CB 4.33Å; F641-M716 HydrophobicContact CE2-SD 3.92Å; F641-M716 HydrophobicContact CZ-CB 4.11Å; F641-M716 HydrophobicContact CZ-SD 4.16Å; F641-L719 HydrophobicContact CZ-CD1 4.34Å
642	A	95.4	Very high	93.9	Very high	3 Å²	3	49 Å²	49	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-38.3	-179.4	0	0	0	0	0	113.2	N638 T639 Q640 L644 A645 N646 H711 T712	N638-A642 VanDerWaalsContact O-CB 3.27Å; N638-A642 WeakPolarHBondContact O-CB 3.32Å; N638-A642 PolarHBondContact O-N 3.48Å; T639-A642 PolarHBondContact O-N 3.04Å; Q640-A642 PolarHBondContact O-N 2.81Å; A642-L644 PolarHBondContact O-N 3.33Å; A642-A645 PolarHBondContact O-N 3.44Å; A642-N646 WeakPolarHBondContact O-CB 3.27Å; A642-N646 PolarHBondContact O-N 3.45Å; A642-N646 PolarHBondContact O-ND2 3.44Å; A642-N646 VanDerWaalsContact O-ND2 3.11Å; A642-H711 HydrophobicContact CB-CB 3.44Å; A642-H711 VanDerWaalsContact CB-CB 3.44Å; A642-T712 HydrophobicContact CB-CG2 3.92Å
643	Q	95.5	Very high	93.9	Very high	130 Å²	130	48.3 Å²	48.3	61%	0.607	23%	0.232	S	C	*	.	H	α-helix	trans	-61.1	-43	175.8	-77.1	172.6	2.6	0	0	112.4	T639 Q640 F641	T639-Q643 WeakPolarHBondContact O-CB 3.33Å; T639-Q643 VanDerWaalsContact O-CG 3.27Å; T639-Q643 WeakPolarHBondContact O-CG 3.45Å; T639-Q643 PolarHBondContact O-N 3.36Å; Q640-Q643 PolarHBondContact O-N 3.4Å; F641-Q643 PolarHBondContact O-N 3.39Å
644	L	95.5	Very high	94.1	Very high	39 Å²	39	49 Å²	49	20%	0.204	24%	0.235	C	C	.	.	H	α-helix	trans	-72.4	-44.1	176.1	-65.2	-176.7	0	0	0	111.5	Q640 F641 A642 R647 F648 T690 E693 L694 L697	Q640-L644 PolarHBondContact O-N 3.33Å; F641-L644 PolarHBondContact O-N 3.28Å; A642-L644 PolarHBondContact O-N 3.33Å; L644-R647 PolarHBondContact O-N 3.48Å; L644-F648 WeakPolarHBondContact O-CB 3.28Å; L644-F648 PolarHBondContact O-N 3.5Å; L644-T690 HydrophobicContact CB-CG2 4.38Å; L644-T690 HydrophobicContact CD2-CG2 4.35Å; L644-E693 HydrophobicContact CD1-CB 4.15Å; L644-E693 HydrophobicContact CD1-CG 4.03Å; L644-L694 HydrophobicContact CB-CD1 4.44Å; L644-L694 HydrophobicContact CB-CD2 3.7Å; L644-L694 HydrophobicContact CB-CG 3.97Å; L644-L694 HydrophobicContact CD1-CG 4.41Å; L644-L697 HydrophobicContact CD1-CD1 3.84Å
645	A	95.8	Very high	94.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-46.3	-179.1	0	0	0	0	0	112.6	F641 A642 R647 F648 G649 L694 L719	F641-A645 HydrophobicContact CD1-CB 4.21Å; F641-A645 HydrophobicContact CE1-CB 3.97Å; F641-A645 WeakPolarHBondContact O-CB 3.36Å; F641-A645 PolarHBondContact O-N 3.46Å; A642-A645 PolarHBondContact O-N 3.44Å; A645-R647 PolarHBondContact O-N 2.66Å; A645-F648 PolarHBondContact O-N 2.95Å; A645-G649 PolarHBondContact O-N 2.83Å; A645-L694 HydrophobicContact CB-CD2 4.2Å; A645-L719 HydrophobicContact CB-CD1 3.78Å
646	N	95.7	Very high	94.3	Very high	72 Å²	72	47.9 Å²	47.9	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-69.1	-15.3	177.8	-69.1	-33.4	0	0	0	113.1	A642 P650 H711 T712	A642-N646 WeakPolarHBondContact O-CB 3.27Å; A642-N646 PolarHBondContact O-N 3.45Å; A642-N646 PolarHBondContact O-ND2 3.44Å; A642-N646 VanDerWaalsContact O-ND2 3.11Å; N646-P650 VanDerWaalsContact O-CD 3.26Å; N646-P650 WeakPolarHBondContact O-CD 3.43Å; N646-P650 WeakPolarHBondContact O-CG 3.14Å; N646-H711 PolarHBondContact ND2-O 2.81Å; N646-T712 PolarHBondContact OD1-OG1 3.04Å
647	R	94.6	Very high	94.3	Very high	138 Å²	138	48.6 Å²	48.6	52%	0.521	23%	0.234	S	C	.	.	H	α-helix	trans	-87.6	-38.3	171.1	-165.7	-176.1	68	178.8	2.4	112	L644 A645 W687 T690	L644-R647 PolarHBondContact O-N 3.48Å; A645-R647 PolarHBondContact O-N 2.66Å; R647-W687 HydrophobicContact CG-CH2 3.97Å; R647-W687 HydrophobicContact CG-CZ3 4.4Å; R647-T690 PolarHBondContact NH2-OG1 3.19Å
648	F	95.3	Very high	94.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-87.4	-38.7	-172.9	-178.9	-129.7	0	0	0	113.4	L644 A645 Y651 L652 W687 I691 L694 L719 W723	L644-F648 WeakPolarHBondContact O-CB 3.28Å; L644-F648 PolarHBondContact O-N 3.5Å; A645-F648 PolarHBondContact O-N 2.95Å; F648-Y651 HydrophobicContact CD2-CD1 4.28Å; F648-Y651 HydrophobicContact CE2-CD1 4.41Å; F648-Y651 WeakPolarHBondContact O-CB 3.03Å; F648-Y651 PolarHBondContact O-N 3.48Å; F648-Y651 VanDerWaalsContact O-N 3.13Å; F648-L652 HydrophobicContact CD1-CD1 4.08Å; F648-L652 HydrophobicContact CD2-CG 4.29Å; F648-L652 HydrophobicContact CE1-CD1 3.76Å; F648-L652 HydrophobicContact CE1-CG 4.36Å; F648-L652 HydrophobicContact CE2-CD1 4.32Å; F648-L652 HydrophobicContact CE2-CD2 3.89Å; F648-L652 HydrophobicContact CE2-CG 4.03Å; F648-L652 HydrophobicContact CZ-CD1 3.9Å; F648-L652 HydrophobicContact CZ-CD2 3.92Å; F648-L652 HydrophobicContact CZ-CG 4.08Å; F648-L652 WeakPolarHBondContact O-CG 3.18Å; F648-L652 PolarHBondContact O-N 3.43Å; F648-W687 HydrophobicContact CB-CE3 4.36Å; F648-W687 HydrophobicContact CB-CZ3 4.17Å; F648-W687 HydrophobicContact CD2-CB 4.4Å; F648-W687 AromaticContact CD2-CD2 3.95Å; F648-W687 HydrophobicContact CD2-CD2 3.95Å; F648-W687 AromaticContact CD2-CE3 3.54Å; F648-W687 HydrophobicContact CD2-CE3 3.54Å; F648-W687 HydrophobicContact CD2-CG 4.3Å; F648-W687 HydrophobicContact CD2-CZ3 4.12Å; F648-W687 HydrophobicContact CE2-CB 3.91Å; F648-W687 HydrophobicContact CE2-CD2 4.31Å; F648-W687 HydrophobicContact CE2-CE3 4.22Å; F648-W687 HydrophobicContact CE2-CG 4.18Å; F648-W687 HydrophobicContact CG-CE3 4.28Å; F648-I691 HydrophobicContact CE1-CB 4.29Å; F648-I691 HydrophobicContact CE1-CD1 4.37Å; F648-I691 HydrophobicContact CE1-CG1 4.46Å; F648-I691 HydrophobicContact CZ-CB 4.34Å; F648-I691 HydrophobicContact CZ-CD1 4.47Å; F648-L694 HydrophobicContact CB-CD1 4.49Å; F648-L694 HydrophobicContact CD1-CD1 3.69Å; F648-L694 HydrophobicContact CE1-CD1 4.3Å; F648-L694 HydrophobicContact CG-CD1 4.42Å; F648-L719 HydrophobicContact CD1-CB 4.35Å; F648-L719 HydrophobicContact CD1-CD1 4.41Å; F648-L719 HydrophobicContact CD1-CD2 4.06Å; F648-L719 HydrophobicContact CE1-CB 4.3Å; F648-W723 AromaticContact CE2-CE3 3.97Å; F648-W723 HydrophobicContact CE2-CE3 3.97Å; F648-W723 HydrophobicContact CE2-CZ3 4.22Å; F648-W723 HydrophobicContact CZ-CB 4.44Å; F648-W723 HydrophobicContact CZ-CD2 4.33Å; F648-W723 AromaticContact CZ-CE3 3.53Å; F648-W723 HydrophobicContact CZ-CE3 3.53Å; F648-W723 HydrophobicContact CZ-CZ3 4.1Å
649	G	94.5	Very high	94.2	Very high	2 Å²	2	49.5 Å²	49.5	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-56.5	-50.8	178.1	0	0	0	0	0	113.7	A645 Y651 L652 E653	A645-G649 PolarHBondContact O-N 2.83Å; G649-Y651 VanDerWaalsContact C-N 3.28Å; G649-Y651 PolarHBondContact O-N 2.94Å; G649-L652 WeakPolarHBondContact O-CB 3.48Å; G649-L652 PolarHBondContact O-N 3.21Å; G649-E653 PolarHBondContact O-N 2.97Å
650	P	94.7	Very high	94.1	Very high	57 Å²	57	53.9 Å²	53.9	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-29.3	175.2	-24.5	36.1	0	0	0	113.8	N646 H654 Y714	N646-P650 VanDerWaalsContact O-CD 3.26Å; N646-P650 WeakPolarHBondContact O-CD 3.43Å; N646-P650 WeakPolarHBondContact O-CG 3.14Å; P650-H654 WeakPolarHBondContact O-CB 3.34Å; P650-H654 PolarHBondContact O-N 3.49Å; P650-Y714 WeakPolarHBondContact CD-OH 3.34Å; P650-Y714 HydrophobicContact CG-CE2 4.43Å
651	Y	94.9	Very high	93.9	Very high	42 Å²	42	53.2 Å²	53.2	17%	0.165	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-42.8	172.8	170.7	-87.2	0	0	0	111.2	F648 G649 N655 L684 W687	F648-Y651 HydrophobicContact CD2-CD1 4.28Å; F648-Y651 HydrophobicContact CE2-CD1 4.41Å; F648-Y651 WeakPolarHBondContact O-CB 3.03Å; F648-Y651 PolarHBondContact O-N 3.48Å; F648-Y651 VanDerWaalsContact O-N 3.13Å; G649-Y651 VanDerWaalsContact C-N 3.28Å; G649-Y651 PolarHBondContact O-N 2.94Å; Y651-N655 VanDerWaalsContact CD2-ND2 3.3Å; Y651-N655 WeakPolarHBondContact CD2-ND2 3.33Å; Y651-N655 WeakPolarHBondContact CE2-ND2 3.49Å; Y651-N655 VanDerWaalsContact CZ-ND2 3.32Å; Y651-N655 WeakPolarHBondContact O-CB 3.38Å; Y651-N655 PolarHBondContact O-N 3.48Å; Y651-N655 PolarHBondContact O-ND2 2.78Å; Y651-L684 HydrophobicContact CE1-CD1 4.09Å; Y651-W687 HydrophobicContact CD1-CD2 4.47Å; Y651-W687 HydrophobicContact CD1-CG 4.5Å; Y651-W687 AromaticContact CD1-NE1 3.9Å; Y651-W687 HydrophobicContact CD2-CZ2 4.04Å; Y651-W687 AromaticContact CD2-NE1 3.7Å; Y651-W687 AromaticContact CE1-CD1 3.5Å; Y651-W687 HydrophobicContact CE1-CG 4.18Å; Y651-W687 AromaticContact CE1-NE1 3.55Å; Y651-W687 HydrophobicContact CE2-CZ2 4.47Å; Y651-W687 AromaticContact CE2-NE1 3.31Å; Y651-W687 VanDerWaalsContact CE2-NE1 3.31Å; Y651-W687 HydrophobicContact CG-CZ2 4.15Å; Y651-W687 AromaticContact CG-NE1 3.98Å; Y651-W687 AromaticContact CZ-CD1 3.46Å; Y651-W687 VanDerWaalsContact CZ-CD1 3.46Å; Y651-W687 AromaticContact CZ-NE1 3.24Å
652	L	93.8	Very high	93.6	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-49.8	174.9	-67.2	174	0	0	0	111.3	F648 G649 H654 N655 L656 L684 L719 W723 L726	F648-L652 HydrophobicContact CD1-CD1 4.08Å; F648-L652 HydrophobicContact CD2-CG 4.29Å; F648-L652 HydrophobicContact CE1-CD1 3.76Å; F648-L652 HydrophobicContact CE1-CG 4.36Å; F648-L652 HydrophobicContact CE2-CD1 4.32Å; F648-L652 HydrophobicContact CE2-CD2 3.89Å; F648-L652 HydrophobicContact CE2-CG 4.03Å; F648-L652 HydrophobicContact CZ-CD1 3.9Å; F648-L652 HydrophobicContact CZ-CD2 3.92Å; F648-L652 HydrophobicContact CZ-CG 4.08Å; F648-L652 WeakPolarHBondContact O-CG 3.18Å; F648-L652 PolarHBondContact O-N 3.43Å; G649-L652 WeakPolarHBondContact O-CB 3.48Å; G649-L652 PolarHBondContact O-N 3.21Å; L652-H654 PolarHBondContact O-N 3.3Å; L652-N655 PolarHBondContact O-N 3.13Å; L652-L656 VanDerWaalsContact O-CG 3.29Å; L652-L656 WeakPolarHBondContact O-CG 3.38Å; L652-L656 PolarHBondContact O-N 2.88Å; L652-L684 HydrophobicContact CD2-CD1 4.49Å; L652-L719 HydrophobicContact CD1-CD2 4.26Å; L652-W723 HydrophobicContact CD2-CB 4.31Å; L652-W723 HydrophobicContact CD2-CE3 4.48Å; L652-L726 HydrophobicContact CD2-CD2 3.84Å
653	E	93.1	Very high	93.2	Very high	84 Å²	84	54 Å²	54	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-53.5	-51.1	176.9	-73.6	169	-151	0	0	111.3	G649 N655 L656 E657 R713 Y714	G649-E653 PolarHBondContact O-N 2.97Å; E653-N655 PolarHBondContact O-N 3.32Å; E653-L656 PolarHBondContact O-N 3.45Å; E653-E657 PolarHBondContact O-N 3.1Å; E653-R713 IonicContact OE1-CZ 3.29Å; E653-R713 IonicContact OE1-NH2 2.95Å; E653-R713 PolarHBondContact OE1-NH2 2.73Å; E653-R713 IonicContact OE2-NH2 2.66Å; E653-R713 PolarHBondContact OE2-NH2 3.1Å; E653-Y714 WeakPolarHBondContact OE1-CE1 3.5Å; E653-Y714 VanDerWaalsContact OE1-CZ 3.26Å; E653-Y714 PolarHBondContact OE1-OH 2.72Å
654	H	94.4	Very high	92.7	Very high	116 Å²	116	51.6 Å²	51.6	54%	0.537	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-37.9	-179.4	-178.2	53.1	0	0	0	113.7	P650 L652 E657 T658	P650-H654 WeakPolarHBondContact O-CB 3.34Å; P650-H654 PolarHBondContact O-N 3.49Å; L652-H654 PolarHBondContact O-N 3.3Å; H654-E657 PolarHBondContact O-N 2.93Å; H654-T658 WeakPolarHBondContact O-CB 3.37Å; H654-T658 PolarHBondContact O-N 2.82Å; H654-T658 PolarHBondContact O-OG1 3.13Å
655	N	93.6	Very high	92	Very high	14 Å²	14	52.3 Å²	52.3	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-75.8	-29.8	-179.7	-79.5	-81.1	0	0	0	112.7	Y651 L652 E653 E657 T658 V659 V680 L726	Y651-N655 VanDerWaalsContact CD2-ND2 3.3Å; Y651-N655 WeakPolarHBondContact CD2-ND2 3.33Å; Y651-N655 WeakPolarHBondContact CE2-ND2 3.49Å; Y651-N655 VanDerWaalsContact CZ-ND2 3.32Å; Y651-N655 WeakPolarHBondContact O-CB 3.38Å; Y651-N655 PolarHBondContact O-N 3.48Å; Y651-N655 PolarHBondContact O-ND2 2.78Å; L652-N655 PolarHBondContact O-N 3.13Å; E653-N655 PolarHBondContact O-N 3.32Å; N655-E657 VanDerWaalsContact C-N 3.35Å; N655-T658 PolarHBondContact O-N 3.35Å; N655-V659 WeakPolarHBondContact O-CG2 3.47Å; N655-V659 PolarHBondContact O-N 3.19Å; N655-V680 HydrophobicContact CB-CG1 4.5Å; N655-L726 HydrophobicContact CB-CD1 3.94Å; N655-L726 HydrophobicContact CB-CD2 3.6Å; N655-L726 HydrophobicContact CB-CG 4.45Å
656	L	91.9	Very high	91	Very high	43 Å²	43	60.4 Å²	60.4	23%	0.225	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-44.7	170.9	-75	165.9	0	0	0	111.4	L652 E653 H660 Q725 L726 N729	L652-L656 VanDerWaalsContact O-CG 3.29Å; L652-L656 WeakPolarHBondContact O-CG 3.38Å; L652-L656 PolarHBondContact O-N 2.88Å; E653-L656 PolarHBondContact O-N 3.45Å; L656-H660 PolarHBondContact O-N 3.21Å; L656-Q725 HydrophobicContact CD2-CB 4.24Å; L656-Q725 HydrophobicContact CD2-CG 3.81Å; L656-L726 HydrophobicContact CD2-CB 3.88Å; L656-L726 HydrophobicContact CD2-CD1 4.15Å; L656-L726 HydrophobicContact CG-CB 4.28Å; L656-L726 HydrophobicContact CG-CD1 4.33Å; L656-N729 WeakPolarHBondContact CD2-ND2 3.26Å
657	E	91.5	Very high	90.1	Very high	141 Å²	141	66.4 Å²	66.4	66%	0.659	32%	0.324	S	S	*	.	H	α-helix	trans	-65.1	-42.2	172.3	-65.6	-178.6	166.7	0	0	112	E653 H654 N655 H660 S661	E653-E657 PolarHBondContact O-N 3.1Å; H654-E657 PolarHBondContact O-N 2.93Å; N655-E657 VanDerWaalsContact C-N 3.35Å; E657-H660 PolarHBondContact O-N 3.39Å; E657-S661 PolarHBondContact O-N 2.96Å
658	T	92.4	Very high	89.3	Confident	31 Å²	31	61.3 Å²	61.3	19%	0.19	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-44.7	-177.7	-61.9	0	0	0	0	112	H654 N655 H660 S661 I662	H654-T658 WeakPolarHBondContact O-CB 3.37Å; H654-T658 PolarHBondContact O-N 2.82Å; H654-T658 PolarHBondContact O-OG1 3.13Å; N655-T658 PolarHBondContact O-N 3.35Å; T658-H660 PolarHBondContact O-N 2.95Å; T658-S661 WeakPolarHBondContact O-CB 3.24Å; T658-S661 PolarHBondContact O-N 3Å; T658-S661 VanDerWaalsContact O-N 3.13Å; T658-S661 PolarHBondContact O-OG 3.41Å; T658-I662 HydrophobicContact CG2-CD1 3.89Å; T658-I662 HydrophobicContact CG2-CG1 4.45Å; T658-I662 WeakPolarHBondContact O-CG1 3.36Å; T658-I662 PolarHBondContact O-N 3.45Å
659	V	91.9	Very high	88.7	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-46.5	176.6	168.9	0	0	0	0	110.9	N655 S661 I662 V663 L677 V680 L726 N729 I730	N655-V659 WeakPolarHBondContact O-CG2 3.47Å; N655-V659 PolarHBondContact O-N 3.19Å; V659-S661 VanDerWaalsContact C-N 3.3Å; V659-S661 PolarHBondContact O-N 2.87Å; V659-I662 PolarHBondContact O-N 3.4Å; V659-I662 VanDerWaalsContact O-N 3.16Å; V659-V663 WeakPolarHBondContact O-CG2 3.3Å; V659-V663 PolarHBondContact O-N 3.34Å; V659-V663 VanDerWaalsContact O-N 3.15Å; V659-L677 HydrophobicContact CB-CD2 4.35Å; V659-L677 HydrophobicContact CG1-CD2 3.98Å; V659-L677 HydrophobicContact CG2-CD2 4.18Å; V659-V680 HydrophobicContact CG2-CG1 3.99Å; V659-L726 HydrophobicContact CG2-CD1 3.83Å; V659-N729 HydrophobicContact CG1-CB 4.07Å; V659-I730 HydrophobicContact CG2-CG1 3.68Å
660	H	90.1	Very high	88.3	Confident	132 Å²	132	64.3 Å²	64.3	61%	0.611	33%	0.326	S	S	*	.	H	α-helix	trans	-60.6	-40.2	175.1	-176	69	0	0	0	112	L656 E657 T658 I662 T664	L656-H660 PolarHBondContact O-N 3.21Å; E657-H660 PolarHBondContact O-N 3.39Å; T658-H660 PolarHBondContact O-N 2.95Å; H660-I662 VanDerWaalsContact C-N 3.33Å; H660-I662 PolarHBondContact O-N 3.3Å; H660-T664 WeakPolarHBondContact O-CG2 3.22Å; H660-T664 PolarHBondContact O-N 3.49Å; H660-T664 PolarHBondContact O-OG1 3.43Å
661	S	90.6	Very high	87.9	Confident	60 Å²	60	66.2 Å²	66.2	42%	0.42	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-32.4	176.3	85.6	0	0	0	0	113.2	E657 T658 V659 T664 N665	E657-S661 PolarHBondContact O-N 2.96Å; T658-S661 WeakPolarHBondContact O-CB 3.24Å; T658-S661 PolarHBondContact O-N 3Å; T658-S661 VanDerWaalsContact O-N 3.13Å; T658-S661 PolarHBondContact O-OG 3.41Å; V659-S661 VanDerWaalsContact C-N 3.3Å; V659-S661 PolarHBondContact O-N 2.87Å; S661-T664 PolarHBondContact O-OG1 2.86Å; S661-N665 VanDerWaalsContact O-CB 3.3Å; S661-N665 WeakPolarHBondContact O-CB 3.44Å; S661-N665 PolarHBondContact O-N 2.99Å
662	I	90.5	Very high	87.6	Confident	11 Å²	11	67.4 Å²	67.4	6%	0.056	34%	0.339	C	S	.	.	H	α-helix	trans	-72	-51.5	179.4	-69.3	160.5	0	0	0	110.2	T658 V659 H660 T664 N665 Q673 R676 L677 V680	T658-I662 HydrophobicContact CG2-CD1 3.89Å; T658-I662 HydrophobicContact CG2-CG1 4.45Å; T658-I662 WeakPolarHBondContact O-CG1 3.36Å; T658-I662 PolarHBondContact O-N 3.45Å; V659-I662 PolarHBondContact O-N 3.4Å; V659-I662 VanDerWaalsContact O-N 3.16Å; H660-I662 VanDerWaalsContact C-N 3.33Å; H660-I662 PolarHBondContact O-N 3.3Å; I662-T664 VanDerWaalsContact C-N 3.27Å; I662-T664 PolarHBondContact O-N 2.93Å; I662-N665 PolarHBondContact O-N 3.34Å; I662-N665 VanDerWaalsContact O-N 3.16Å; I662-Q673 HydrophobicContact CG2-CB 4.04Å; I662-Q673 HydrophobicContact CG2-CG 4.38Å; I662-Q673 WeakPolarHBondContact CG2-O 3.44Å; I662-R676 HydrophobicContact CD1-CB 3.94Å; I662-R676 HydrophobicContact CG1-CB 4.33Å; I662-R676 HydrophobicContact CG2-CB 4.13Å; I662-L677 HydrophobicContact CB-CD2 4.05Å; I662-L677 HydrophobicContact CD1-CD2 4.01Å; I662-L677 HydrophobicContact CG2-CD2 3.89Å; I662-L677 HydrophobicContact CG2-CG 3.92Å; I662-V680 HydrophobicContact CD1-CG2 4.21Å
663	V	87.3	Confident	87.4	Confident	14 Å²	14	67.2 Å²	67.2	9%	0.085	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-36.8	-177.1	175.7	0	0	0	0	112.1	V659 L677 E736 I737 R740	V659-V663 WeakPolarHBondContact O-CG2 3.3Å; V659-V663 PolarHBondContact O-N 3.34Å; V659-V663 VanDerWaalsContact O-N 3.15Å; V663-L677 HydrophobicContact CG2-CD1 4.07Å; V663-E736 WeakPolarHBondContact CG1-OE2 3.4Å; V663-I737 HydrophobicContact CG2-CD1 4.32Å; V663-R740 PolarHBondContact O-NH1 3.12Å; V663-R740 VanDerWaalsContact O-NH1 3.16Å
664	T	83.8	Confident	87.3	Confident	78 Å²	78	64.7 Å²	64.7	48%	0.479	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.5	-179	56.6	0	0	0	0	114.4	H660 S661 I662 Q666	H660-T664 WeakPolarHBondContact O-CG2 3.22Å; H660-T664 PolarHBondContact O-N 3.49Å; H660-T664 PolarHBondContact O-OG1 3.43Å; S661-T664 PolarHBondContact O-OG1 2.86Å; I662-T664 VanDerWaalsContact C-N 3.27Å; I662-T664 PolarHBondContact O-N 2.93Å; T664-Q666 PolarHBondContact O-N 3.46Å
665	N	82.6	Confident	87.2	Confident	54 Å²	54	65.4 Å²	65.4	29%	0.289	33%	0.331	S	S	.	.			trans	-81	92.3	-170.6	-170	-11	0	0	0	113.8	S661 I662 K667 L668 Q673	S661-N665 VanDerWaalsContact O-CB 3.3Å; S661-N665 WeakPolarHBondContact O-CB 3.44Å; S661-N665 PolarHBondContact O-N 2.99Å; I662-N665 PolarHBondContact O-N 3.34Å; I662-N665 VanDerWaalsContact O-N 3.16Å; N665-K667 PolarHBondContact O-N 3.35Å; N665-K667 WeakPolarHBondContact OD1-CB 3.31Å; N665-K667 PolarHBondContact OD1-N 2.97Å; N665-L668 HydrophobicContact CB-CD1 4.22Å; N665-L668 WeakPolarHBondContact ND2-CD1 3.13Å; N665-L668 PolarHBondContact O-N 2.71Å; N665-Q673 PolarHBondContact O-NE2 3.45Å
666	Q	74.5	Confident	87.2	Confident	170 Å²	170	70.5 Å²	70.5	79%	0.794	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-6	176.9	-61	-178.3	-5.7	0	0	116	T664	T664-Q666 PolarHBondContact O-N 3.46Å
667	K	76.8	Confident	87.3	Confident	198 Å²	198	68.4 Å²	68.4	86%	0.861	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-16.4	-179.9	-63.1	-179.1	178.1	176.4	0	114.2	N665	N665-K667 PolarHBondContact O-N 3.35Å; N665-K667 WeakPolarHBondContact OD1-CB 3.31Å; N665-K667 PolarHBondContact OD1-N 2.97Å
668	L	76.3	Confident	87.4	Confident	31 Å²	31	65 Å²	65	16%	0.162	33%	0.325	C	S	.	.	S	Bend	trans	-92.6	149	178	-65.5	172.8	0	0	0	109.5	N665 D672 Q673	N665-L668 HydrophobicContact CB-CD1 4.22Å; N665-L668 WeakPolarHBondContact ND2-CD1 3.13Å; N665-L668 PolarHBondContact O-N 2.71Å; L668-D672 HydrophobicContact CB-CB 4.23Å; L668-D672 HydrophobicContact CD2-CB 4.48Å; L668-Q673 HydrophobicContact CB-CG 3.74Å; L668-Q673 HydrophobicContact CD1-CG 4.24Å; L668-Q673 PolarHBondContact O-NE2 3.06Å
669	S	83.6	Confident	87.4	Confident	50 Å²	50	69.5 Å²	69.5	35%	0.35	34%	0.341	S	S	.	.			trans	-61	160.2	165.8	66.3	0	0	0	0	110	E671 D672 Q673	S669-E671 VanDerWaalsContact CB-OE2 3.31Å; S669-E671 WeakPolarHBondContact CB-OE2 3.28Å; S669-E671 PolarHBondContact O-N 2.65Å; S669-D672 PolarHBondContact O-N 3.04Å; S669-D672 WeakPolarHBondContact OG-CB 3.42Å; S669-D672 PolarHBondContact OG-N 3.2Å; S669-D672 PolarHBondContact OG-OD1 2.84Å; S669-Q673 VanDerWaalsContact O-CG 3.3Å; S669-Q673 WeakPolarHBondContact O-CG 3.31Å; S669-Q673 PolarHBondContact O-N 3.02Å; S669-Q673 PolarHBondContact O-NE2 2.97Å
670	L	85.4	Confident	87.5	Confident	16 Å²	16	69.8 Å²	69.8	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-68.8	-33	179.5	-63.7	-178	0	0	0	110.5	Q673 L674 I737 R740 I741 N744	L670-Q673 PolarHBondContact O-N 3.14Å; L670-L674 WeakPolarHBondContact O-CB 3.39Å; L670-L674 PolarHBondContact O-N 2.78Å; L670-I737 HydrophobicContact CB-CG2 4.1Å; L670-I737 VanDerWaalsContact O-CG2 3.3Å; L670-I737 WeakPolarHBondContact O-CG2 3.26Å; L670-R740 HydrophobicContact CD1-CB 3.84Å; L670-R740 HydrophobicContact CD2-CB 4.33Å; L670-I741 HydrophobicContact CB-CD1 3.95Å; L670-I741 HydrophobicContact CB-CG1 3.5Å; L670-I741 VanDerWaalsContact CB-CG1 3.5Å; L670-I741 HydrophobicContact CD1-CB 4.47Å; L670-I741 HydrophobicContact CD1-CG1 3.71Å; L670-I741 HydrophobicContact CG-CG1 4.25Å; L670-N744 VanDerWaalsContact CD1-ND2 3.34Å; L670-N744 WeakPolarHBondContact CD1-ND2 3.33Å
671	E	87.4	Confident	87.7	Confident	97 Å²	97	66 Å²	66	45%	0.453	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-45.1	175.2	-58.1	68.7	-150.7	0	0	110.6	S669 L674 Q675	S669-E671 VanDerWaalsContact CB-OE2 3.31Å; S669-E671 WeakPolarHBondContact CB-OE2 3.28Å; S669-E671 PolarHBondContact O-N 2.65Å; E671-L674 PolarHBondContact O-N 3.16Å; E671-Q675 WeakPolarHBondContact O-CB 3.39Å; E671-Q675 WeakPolarHBondContact O-CG 3.36Å; E671-Q675 PolarHBondContact O-N 3.31Å
672	D	88.8	Confident	87.8	Confident	66 Å²	66	70.1 Å²	70.1	35%	0.353	34%	0.338	S	S	.	.	H	α-helix	trans	-65.3	-38.2	174.4	-81.2	4.8	0	0	0	111.9	L668 S669 R676	L668-D672 HydrophobicContact CB-CB 4.23Å; L668-D672 HydrophobicContact CD2-CB 4.48Å; S669-D672 PolarHBondContact O-N 3.04Å; S669-D672 WeakPolarHBondContact OG-CB 3.42Å; S669-D672 PolarHBondContact OG-N 3.2Å; S669-D672 PolarHBondContact OG-OD1 2.84Å; D672-R676 WeakPolarHBondContact O-CB 3.33Å; D672-R676 WeakPolarHBondContact O-CD 3.41Å; D672-R676 WeakPolarHBondContact O-CG 3.46Å; D672-R676 PolarHBondContact O-N 3Å
673	Q	89.8	Confident	88	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-46.1	176	-68.8	166.8	48.7	0	0	110.4	I662 N665 L668 S669 L670 R676 L677 I737	I662-Q673 HydrophobicContact CG2-CB 4.04Å; I662-Q673 HydrophobicContact CG2-CG 4.38Å; I662-Q673 WeakPolarHBondContact CG2-O 3.44Å; N665-Q673 PolarHBondContact O-NE2 3.45Å; L668-Q673 HydrophobicContact CB-CG 3.74Å; L668-Q673 HydrophobicContact CD1-CG 4.24Å; L668-Q673 PolarHBondContact O-NE2 3.06Å; S669-Q673 VanDerWaalsContact O-CG 3.3Å; S669-Q673 WeakPolarHBondContact O-CG 3.31Å; S669-Q673 PolarHBondContact O-N 3.02Å; S669-Q673 PolarHBondContact O-NE2 2.97Å; L670-Q673 PolarHBondContact O-N 3.14Å; Q673-R676 PolarHBondContact O-N 2.83Å; Q673-L677 PolarHBondContact O-N 2.57Å; Q673-I737 HydrophobicContact CB-CD1 3.65Å; Q673-I737 HydrophobicContact CB-CG1 4.37Å
674	L	90.5	Very high	88.2	Confident	31 Å²	31	72.7 Å²	72.7	16%	0.162	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-45.5	178.2	-169.8	64	0	0	0	111.6	L670 E671 R676 L677 N678 Q734 I737 E738 I741	L670-L674 WeakPolarHBondContact O-CB 3.39Å; L670-L674 PolarHBondContact O-N 2.78Å; E671-L674 PolarHBondContact O-N 3.16Å; L674-R676 VanDerWaalsContact C-N 3.29Å; L674-R676 PolarHBondContact O-N 3.41Å; L674-L677 PolarHBondContact O-N 3.08Å; L674-N678 WeakPolarHBondContact O-CB 3.41Å; L674-N678 PolarHBondContact O-N 2.84Å; L674-N678 PolarHBondContact O-OD1 3.35Å; L674-Q734 HydrophobicContact CD1-CB 4.09Å; L674-Q734 HydrophobicContact CD1-CG 3.99Å; L674-I737 HydrophobicContact CB-CG2 4.01Å; L674-I737 HydrophobicContact CD1-CG2 4.49Å; L674-E738 HydrophobicContact CD1-CG 4.24Å; L674-E738 HydrophobicContact CD2-CG 4.3Å; L674-I741 HydrophobicContact CD2-CD1 4.27Å
675	Q	92.7	Very high	88.5	Confident	131 Å²	131	72.6 Å²	72.6	61%	0.612	35%	0.346	S	S	*	.	H	α-helix	trans	-58.6	-39.3	174.4	-76.1	-176.7	15.8	0	0	112.5	E671 N678 K679	E671-Q675 WeakPolarHBondContact O-CB 3.39Å; E671-Q675 WeakPolarHBondContact O-CG 3.36Å; E671-Q675 PolarHBondContact O-N 3.31Å; Q675-N678 PolarHBondContact O-N 2.95Å; Q675-K679 PolarHBondContact O-N 2.94Å
676	R	93.3	Very high	89	Confident	121 Å²	121	72.7 Å²	72.7	46%	0.457	36%	0.36	S	S	.	.	H	α-helix	trans	-67.8	-40.6	176.2	-73	170.1	-171.5	-130.6	1.5	112.4	I662 D672 Q673 L674 K679 V680	I662-R676 HydrophobicContact CD1-CB 3.94Å; I662-R676 HydrophobicContact CG1-CB 4.33Å; I662-R676 HydrophobicContact CG2-CB 4.13Å; D672-R676 WeakPolarHBondContact O-CB 3.33Å; D672-R676 WeakPolarHBondContact O-CD 3.41Å; D672-R676 WeakPolarHBondContact O-CG 3.46Å; D672-R676 PolarHBondContact O-N 3Å; Q673-R676 PolarHBondContact O-N 2.83Å; L674-R676 VanDerWaalsContact C-N 3.29Å; L674-R676 PolarHBondContact O-N 3.41Å; R676-K679 PolarHBondContact O-N 3.09Å; R676-V680 WeakPolarHBondContact O-CG2 3.45Å; R676-V680 PolarHBondContact O-N 3.23Å
677	L	93.4	Very high	89.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-42.3	174.3	-69.9	-172.7	0	0	0	111.9	V659 I662 V663 Q673 L674 K679 V680 E681 Q734 I737	V659-L677 HydrophobicContact CB-CD2 4.35Å; V659-L677 HydrophobicContact CG1-CD2 3.98Å; V659-L677 HydrophobicContact CG2-CD2 4.18Å; I662-L677 HydrophobicContact CB-CD2 4.05Å; I662-L677 HydrophobicContact CD1-CD2 4.01Å; I662-L677 HydrophobicContact CG2-CD2 3.89Å; I662-L677 HydrophobicContact CG2-CG 3.92Å; V663-L677 HydrophobicContact CG2-CD1 4.07Å; Q673-L677 PolarHBondContact O-N 2.57Å; L674-L677 PolarHBondContact O-N 3.08Å; L677-K679 VanDerWaalsContact C-N 3.25Å; L677-K679 PolarHBondContact O-N 3.29Å; L677-V680 PolarHBondContact O-N 2.96Å; L677-V680 VanDerWaalsContact O-N 3.11Å; L677-E681 PolarHBondContact O-N 2.8Å; L677-Q734 HydrophobicContact CB-CG 4.02Å; L677-Q734 HydrophobicContact CD1-CG 4.11Å; L677-I737 HydrophobicContact CD1-CD1 3.62Å; L677-I737 HydrophobicContact CG-CD1 4.36Å
678	N	93.2	Very high	90.5	Very high	70 Å²	70	62.2 Å²	62.2	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-37.8	175.5	-65.2	-5.1	0	0	0	111.5	L674 Q675 E681 E682 Q734	L674-N678 WeakPolarHBondContact O-CB 3.41Å; L674-N678 PolarHBondContact O-N 2.84Å; L674-N678 PolarHBondContact O-OD1 3.35Å; Q675-N678 PolarHBondContact O-N 2.95Å; N678-E681 WeakPolarHBondContact O-CB 3.49Å; N678-E681 PolarHBondContact O-N 2.84Å; N678-E682 PolarHBondContact O-N 3.08Å; N678-Q734 PolarHBondContact OD1-NE2 2.86Å
679	K	93.8	Very high	91.3	Very high	124 Å²	124	65.1 Å²	65.1	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-43	173.2	-175.1	177.4	177.7	-178.6	0	112.5	Q675 R676 L677 E681 E682 D683	Q675-K679 PolarHBondContact O-N 2.94Å; R676-K679 PolarHBondContact O-N 3.09Å; L677-K679 VanDerWaalsContact C-N 3.25Å; L677-K679 PolarHBondContact O-N 3.29Å; K679-E681 PolarHBondContact O-N 3Å; K679-E682 PolarHBondContact O-N 3.41Å; K679-D683 WeakPolarHBondContact O-CB 3.48Å; K679-D683 PolarHBondContact O-N 3.24Å
680	V	94.1	Very high	91.8	Very high	11 Å²	11	63.7 Å²	63.7	7%	0.067	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-32.8	175.4	177.1	0	0	0	0	110.9	N655 V659 I662 R676 L677 L684 I730	N655-V680 HydrophobicContact CB-CG1 4.5Å; V659-V680 HydrophobicContact CG2-CG1 3.99Å; I662-V680 HydrophobicContact CD1-CG2 4.21Å; R676-V680 WeakPolarHBondContact O-CG2 3.45Å; R676-V680 PolarHBondContact O-N 3.23Å; L677-V680 PolarHBondContact O-N 2.96Å; L677-V680 VanDerWaalsContact O-N 3.11Å; V680-L684 WeakPolarHBondContact O-CB 3.1Å; V680-L684 PolarHBondContact O-N 3.29Å; V680-I730 HydrophobicContact CG1-CD1 3.86Å; V680-I730 HydrophobicContact CG1-CG1 4.27Å
681	E	93.4	Very high	92	Very high	51 Å²	51	63.8 Å²	63.8	24%	0.238	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-46.3	171.8	-163.9	177.4	179.2	0	0	112.6	L677 N678 K679 L684 E685 I730 K731 Q734	L677-E681 PolarHBondContact O-N 2.8Å; N678-E681 WeakPolarHBondContact O-CB 3.49Å; N678-E681 PolarHBondContact O-N 2.84Å; K679-E681 PolarHBondContact O-N 3Å; E681-L684 WeakPolarHBondContact O-CB 3.37Å; E681-L684 PolarHBondContact O-N 2.94Å; E681-E685 PolarHBondContact O-N 3.2Å; E681-I730 HydrophobicContact CB-CG2 4Å; E681-I730 HydrophobicContact CG-CG2 4.34Å; E681-K731 WeakPolarHBondContact OE1-CE 3.38Å; E681-K731 IonicContact OE1-NZ 2.94Å; E681-K731 PolarHBondContact OE1-NZ 3.38Å; E681-K731 IonicContact OE2-NZ 2.82Å; E681-K731 PolarHBondContact OE2-NZ 3.25Å; E681-Q734 PolarHBondContact OE2-NE2 3.33Å; E681-Q734 PolarHBondContact OE2-OE1 3.28Å
682	E	93.6	Very high	92.2	Very high	147 Å²	147	62.4 Å²	62.4	69%	0.687	32%	0.319	S	S	*	.	H	α-helix	trans	-61.3	-47.4	176.2	-174.9	-179.1	-171.8	0	0	111.5	N678 K679 L684 E685 G686	N678-E682 PolarHBondContact O-N 3.08Å; K679-E682 PolarHBondContact O-N 3.41Å; E682-L684 VanDerWaalsContact C-N 3.29Å; E682-L684 PolarHBondContact O-N 2.9Å; E682-E685 PolarHBondContact O-N 3.36Å; E682-G686 PolarHBondContact O-N 3.08Å; E682-G686 VanDerWaalsContact O-N 3.12Å
683	D	93.6	Very high	92.4	Very high	76 Å²	76	62.8 Å²	62.8	41%	0.406	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-40.2	175	-74.4	-32.4	0	0	0	110.4	K679 G686	K679-D683 WeakPolarHBondContact O-CB 3.48Å; K679-D683 PolarHBondContact O-N 3.24Å; D683-G686 PolarHBondContact O-N 3.04Å
684	L	92.4	Very high	92.6	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-47.8	177.2	-171.9	68.2	0	0	0	112.8	Y651 L652 V680 E681 E682 G686 W687 W723 L726 K727 I730	Y651-L684 HydrophobicContact CE1-CD1 4.09Å; L652-L684 HydrophobicContact CD2-CD1 4.49Å; V680-L684 WeakPolarHBondContact O-CB 3.1Å; V680-L684 PolarHBondContact O-N 3.29Å; E681-L684 WeakPolarHBondContact O-CB 3.37Å; E681-L684 PolarHBondContact O-N 2.94Å; E682-L684 VanDerWaalsContact C-N 3.29Å; E682-L684 PolarHBondContact O-N 2.9Å; L684-G686 PolarHBondContact O-N 3.06Å; L684-W687 WeakPolarHBondContact O-CB 3.43Å; L684-W687 PolarHBondContact O-N 2.81Å; L684-W723 HydrophobicContact CD1-CD2 4.4Å; L684-W723 HydrophobicContact CD1-CE3 3.43Å; L684-W723 VanDerWaalsContact CD1-CE3 3.43Å; L684-W723 HydrophobicContact CD1-CH2 4.24Å; L684-W723 HydrophobicContact CD1-CZ3 3.35Å; L684-W723 HydrophobicContact CG-CE3 3.95Å; L684-W723 HydrophobicContact CG-CH2 3.97Å; L684-W723 HydrophobicContact CG-CZ3 3.58Å; L684-W723 WeakPolarHBondContact O-CH2 3.26Å; L684-W723 VanDerWaalsContact O-CZ3 3.27Å; L684-W723 WeakPolarHBondContact O-CZ3 3.44Å; L684-L726 HydrophobicContact CD1-CD2 3.65Å; L684-L726 HydrophobicContact CD1-CG 4.31Å; L684-L726 HydrophobicContact CD2-CD2 4.43Å; L684-L726 HydrophobicContact CD2-CG 4.2Å; L684-K727 HydrophobicContact CD2-CB 4.23Å; L684-I730 HydrophobicContact CD2-CD1 3.8Å
685	E	90.5	Very high	92.6	Very high	76 Å²	76	64.3 Å²	64.3	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-29.3	175.5	-78.8	-71.1	132.3	0	0	111.7	E681 E682 W687 K688	E681-E685 PolarHBondContact O-N 3.2Å; E682-E685 PolarHBondContact O-N 3.36Å; E685-W687 PolarHBondContact O-N 3.4Å; E685-K688 WeakPolarHBondContact O-CB 3.4Å; E685-K688 PolarHBondContact O-N 3.39Å; E685-K688 IonicContact OE1-NZ 3.94Å; E685-K688 PolarHBondContact OE1-NZ 2.73Å; E685-K688 WeakPolarHBondContact OE2-CD 3.18Å; E685-K688 IonicContact OE2-NZ 3.64Å; E685-K688 PolarHBondContact OE2-NZ 2.93Å
686	G	92.2	Very high	92.5	Very high	56 Å²	56	62.7 Å²	62.7	58%	0.577	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-24.7	169.2	0	0	0	0	0	114.9	E682 D683 L684 P689	E682-G686 PolarHBondContact O-N 3.08Å; E682-G686 VanDerWaalsContact O-N 3.12Å; D683-G686 PolarHBondContact O-N 3.04Å; L684-G686 PolarHBondContact O-N 3.06Å; G686-P689 WeakPolarHBondContact O-CD 3.28Å
687	W	93.3	Very high	92.5	Very high	48 Å²	48	57.2 Å²	57.2	18%	0.182	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-7.6	175.5	-72.9	91.1	0	0	0	114.4	R647 F648 Y651 L684 E685 P689 T690 I691 W723	R647-W687 HydrophobicContact CG-CH2 3.97Å; R647-W687 HydrophobicContact CG-CZ3 4.4Å; F648-W687 HydrophobicContact CB-CE3 4.36Å; F648-W687 HydrophobicContact CB-CZ3 4.17Å; F648-W687 HydrophobicContact CD2-CB 4.4Å; F648-W687 AromaticContact CD2-CD2 3.95Å; F648-W687 HydrophobicContact CD2-CD2 3.95Å; F648-W687 AromaticContact CD2-CE3 3.54Å; F648-W687 HydrophobicContact CD2-CE3 3.54Å; F648-W687 HydrophobicContact CD2-CG 4.3Å; F648-W687 HydrophobicContact CD2-CZ3 4.12Å; F648-W687 HydrophobicContact CE2-CB 3.91Å; F648-W687 HydrophobicContact CE2-CD2 4.31Å; F648-W687 HydrophobicContact CE2-CE3 4.22Å; F648-W687 HydrophobicContact CE2-CG 4.18Å; F648-W687 HydrophobicContact CG-CE3 4.28Å; Y651-W687 HydrophobicContact CD1-CD2 4.47Å; Y651-W687 HydrophobicContact CD1-CG 4.5Å; Y651-W687 AromaticContact CD1-NE1 3.9Å; Y651-W687 HydrophobicContact CD2-CZ2 4.04Å; Y651-W687 AromaticContact CD2-NE1 3.7Å; Y651-W687 AromaticContact CE1-CD1 3.5Å; Y651-W687 HydrophobicContact CE1-CG 4.18Å; Y651-W687 AromaticContact CE1-NE1 3.55Å; Y651-W687 HydrophobicContact CE2-CZ2 4.47Å; Y651-W687 AromaticContact CE2-NE1 3.31Å; Y651-W687 VanDerWaalsContact CE2-NE1 3.31Å; Y651-W687 HydrophobicContact CG-CZ2 4.15Å; Y651-W687 AromaticContact CG-NE1 3.98Å; Y651-W687 AromaticContact CZ-CD1 3.46Å; Y651-W687 VanDerWaalsContact CZ-CD1 3.46Å; Y651-W687 AromaticContact CZ-NE1 3.24Å; L684-W687 WeakPolarHBondContact O-CB 3.43Å; L684-W687 PolarHBondContact O-N 2.81Å; E685-W687 PolarHBondContact O-N 3.4Å; W687-P689 VanDerWaalsContact C-CD 3.4Å; W687-P689 VanDerWaalsContact C-N 3.31Å; W687-T690 HydrophobicContact CE3-CG2 3.94Å; W687-T690 HydrophobicContact CZ3-CG2 4.14Å; W687-T690 WeakPolarHBondContact O-CA 3.42Å; W687-T690 WeakPolarHBondContact O-CB 3.31Å; W687-T690 PolarHBondContact O-N 3.4Å; W687-I691 PolarHBondContact O-N 3.42Å; W687-I691 VanDerWaalsContact O-N 3.15Å; W687-W723 HydrophobicContact CB-CZ3 3.93Å
688	K	90.2	Very high	92.4	Very high	101 Å²	101	58.7 Å²	58.7	44%	0.439	30%	0.302	S	S	.	.	H	α-helix	trans	-51.6	-37.2	179	-165.3	178.5	-151.9	149.3	0	114.5	E685 T690 I691 T692 W723	E685-K688 WeakPolarHBondContact O-CB 3.4Å; E685-K688 PolarHBondContact O-N 3.39Å; E685-K688 IonicContact OE1-NZ 3.94Å; E685-K688 PolarHBondContact OE1-NZ 2.73Å; E685-K688 WeakPolarHBondContact OE2-CD 3.18Å; E685-K688 IonicContact OE2-NZ 3.64Å; E685-K688 PolarHBondContact OE2-NZ 2.93Å; K688-T690 VanDerWaalsContact C-N 3.35Å; K688-T690 PolarHBondContact O-N 3.1Å; K688-I691 VanDerWaalsContact O-CG2 3.24Å; K688-I691 WeakPolarHBondContact O-CG2 3.24Å; K688-T692 WeakPolarHBondContact O-CB 3.4Å; K688-T692 PolarHBondContact O-N 3.42Å; K688-T692 VanDerWaalsContact O-N 3.14Å; K688-T692 PolarHBondContact O-OG1 3.42Å; K688-W723 HydrophobicContact CB-CH2 4.32Å
689	P	92.5	Very high	92.1	Very high	92 Å²	92	60.1 Å²	60.1	60%	0.597	31%	0.307	S	S	*	.	H	α-helix	trans	-67.6	-31.6	172.2	-20.7	34.7	0	0	0	113.5	G686 W687 E693	G686-P689 WeakPolarHBondContact O-CD 3.28Å; W687-P689 VanDerWaalsContact C-CD 3.4Å; W687-P689 VanDerWaalsContact C-N 3.31Å; P689-E693 PolarHBondContact O-N 2.78Å
690	T	93	Very high	91.8	Very high	19 Å²	19	59 Å²	59	12%	0.117	30%	0.302	C	S	.	.	H	α-helix	trans	-71.2	-45	179.2	-59.4	0	0	0	0	111.3	L644 R647 W687 K688 T692 E693 L694	L644-T690 HydrophobicContact CB-CG2 4.38Å; L644-T690 HydrophobicContact CD2-CG2 4.35Å; R647-T690 PolarHBondContact NH2-OG1 3.19Å; W687-T690 HydrophobicContact CE3-CG2 3.94Å; W687-T690 HydrophobicContact CZ3-CG2 4.14Å; W687-T690 WeakPolarHBondContact O-CA 3.42Å; W687-T690 WeakPolarHBondContact O-CB 3.31Å; W687-T690 PolarHBondContact O-N 3.4Å; K688-T690 VanDerWaalsContact C-N 3.35Å; K688-T690 PolarHBondContact O-N 3.1Å; T690-T692 VanDerWaalsContact C-N 3.31Å; T690-T692 PolarHBondContact O-N 3.05Å; T690-E693 PolarHBondContact O-N 2.79Å; T690-L694 HydrophobicContact CG2-CD1 4.18Å; T690-L694 WeakPolarHBondContact O-CG 3.28Å; T690-L694 PolarHBondContact O-N 3.3Å
691	I	91.2	Very high	91.6	Very high	19 Å²	19	59 Å²	59	10%	0.097	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-36.4	175	-171	168.6	0	0	0	111.4	F648 W687 K688 E693 L694 E695 M716 W723	F648-I691 HydrophobicContact CE1-CB 4.29Å; F648-I691 HydrophobicContact CE1-CD1 4.37Å; F648-I691 HydrophobicContact CE1-CG1 4.46Å; F648-I691 HydrophobicContact CZ-CB 4.34Å; F648-I691 HydrophobicContact CZ-CD1 4.47Å; W687-I691 PolarHBondContact O-N 3.42Å; W687-I691 VanDerWaalsContact O-N 3.15Å; K688-I691 VanDerWaalsContact O-CG2 3.24Å; K688-I691 WeakPolarHBondContact O-CG2 3.24Å; I691-E693 VanDerWaalsContact C-N 3.33Å; I691-E693 PolarHBondContact O-N 3.19Å; I691-L694 WeakPolarHBondContact O-CB 3.49Å; I691-L694 PolarHBondContact O-N 2.83Å; I691-E695 PolarHBondContact O-N 3.09Å; I691-M716 HydrophobicContact CG1-CE 4.15Å; I691-W723 HydrophobicContact CD1-CB 4.01Å; I691-W723 HydrophobicContact CD1-CD2 3.92Å; I691-W723 HydrophobicContact CD1-CG 3.7Å; I691-W723 HydrophobicContact CG2-CH2 4.36Å; I691-W723 HydrophobicContact CG2-CZ2 4.33Å
692	T	91.2	Very high	91.1	Very high	68 Å²	68	58.1 Å²	58.1	42%	0.417	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-37.3	172.6	-55.4	0	0	0	0	112.7	K688 T690 K696	K688-T692 WeakPolarHBondContact O-CB 3.4Å; K688-T692 PolarHBondContact O-N 3.42Å; K688-T692 VanDerWaalsContact O-N 3.14Å; K688-T692 PolarHBondContact O-OG1 3.42Å; T690-T692 VanDerWaalsContact C-N 3.31Å; T690-T692 PolarHBondContact O-N 3.05Å; T692-K696 WeakPolarHBondContact O-CG 3.42Å; T692-K696 PolarHBondContact O-N 3.42Å
693	E	92.7	Very high	90.5	Very high	73 Å²	73	53.4 Å²	53.4	34%	0.341	29%	0.288	S	S	.	.	H	α-helix	trans	-76.3	-34.4	176.5	-164.3	60.8	-156.4	0	0	112.3	L644 P689 T690 I691 K696 L697	L644-E693 HydrophobicContact CD1-CB 4.15Å; L644-E693 HydrophobicContact CD1-CG 4.03Å; P689-E693 PolarHBondContact O-N 2.78Å; T690-E693 PolarHBondContact O-N 2.79Å; I691-E693 VanDerWaalsContact C-N 3.33Å; I691-E693 PolarHBondContact O-N 3.19Å; E693-K696 PolarHBondContact O-N 3.04Å; E693-K696 VanDerWaalsContact OE2-CD 3.25Å; E693-K696 WeakPolarHBondContact OE2-CD 3.28Å; E693-K696 IonicContact OE2-NZ 3.19Å; E693-K696 PolarHBondContact OE2-NZ 2.67Å; E693-L697 HydrophobicContact CG-CD1 4.43Å; E693-L697 WeakPolarHBondContact O-CB 3.17Å; E693-L697 WeakPolarHBondContact O-CG 3.29Å; E693-L697 PolarHBondContact O-N 3.27Å
694	L	94.2	Very high	90	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-43.1	170	-78.7	163.5	0	0	0	111.8	F641 L644 A645 F648 T690 I691 L697 H698 M716 L719	F641-L694 HydrophobicContact CD2-CD2 3.74Å; F641-L694 HydrophobicContact CE2-CB 4.41Å; F641-L694 HydrophobicContact CE2-CD2 3.66Å; F641-L694 HydrophobicContact CG-CD2 4.26Å; F641-L694 HydrophobicContact CZ-CD2 4.13Å; L644-L694 HydrophobicContact CB-CD1 4.44Å; L644-L694 HydrophobicContact CB-CD2 3.7Å; L644-L694 HydrophobicContact CB-CG 3.97Å; L644-L694 HydrophobicContact CD1-CG 4.41Å; A645-L694 HydrophobicContact CB-CD2 4.2Å; F648-L694 HydrophobicContact CB-CD1 4.49Å; F648-L694 HydrophobicContact CD1-CD1 3.69Å; F648-L694 HydrophobicContact CE1-CD1 4.3Å; F648-L694 HydrophobicContact CG-CD1 4.42Å; T690-L694 HydrophobicContact CG2-CD1 4.18Å; T690-L694 WeakPolarHBondContact O-CG 3.28Å; T690-L694 PolarHBondContact O-N 3.3Å; I691-L694 WeakPolarHBondContact O-CB 3.49Å; I691-L694 PolarHBondContact O-N 2.83Å; L694-L697 PolarHBondContact O-N 3.25Å; L694-H698 VanDerWaalsContact O-CB 3.3Å; L694-H698 WeakPolarHBondContact O-CB 3.47Å; L694-H698 PolarHBondContact O-N 3.45Å; L694-M716 HydrophobicContact CB-CE 3.88Å; L694-M716 HydrophobicContact CB-SD 3.87Å; L694-L719 HydrophobicContact CD1-CD1 3.96Å; L694-L719 HydrophobicContact CD2-CD1 4.29Å
695	E	90	Very high	89.4	Confident	65 Å²	65	56.7 Å²	56.7	30%	0.304	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-46.5	173.1	-76.6	-62.8	166.9	0	0	111.9	I691 L697 H698 Q699 M716 R720	I691-E695 PolarHBondContact O-N 3.09Å; E695-L697 PolarHBondContact O-N 2.91Å; E695-H698 PolarHBondContact O-N 3.06Å; E695-Q699 WeakPolarHBondContact O-CB 3.29Å; E695-Q699 PolarHBondContact O-N 3.19Å; E695-M716 HydrophobicContact CB-CE 4.3Å; E695-M716 HydrophobicContact CG-CE 3.55Å; E695-M716 WeakPolarHBondContact OE1-CE 3.39Å; E695-R720 IonicContact OE1-CZ 2.9Å; E695-R720 IonicContact OE1-NE 3.82Å; E695-R720 PolarHBondContact OE1-NE 2.99Å; E695-R720 IonicContact OE1-NH2 3.79Å; E695-R720 PolarHBondContact OE1-NH2 3.36Å; E695-R720 VanDerWaalsContact OE1-NH2 3.16Å; E695-R720 IonicContact OE2-CZ 2.69Å; E695-R720 IonicContact OE2-NE 3.42Å; E695-R720 IonicContact OE2-NH2 2.72Å; E695-R720 PolarHBondContact OE2-NH2 3.48Å
696	K	91.4	Very high	89.1	Confident	97 Å²	97	54.5 Å²	54.5	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-64.1	-40.8	177.6	-68.8	164.9	-174.4	163.7	0	112.8	T692 E693 H698 Q699 K700	T692-K696 WeakPolarHBondContact O-CG 3.42Å; T692-K696 PolarHBondContact O-N 3.42Å; E693-K696 PolarHBondContact O-N 3.04Å; E693-K696 VanDerWaalsContact OE2-CD 3.25Å; E693-K696 WeakPolarHBondContact OE2-CD 3.28Å; E693-K696 IonicContact OE2-NZ 3.19Å; E693-K696 PolarHBondContact OE2-NZ 2.67Å; K696-H698 VanDerWaalsContact C-N 3.32Å; K696-Q699 PolarHBondContact O-N 3.03Å; K696-K700 WeakPolarHBondContact O-CG 3.19Å; K696-K700 PolarHBondContact O-N 3.41Å
697	L	92.9	Very high	88.4	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-38.4	175.9	-72.6	168.2	0	0	0	110.7	V637 Q640 F641 L644 E693 L694 E695 K700 Q701	V637-L697 HydrophobicContact CG1-CD2 4.33Å; Q640-L697 HydrophobicContact CB-CD1 4.11Å; Q640-L697 HydrophobicContact CB-CD2 4Å; F641-L697 HydrophobicContact CB-CB 4.27Å; F641-L697 HydrophobicContact CD2-CB 4.04Å; L644-L697 HydrophobicContact CD1-CD1 3.84Å; E693-L697 HydrophobicContact CG-CD1 4.43Å; E693-L697 WeakPolarHBondContact O-CB 3.17Å; E693-L697 WeakPolarHBondContact O-CG 3.29Å; E693-L697 PolarHBondContact O-N 3.27Å; L694-L697 PolarHBondContact O-N 3.25Å; E695-L697 PolarHBondContact O-N 2.91Å; L697-K700 WeakPolarHBondContact O-CB 3.35Å; L697-K700 PolarHBondContact O-N 3.39Å; L697-Q701 WeakPolarHBondContact O-CG 3.41Å; L697-Q701 PolarHBondContact O-N 3.16Å
698	H	90.6	Very high	88	Confident	32 Å²	32	60.9 Å²	60.9	15%	0.148	32%	0.316	C	S	.	.	H	α-helix	trans	-66.8	-39.3	174.1	-168.7	54.3	0	0	0	112.5	F641 L694 E695 K696 K700 Q701 Q702 M716	F641-H698 HydrophobicContact CE2-CB 4.09Å; L694-H698 VanDerWaalsContact O-CB 3.3Å; L694-H698 WeakPolarHBondContact O-CB 3.47Å; L694-H698 PolarHBondContact O-N 3.45Å; E695-H698 PolarHBondContact O-N 3.06Å; K696-H698 VanDerWaalsContact C-N 3.32Å; H698-K700 VanDerWaalsContact C-N 3.3Å; H698-K700 PolarHBondContact O-N 3.36Å; H698-Q701 PolarHBondContact ND1-OE1 3.2Å; H698-Q701 VanDerWaalsContact ND1-OE1 3.12Å; H698-Q701 WeakPolarHBondContact O-CB 3.41Å; H698-Q701 PolarHBondContact O-N 3.44Å; H698-Q701 VanDerWaalsContact O-N 3.16Å; H698-Q702 PolarHBondContact NE2-NE2 3.11Å; H698-Q702 VanDerWaalsContact NE2-NE2 3.1Å; H698-Q702 WeakPolarHBondContact O-CG 3.37Å; H698-Q702 PolarHBondContact O-N 3.09Å; H698-M716 HydrophobicContact CB-CB 4.26Å; H698-M716 HydrophobicContact CB-CG 4.1Å
699	Q	87.3	Confident	87.9	Confident	100 Å²	100	56.9 Å²	56.9	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-39.9	172.5	-168.4	-176.7	20.7	0	0	111.4	E695 K696 G703	E695-Q699 WeakPolarHBondContact O-CB 3.29Å; E695-Q699 PolarHBondContact O-N 3.19Å; K696-Q699 PolarHBondContact O-N 3.03Å; Q699-G703 PolarHBondContact O-N 3.05Å
700	K	88.6	Confident	87.7	Confident	101 Å²	101	56.6 Å²	56.6	44%	0.439	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-45.2	171.2	-71.5	177.2	-178.1	178.4	0	112.1	V637 K696 L697 H698 Q702 G703 F704	V637-K700 HydrophobicContact CG1-CB 4.04Å; V637-K700 HydrophobicContact CG2-CD 4.43Å; K696-K700 WeakPolarHBondContact O-CG 3.19Å; K696-K700 PolarHBondContact O-N 3.41Å; L697-K700 WeakPolarHBondContact O-CB 3.35Å; L697-K700 PolarHBondContact O-N 3.39Å; H698-K700 VanDerWaalsContact C-N 3.3Å; H698-K700 PolarHBondContact O-N 3.36Å; K700-Q702 VanDerWaalsContact C-N 3.35Å; K700-Q702 PolarHBondContact O-N 3.12Å; K700-G703 PolarHBondContact O-N 3.18Å; K700-F704 VanDerWaalsContact O-CB 3.32Å; K700-F704 WeakPolarHBondContact O-CB 3.46Å; K700-F704 VanDerWaalsContact O-CG 3.31Å; K700-F704 WeakPolarHBondContact O-CG 3.21Å; K700-F704 PolarHBondContact O-N 2.86Å
701	Q	89.3	Confident	87.6	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-56.2	-48.9	174.8	-72.3	175	-44.6	0	0	111.3	V637 N638 L697 H698 F704 L705 I706 N709	V637-Q701 HydrophobicContact CG1-CG 3.8Å; N638-Q701 PolarHBondContact OD1-NE2 3.19Å; L697-Q701 WeakPolarHBondContact O-CG 3.41Å; L697-Q701 PolarHBondContact O-N 3.16Å; H698-Q701 PolarHBondContact ND1-OE1 3.2Å; H698-Q701 VanDerWaalsContact ND1-OE1 3.12Å; H698-Q701 WeakPolarHBondContact O-CB 3.41Å; H698-Q701 PolarHBondContact O-N 3.44Å; H698-Q701 VanDerWaalsContact O-N 3.16Å; Q701-F704 CarbonylContact O-C 3.53Å; Q701-F704 PolarHBondContact O-N 3.35Å; Q701-L705 PolarHBondContact O-N 3.36Å; Q701-I706 HydrophobicContact CB-CB 4.13Å; Q701-I706 HydrophobicContact CG-CB 4.43Å; Q701-I706 HydrophobicContact CG-CD1 4.39Å; Q701-I706 PolarHBondContact O-N 3.13Å; Q701-N709 PolarHBondContact NE2-ND2 3.01Å
702	Q	82.3	Confident	87.7	Confident	32 Å²	32	59.6 Å²	59.6	15%	0.15	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-42.4	177	-71.3	-176.3	-16.1	0	0	111.9	R322 E384 H698 K700 F704 L705	R322-Q702 VanDerWaalsContact CZ-OE1 3.32Å; R322-Q702 VanDerWaalsContact NH2-CB 3.29Å; E384-Q702 PolarHBondContact OE1-NE2 3.42Å; H698-Q702 PolarHBondContact NE2-NE2 3.11Å; H698-Q702 VanDerWaalsContact NE2-NE2 3.1Å; H698-Q702 WeakPolarHBondContact O-CG 3.37Å; H698-Q702 PolarHBondContact O-N 3.09Å; K700-Q702 VanDerWaalsContact C-N 3.35Å; K700-Q702 PolarHBondContact O-N 3.12Å; Q702-F704 VanDerWaalsContact C-N 3.34Å; Q702-F704 PolarHBondContact O-N 3.47Å; Q702-L705 PolarHBondContact O-N 2.73Å; Q702-L705 VanDerWaalsContact O-N 3.12Å
703	G	81.5	Confident	87.8	Confident	49 Å²	49	64.9 Å²	64.9	51%	0.505	32%	0.323	S	S	.	.	H	α-helix	trans	-68.4	-28.8	177	0	0	0	0	0	114.4	Q699 K700 L705	Q699-G703 PolarHBondContact O-N 3.05Å; K700-G703 PolarHBondContact O-N 3.18Å; G703-L705 VanDerWaalsContact C-N 3.32Å
704	F	83	Confident	87.9	Confident	79 Å²	79	62.3 Å²	62.3	35%	0.346	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	4.8	171.5	-64.8	-14.6	0	0	0	112.9	E633 N634 V637 K700 Q701 Q702 I706	E633-F704 HydrophobicContact CG-CE2 4Å; E633-F704 HydrophobicContact CG-CZ 4.4Å; N634-F704 WeakPolarHBondContact OD1-CB 3.15Å; N634-F704 WeakPolarHBondContact OD1-CD2 3.44Å; V637-F704 HydrophobicContact CG2-CD2 4.32Å; V637-F704 HydrophobicContact CG2-CE2 3.94Å; K700-F704 VanDerWaalsContact O-CB 3.32Å; K700-F704 WeakPolarHBondContact O-CB 3.46Å; K700-F704 VanDerWaalsContact O-CG 3.31Å; K700-F704 WeakPolarHBondContact O-CG 3.21Å; K700-F704 PolarHBondContact O-N 2.86Å; Q701-F704 CarbonylContact O-C 3.53Å; Q701-F704 PolarHBondContact O-N 3.35Å; Q702-F704 VanDerWaalsContact C-N 3.34Å; Q702-F704 PolarHBondContact O-N 3.47Å; F704-I706 HydrophobicContact CB-CD1 3.95Å; F704-I706 HydrophobicContact CB-CG1 3.84Å; F704-I706 HydrophobicContact CD2-CD1 4.27Å; F704-I706 PolarHBondContact O-N 3.48Å
705	L	80.9	Confident	87.7	Confident	69 Å²	69	66.2 Å²	66.2	36%	0.361	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	24.9	178.4	-54.6	156	0	0	0	114	I391 E395 Q701 Q702 G703 T707	I391-L705 HydrophobicContact CG2-CD2 4.03Å; E395-L705 WeakPolarHBondContact OE2-CD1 3.2Å; E395-L705 VanDerWaalsContact OE2-CD2 3.23Å; E395-L705 WeakPolarHBondContact OE2-CD2 3.23Å; Q701-L705 PolarHBondContact O-N 3.36Å; Q702-L705 PolarHBondContact O-N 2.73Å; Q702-L705 VanDerWaalsContact O-N 3.12Å; G703-L705 VanDerWaalsContact C-N 3.32Å; L705-T707 WeakPolarHBondContact O-CG2 3.43Å; L705-T707 PolarHBondContact O-N 3.17Å; L705-T707 VanDerWaalsContact O-N 3.12Å
706	I	82.8	Confident	87.8	Confident	29 Å²	29	63.2 Å²	63.2	15%	0.149	32%	0.321	C	S	.	.			trans	-72.2	106.4	179.1	-56.2	175.6	0	0	0	108.8	N634 N638 Q701 F704 H708	N634-I706 HydrophobicContact CB-CD1 3.68Å; N634-I706 HydrophobicContact CB-CG1 4.23Å; N638-I706 WeakPolarHBondContact ND2-CG2 3.25Å; N638-I706 WeakPolarHBondContact OD1-CG2 3.47Å; Q701-I706 HydrophobicContact CB-CB 4.13Å; Q701-I706 HydrophobicContact CG-CB 4.43Å; Q701-I706 HydrophobicContact CG-CD1 4.39Å; Q701-I706 PolarHBondContact O-N 3.13Å; F704-I706 HydrophobicContact CB-CD1 3.95Å; F704-I706 HydrophobicContact CB-CG1 3.84Å; F704-I706 HydrophobicContact CD2-CD1 4.27Å; F704-I706 PolarHBondContact O-N 3.48Å; I706-H708 WeakPolarHBondContact CG2-O 3.47Å
707	T	78.5	Confident	87.5	Confident	106 Å²	106	62 Å²	62	65%	0.65	32%	0.317	S	S	*	.			trans	-87.6	-19.7	-174.8	60.7	0	0	0	0	114.1	K392 L705	K392-T707 HydrophobicContact CD-CG2 4.46Å; K392-T707 VanDerWaalsContact CE-CG2 3.4Å; K392-T707 VanDerWaalsContact NZ-CG2 3.32Å; L705-T707 WeakPolarHBondContact O-CG2 3.43Å; L705-T707 PolarHBondContact O-N 3.17Å; L705-T707 VanDerWaalsContact O-N 3.12Å
708	H	83.8	Confident	87.5	Confident	133 Å²	133	65.1 Å²	65.1	62%	0.616	34%	0.336	S	S	*	.			trans	-144.1	137.5	-172.7	179.1	66.2	0	0	0	110.3	N638 I706	N638-H708 PolarHBondContact ND2-O 2.85Å; N638-H708 VanDerWaalsContact ND2-O 3.14Å; I706-H708 WeakPolarHBondContact CG2-O 3.47Å
709	N	87.9	Confident	87.6	Confident	17 Å²	17	63.7 Å²	63.7	9%	0.091	33%	0.329	C	S	.	.			trans	-119.7	105.5	173.8	-172.5	-14.1	0	0	0	108.7	N638 Q701 H711 T712	N638-N709 VanDerWaalsContact CG-CG 3.5Å; N638-N709 PolarHBondContact O-ND2 2.86Å; N638-N709 WeakPolarHBondContact OD1-CB 3.41Å; N638-N709 VanDerWaalsContact OD1-CG 3.3Å; N638-N709 PolarHBondContact OD1-ND2 2.86Å; Q701-N709 PolarHBondContact NE2-ND2 3.01Å; N709-H711 PolarHBondContact O-N 2.98Å; N709-H711 WeakPolarHBondContact OD1-CB 3.41Å; N709-H711 PolarHBondContact OD1-N 3.3Å; N709-H711 VanDerWaalsContact OD1-N 3.11Å; N709-T712 HydrophobicContact CB-CG2 4.11Å
710	P	89.1	Confident	87.7	Confident	86 Å²	86	60 Å²	60	56%	0.558	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.6	-177.5	30.4	-35.6	0	0	0	113.3
711	H	91.6	Very high	87.7	Confident	80 Å²	80	58.6 Å²	58.6	37%	0.37	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.8	-173.2	-55.1	-63	0	0	0	114	D635 A642 N646 N709	D635-H711 IonicContact OD1-CD2 3.5Å; D635-H711 IonicContact OD1-CE1 3.55Å; D635-H711 IonicContact OD1-NE2 3.43Å; D635-H711 PolarHBondContact OD1-NE2 3.03Å; A642-H711 HydrophobicContact CB-CB 3.44Å; A642-H711 VanDerWaalsContact CB-CB 3.44Å; N646-H711 PolarHBondContact ND2-O 2.81Å; N709-H711 PolarHBondContact O-N 2.98Å; N709-H711 WeakPolarHBondContact OD1-CB 3.41Å; N709-H711 PolarHBondContact OD1-N 3.3Å; N709-H711 VanDerWaalsContact OD1-N 3.11Å
712	T	93.1	Very high	87.8	Confident	21 Å²	21	58.8 Å²	58.8	13%	0.129	32%	0.315	C	S	.	.			trans	-146.9	145.2	-178.8	175.5	0	0	0	0	112.2	F641 A642 N646 N709 Y714	F641-T712 HydrophobicContact CD1-CG2 4.09Å; F641-T712 HydrophobicContact CE1-CG2 4.2Å; A642-T712 HydrophobicContact CB-CG2 3.92Å; N646-T712 PolarHBondContact OD1-OG1 3.04Å; N709-T712 HydrophobicContact CB-CG2 4.11Å; T712-Y714 WeakPolarHBondContact CG2-O 3.39Å; T712-Y714 WeakPolarHBondContact OG1-CB 3.42Å; T712-Y714 PolarHBondContact OG1-N 3.16Å; T712-Y714 PolarHBondContact OG1-O 3.24Å
713	R	93.3	Very high	88.2	Confident	178 Å²	178	58.7 Å²	58.7	67%	0.672	31%	0.313	S	S	*	.	S	Bend	trans	-81.7	-18.7	168.1	69.9	179.9	-174	173.6	5.3	113.1	E653	E653-R713 IonicContact OE1-CZ 3.29Å; E653-R713 IonicContact OE1-NH2 2.95Å; E653-R713 PolarHBondContact OE1-NH2 2.73Å; E653-R713 IonicContact OE2-NH2 2.66Å; E653-R713 PolarHBondContact OE2-NH2 3.1Å
714	Y	93.3	Very high	88.6	Confident	20 Å²	20	58.1 Å²	58.1	8%	0.078	30%	0.298	C	S	.	.			trans	-87.5	122.1	-176.4	-60	-77.5	0	0	0	110.6	P650 E653 T712 T718 L719	P650-Y714 WeakPolarHBondContact CD-OH 3.34Å; P650-Y714 HydrophobicContact CG-CE2 4.43Å; E653-Y714 WeakPolarHBondContact OE1-CE1 3.5Å; E653-Y714 VanDerWaalsContact OE1-CZ 3.26Å; E653-Y714 PolarHBondContact OE1-OH 2.72Å; T712-Y714 WeakPolarHBondContact CG2-O 3.39Å; T712-Y714 WeakPolarHBondContact OG1-CB 3.42Å; T712-Y714 PolarHBondContact OG1-N 3.16Å; T712-Y714 PolarHBondContact OG1-O 3.24Å; Y714-T718 WeakPolarHBondContact CA-OG1 3.26Å; Y714-L719 HydrophobicContact CD1-CD2 3.94Å; Y714-L719 HydrophobicContact CG-CD2 4.04Å
715	T	91.7	Very high	89	Confident	81 Å²	81	58.4 Å²	58.4	50%	0.497	30%	0.3	S	S	.	.			trans	-86.2	162	164.7	68.5	0	0	0	0	109.8	E717 T718 L719	T715-E717 PolarHBondContact O-N 3.42Å; T715-T718 PolarHBondContact N-OG1 2.88Å; T715-T718 PolarHBondContact O-N 3.12Å; T715-T718 VanDerWaalsContact O-N 3.13Å; T715-T718 PolarHBondContact O-OG1 2.79Å; T715-T718 PolarHBondContact OG1-N 3.1Å; T715-L719 PolarHBondContact O-N 2.61Å
716	M	90.5	Very high	89.6	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-37.9	176.4	-167.4	56.2	-172.7	0	0	111.7	F641 I691 L694 E695 H698 T718 L719 R720	F641-M716 HydrophobicContact CE2-CB 4.33Å; F641-M716 HydrophobicContact CE2-SD 3.92Å; F641-M716 HydrophobicContact CZ-CB 4.11Å; F641-M716 HydrophobicContact CZ-SD 4.16Å; I691-M716 HydrophobicContact CG1-CE 4.15Å; L694-M716 HydrophobicContact CB-CE 3.88Å; L694-M716 HydrophobicContact CB-SD 3.87Å; E695-M716 HydrophobicContact CB-CE 4.3Å; E695-M716 HydrophobicContact CG-CE 3.55Å; E695-M716 WeakPolarHBondContact OE1-CE 3.39Å; H698-M716 HydrophobicContact CB-CB 4.26Å; H698-M716 HydrophobicContact CB-CG 4.1Å; M716-T718 PolarHBondContact O-N 3.46Å; M716-L719 PolarHBondContact O-N 3.22Å; M716-L719 VanDerWaalsContact O-N 3.15Å; M716-R720 HydrophobicContact CE-CG 4.31Å; M716-R720 HydrophobicContact CG-CG 4.48Å; M716-R720 WeakPolarHBondContact O-CG 3.47Å; M716-R720 PolarHBondContact O-N 2.76Å
717	E	86.1	Confident	90	Very high	72 Å²	72	55.9 Å²	55.9	34%	0.336	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176.1	-164.6	59.3	-160	0	0	112.8	R325 T715 L719 R720 V721	R325-E717 IonicContact CZ-OE1 3.12Å; R325-E717 IonicContact CZ-OE2 3.26Å; R325-E717 IonicContact NH1-OE1 2.69Å; R325-E717 IonicContact NH1-OE2 2.87Å; R325-E717 PolarHBondContact NH1-OE2 3.16Å; R325-E717 VanDerWaalsContact NH2-CD 3.33Å; R325-E717 IonicContact NH2-OE1 2.66Å; R325-E717 PolarHBondContact NH2-OE1 2.81Å; R325-E717 IonicContact NH2-OE2 3.62Å; R325-E717 PolarHBondContact NH2-OE2 2.78Å; T715-E717 PolarHBondContact O-N 3.42Å; E717-L719 PolarHBondContact O-N 2.74Å; E717-R720 PolarHBondContact O-N 3.31Å; E717-R720 IonicContact OE2-NH1 3.76Å; E717-R720 PolarHBondContact OE2-NH1 3.13Å; E717-V721 WeakPolarHBondContact O-CG2 3.43Å; E717-V721 PolarHBondContact O-N 3.09Å
718	T	91.7	Very high	90.5	Very high	70 Å²	70	51.4 Å²	51.4	43%	0.429	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-31.2	175.9	56.3	0	0	0	0	113.2	Y714 T715 M716 G722	Y714-T718 WeakPolarHBondContact CA-OG1 3.26Å; T715-T718 PolarHBondContact N-OG1 2.88Å; T715-T718 PolarHBondContact O-N 3.12Å; T715-T718 VanDerWaalsContact O-N 3.13Å; T715-T718 PolarHBondContact O-OG1 2.79Å; T715-T718 PolarHBondContact OG1-N 3.1Å; M716-T718 PolarHBondContact O-N 3.46Å; T718-G722 PolarHBondContact O-N 3.01Å; T718-G722 VanDerWaalsContact O-N 3.13Å
719	L	93.1	Very high	90.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-78.1	-38.8	178	-61.2	174.9	0	0	0	111.8	F641 A645 F648 L652 L694 Y714 T715 M716 E717 W723	F641-L719 HydrophobicContact CZ-CD1 4.34Å; A645-L719 HydrophobicContact CB-CD1 3.78Å; F648-L719 HydrophobicContact CD1-CB 4.35Å; F648-L719 HydrophobicContact CD1-CD1 4.41Å; F648-L719 HydrophobicContact CD1-CD2 4.06Å; F648-L719 HydrophobicContact CE1-CB 4.3Å; L652-L719 HydrophobicContact CD1-CD2 4.26Å; L694-L719 HydrophobicContact CD1-CD1 3.96Å; L694-L719 HydrophobicContact CD2-CD1 4.29Å; Y714-L719 HydrophobicContact CD1-CD2 3.94Å; Y714-L719 HydrophobicContact CG-CD2 4.04Å; T715-L719 PolarHBondContact O-N 2.61Å; M716-L719 PolarHBondContact O-N 3.22Å; M716-L719 VanDerWaalsContact O-N 3.15Å; E717-L719 PolarHBondContact O-N 2.74Å; L719-W723 WeakPolarHBondContact O-CB 3.4Å; L719-W723 PolarHBondContact O-N 2.94Å
720	R	88.8	Confident	91.1	Very high	22 Å²	22	46.6 Å²	46.6	8%	0.083	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-55.4	172.7	-71.3	173.9	-177.4	155.8	-3.5	110.9	E384 E695 M716 E717 G722 W723 E724	E384-R720 IonicContact OE2-NH1 3.77Å; E695-R720 IonicContact OE1-CZ 2.9Å; E695-R720 IonicContact OE1-NE 3.82Å; E695-R720 PolarHBondContact OE1-NE 2.99Å; E695-R720 IonicContact OE1-NH2 3.79Å; E695-R720 PolarHBondContact OE1-NH2 3.36Å; E695-R720 VanDerWaalsContact OE1-NH2 3.16Å; E695-R720 IonicContact OE2-CZ 2.69Å; E695-R720 IonicContact OE2-NE 3.42Å; E695-R720 IonicContact OE2-NH2 2.72Å; E695-R720 PolarHBondContact OE2-NH2 3.48Å; M716-R720 HydrophobicContact CE-CG 4.31Å; M716-R720 HydrophobicContact CG-CG 4.48Å; M716-R720 WeakPolarHBondContact O-CG 3.47Å; M716-R720 PolarHBondContact O-N 2.76Å; E717-R720 PolarHBondContact O-N 3.31Å; E717-R720 IonicContact OE2-NH1 3.76Å; E717-R720 PolarHBondContact OE2-NH1 3.13Å; R720-G722 VanDerWaalsContact C-N 3.32Å; R720-G722 PolarHBondContact O-N 3.02Å; R720-W723 WeakPolarHBondContact O-CB 3.12Å; R720-W723 PolarHBondContact O-N 3.06Å; R720-W723 VanDerWaalsContact O-N 3.14Å; R720-E724 WeakPolarHBondContact O-CB 3.48Å; R720-E724 WeakPolarHBondContact O-CG 3.33Å; R720-E724 PolarHBondContact O-N 3.08Å
721	V	88.6	Confident	91.2	Very high	73 Å²	73	45.4 Å²	45.4	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-59.3	-42.3	179.7	175.1	0	0	0	0	111.2	E717 W723 Q725	E717-V721 WeakPolarHBondContact O-CG2 3.43Å; E717-V721 PolarHBondContact O-N 3.09Å; V721-W723 PolarHBondContact O-N 3.43Å; V721-Q725 WeakPolarHBondContact O-CB 3.45Å; V721-Q725 PolarHBondContact O-N 3.36Å
722	G	91.6	Very high	91	Very high	13 Å²	13	46 Å²	46	13%	0.134	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-38.8	176.9	0	0	0	0	0	113.8	T718 R720 L726	T718-G722 PolarHBondContact O-N 3.01Å; T718-G722 VanDerWaalsContact O-N 3.13Å; R720-G722 VanDerWaalsContact C-N 3.32Å; R720-G722 PolarHBondContact O-N 3.02Å; G722-L726 VanDerWaalsContact O-CB 3.26Å; G722-L726 WeakPolarHBondContact O-CB 3.5Å; G722-L726 PolarHBondContact O-N 3.22Å
723	W	92	Very high	90.9	Very high	30 Å²	30	45.2 Å²	45.2	11%	0.114	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-49	175.3	169.8	-90.9	0	0	0	112.3	F648 L652 L684 W687 K688 I691 L719 R720 V721 L726 K727	F648-W723 AromaticContact CE2-CE3 3.97Å; F648-W723 HydrophobicContact CE2-CE3 3.97Å; F648-W723 HydrophobicContact CE2-CZ3 4.22Å; F648-W723 HydrophobicContact CZ-CB 4.44Å; F648-W723 HydrophobicContact CZ-CD2 4.33Å; F648-W723 AromaticContact CZ-CE3 3.53Å; F648-W723 HydrophobicContact CZ-CE3 3.53Å; F648-W723 HydrophobicContact CZ-CZ3 4.1Å; L652-W723 HydrophobicContact CD2-CB 4.31Å; L652-W723 HydrophobicContact CD2-CE3 4.48Å; L684-W723 HydrophobicContact CD1-CD2 4.4Å; L684-W723 HydrophobicContact CD1-CE3 3.43Å; L684-W723 VanDerWaalsContact CD1-CE3 3.43Å; L684-W723 HydrophobicContact CD1-CH2 4.24Å; L684-W723 HydrophobicContact CD1-CZ3 3.35Å; L684-W723 HydrophobicContact CG-CE3 3.95Å; L684-W723 HydrophobicContact CG-CH2 3.97Å; L684-W723 HydrophobicContact CG-CZ3 3.58Å; L684-W723 WeakPolarHBondContact O-CH2 3.26Å; L684-W723 VanDerWaalsContact O-CZ3 3.27Å; L684-W723 WeakPolarHBondContact O-CZ3 3.44Å; W687-W723 HydrophobicContact CB-CZ3 3.93Å; K688-W723 HydrophobicContact CB-CH2 4.32Å; I691-W723 HydrophobicContact CD1-CB 4.01Å; I691-W723 HydrophobicContact CD1-CD2 3.92Å; I691-W723 HydrophobicContact CD1-CG 3.7Å; I691-W723 HydrophobicContact CG2-CH2 4.36Å; I691-W723 HydrophobicContact CG2-CZ2 4.33Å; L719-W723 WeakPolarHBondContact O-CB 3.4Å; L719-W723 PolarHBondContact O-N 2.94Å; R720-W723 WeakPolarHBondContact O-CB 3.12Å; R720-W723 PolarHBondContact O-N 3.06Å; R720-W723 VanDerWaalsContact O-N 3.14Å; V721-W723 PolarHBondContact O-N 3.43Å; W723-L726 PolarHBondContact O-N 3.46Å; W723-K727 PolarHBondContact O-N 3.31Å
724	E	89.2	Confident	90.8	Very high	37 Å²	37	37.3 Å²	37.3	17%	0.173	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-46.1	177.9	-73.9	176.7	-172.7	0	0	111.3	L333 R720 L726 K727 T728	L333-E724 HydrophobicContact CD2-CB 3.57Å; L333-E724 HydrophobicContact CD2-CG 3.55Å; R720-E724 WeakPolarHBondContact O-CB 3.48Å; R720-E724 WeakPolarHBondContact O-CG 3.33Å; R720-E724 PolarHBondContact O-N 3.08Å; E724-L726 PolarHBondContact O-N 3.38Å; E724-K727 PolarHBondContact O-N 2.91Å; E724-T728 WeakPolarHBondContact O-CB 3.47Å; E724-T728 PolarHBondContact O-N 3.08Å; E724-T728 PolarHBondContact O-OG1 2.81Å
725	Q	91	Very high	90.5	Very high	86 Å²	86	36.8 Å²	36.8	40%	0.402	19%	0.187	S	C	.	.	H	α-helix	trans	-62.4	-41.8	175.4	-173.3	68.9	62.9	0	0	112	L656 V721 T728 N729	L656-Q725 HydrophobicContact CD2-CB 4.24Å; L656-Q725 HydrophobicContact CD2-CG 3.81Å; V721-Q725 WeakPolarHBondContact O-CB 3.45Å; V721-Q725 PolarHBondContact O-N 3.36Å; Q725-T728 PolarHBondContact O-N 3.49Å; Q725-N729 PolarHBondContact NE2-OD1 3.34Å; Q725-N729 VanDerWaalsContact O-CB 3.31Å; Q725-N729 WeakPolarHBondContact O-CB 3.35Å; Q725-N729 PolarHBondContact O-N 2.83Å; Q725-N729 PolarHBondContact O-OD1 2.91Å
726	L	93.2	Very high	90.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.6	-46	-179.9	179.6	55.1	0	0	0	111.4	L652 N655 L656 V659 L684 G722 W723 E724 T728 N729 I730	L652-L726 HydrophobicContact CD2-CD2 3.84Å; N655-L726 HydrophobicContact CB-CD1 3.94Å; N655-L726 HydrophobicContact CB-CD2 3.6Å; N655-L726 HydrophobicContact CB-CG 4.45Å; L656-L726 HydrophobicContact CD2-CB 3.88Å; L656-L726 HydrophobicContact CD2-CD1 4.15Å; L656-L726 HydrophobicContact CG-CB 4.28Å; L656-L726 HydrophobicContact CG-CD1 4.33Å; V659-L726 HydrophobicContact CG2-CD1 3.83Å; L684-L726 HydrophobicContact CD1-CD2 3.65Å; L684-L726 HydrophobicContact CD1-CG 4.31Å; L684-L726 HydrophobicContact CD2-CD2 4.43Å; L684-L726 HydrophobicContact CD2-CG 4.2Å; G722-L726 VanDerWaalsContact O-CB 3.26Å; G722-L726 WeakPolarHBondContact O-CB 3.5Å; G722-L726 PolarHBondContact O-N 3.22Å; W723-L726 PolarHBondContact O-N 3.46Å; E724-L726 PolarHBondContact O-N 3.38Å; L726-T728 VanDerWaalsContact C-N 3.34Å; L726-T728 PolarHBondContact O-N 3.22Å; L726-N729 PolarHBondContact O-N 2.81Å; L726-I730 HydrophobicContact CD1-CD1 4.09Å; L726-I730 HydrophobicContact CD1-CG1 4.24Å; L726-I730 HydrophobicContact CG-CD1 4.05Å; L726-I730 VanDerWaalsContact O-CG1 3.27Å; L726-I730 WeakPolarHBondContact O-CG1 3.12Å; L726-I730 PolarHBondContact O-N 3.06Å
727	K	91.8	Very high	90.1	Very high	44 Å²	44	37.3 Å²	37.3	19%	0.191	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-45.3	175.4	-167	-176.5	-176.5	-164.8	0	111.6	D334 L684 W723 E724 I730 K731	D334-K727 WeakPolarHBondContact OD1-CE 3.14Å; D334-K727 IonicContact OD1-NZ 3.54Å; D334-K727 PolarHBondContact OD1-NZ 3.14Å; D334-K727 IonicContact OD2-NZ 2.67Å; D334-K727 PolarHBondContact OD2-NZ 3.12Å; L684-K727 HydrophobicContact CD2-CB 4.23Å; W723-K727 PolarHBondContact O-N 3.31Å; E724-K727 PolarHBondContact O-N 2.91Å; K727-I730 PolarHBondContact O-N 3.46Å; K727-K731 WeakPolarHBondContact O-CG 3.35Å; K727-K731 PolarHBondContact O-N 2.93Å; K727-K731 VanDerWaalsContact O-N 3.09Å
728	T	89.5	Confident	90.2	Very high	13 Å²	13	38.1 Å²	38.1	8%	0.08	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175.9	-54.5	0	0	0	0	111.5	T337 E724 Q725 L726 I730 K731 R732	T337-T728 HydrophobicContact CG2-CG2 4.19Å; E724-T728 WeakPolarHBondContact O-CB 3.47Å; E724-T728 PolarHBondContact O-N 3.08Å; E724-T728 PolarHBondContact O-OG1 2.81Å; Q725-T728 PolarHBondContact O-N 3.49Å; L726-T728 VanDerWaalsContact C-N 3.34Å; L726-T728 PolarHBondContact O-N 3.22Å; T728-I730 PolarHBondContact O-N 2.89Å; T728-K731 PolarHBondContact O-N 3.27Å; T728-R732 HydrophobicContact CG2-CG 4.42Å; T728-R732 WeakPolarHBondContact O-CB 3.35Å; T728-R732 WeakPolarHBondContact O-CG 3.32Å; T728-R732 PolarHBondContact O-N 2.92Å
729	N	91.4	Very high	89.7	Confident	47 Å²	47	35.4 Å²	35.4	25%	0.251	17%	0.17	S	C	.	.	H	α-helix	trans	-64.9	-38.9	179.9	-73.9	-1.2	0	0	0	112.6	L656 V659 Q725 L726 G733	L656-N729 WeakPolarHBondContact CD2-ND2 3.26Å; V659-N729 HydrophobicContact CG1-CB 4.07Å; Q725-N729 PolarHBondContact NE2-OD1 3.34Å; Q725-N729 VanDerWaalsContact O-CB 3.31Å; Q725-N729 WeakPolarHBondContact O-CB 3.35Å; Q725-N729 PolarHBondContact O-N 2.83Å; Q725-N729 PolarHBondContact O-OD1 2.91Å; L726-N729 PolarHBondContact O-N 2.81Å; N729-G733 PolarHBondContact O-N 3.44Å
730	I	92.1	Very high	89.1	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-50.5	174.2	-68	162.4	0	0	0	109.8	V659 V680 E681 L684 L726 K727 T728 R732 G733 Q734	V659-I730 HydrophobicContact CG2-CG1 3.68Å; V680-I730 HydrophobicContact CG1-CD1 3.86Å; V680-I730 HydrophobicContact CG1-CG1 4.27Å; E681-I730 HydrophobicContact CB-CG2 4Å; E681-I730 HydrophobicContact CG-CG2 4.34Å; L684-I730 HydrophobicContact CD2-CD1 3.8Å; L726-I730 HydrophobicContact CD1-CD1 4.09Å; L726-I730 HydrophobicContact CD1-CG1 4.24Å; L726-I730 HydrophobicContact CG-CD1 4.05Å; L726-I730 VanDerWaalsContact O-CG1 3.27Å; L726-I730 WeakPolarHBondContact O-CG1 3.12Å; L726-I730 PolarHBondContact O-N 3.06Å; K727-I730 PolarHBondContact O-N 3.46Å; T728-I730 PolarHBondContact O-N 2.89Å; I730-R732 PolarHBondContact O-N 2.83Å; I730-G733 PolarHBondContact O-N 2.93Å; I730-Q734 HydrophobicContact CG2-CG 4.43Å; I730-Q734 WeakPolarHBondContact O-CB 3.27Å; I730-Q734 WeakPolarHBondContact O-CG 3.26Å; I730-Q734 PolarHBondContact O-N 3.19Å
731	K	90.9	Very high	88.7	Confident	62 Å²	62	39.6 Å²	39.6	27%	0.27	19%	0.188	S	C	.	.	H	α-helix	trans	-65.4	-38.9	-178.2	-73.4	-74.6	160.1	-134.8	0	113.4	T337 N341 E681 K727 T728 N735	T337-K731 HydrophobicContact CG2-CB 3.59Å; T337-K731 HydrophobicContact CG2-CG 4.44Å; N341-K731 PolarHBondContact ND2-O 3.28Å; E681-K731 WeakPolarHBondContact OE1-CE 3.38Å; E681-K731 IonicContact OE1-NZ 2.94Å; E681-K731 PolarHBondContact OE1-NZ 3.38Å; E681-K731 IonicContact OE2-NZ 2.82Å; E681-K731 PolarHBondContact OE2-NZ 3.25Å; K727-K731 WeakPolarHBondContact O-CG 3.35Å; K727-K731 PolarHBondContact O-N 2.93Å; K727-K731 VanDerWaalsContact O-N 3.09Å; T728-K731 PolarHBondContact O-N 3.27Å; K731-N735 PolarHBondContact O-N 2.91Å
732	R	88.9	Confident	88	Confident	92 Å²	92	38.1 Å²	38.1	35%	0.347	18%	0.179	S	C	.	.	H	α-helix	trans	-65.7	-43.6	172.3	-73.4	177	174.4	175.5	-3.3	111.3	E340 T728 I730 N735 E736	E340-R732 IonicContact OE1-NH2 2.79Å; E340-R732 PolarHBondContact OE1-NH2 3.26Å; E340-R732 IonicContact OE2-CZ 2.7Å; E340-R732 IonicContact OE2-NE 3.95Å; E340-R732 PolarHBondContact OE2-NE 2.59Å; E340-R732 IonicContact OE2-NH2 2.7Å; E340-R732 PolarHBondContact OE2-NH2 2.86Å; T728-R732 HydrophobicContact CG2-CG 4.42Å; T728-R732 WeakPolarHBondContact O-CB 3.35Å; T728-R732 WeakPolarHBondContact O-CG 3.32Å; T728-R732 PolarHBondContact O-N 2.92Å; I730-R732 PolarHBondContact O-N 2.83Å; R732-N735 PolarHBondContact O-N 3.47Å; R732-E736 PolarHBondContact O-N 3.03Å
733	G	89.8	Confident	86.9	Confident	4 Å²	4	38.3 Å²	38.3	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-41.4	178.4	0	0	0	0	0	113.6	N729 I730 E736 I737	N729-G733 PolarHBondContact O-N 3.44Å; I730-G733 PolarHBondContact O-N 2.93Å; G733-E736 PolarHBondContact O-N 3.31Å; G733-I737 WeakPolarHBondContact O-CD1 3.39Å; G733-I737 WeakPolarHBondContact O-CG1 3.35Å; G733-I737 PolarHBondContact O-N 2.63Å
734	Q	90.8	Very high	85.7	Confident	12 Å²	12	40 Å²	40	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-51.4	171.5	-77.5	168.1	-30.2	0	0	110	L674 L677 N678 E681 I730 E736 I737 E738	L674-Q734 HydrophobicContact CD1-CB 4.09Å; L674-Q734 HydrophobicContact CD1-CG 3.99Å; L677-Q734 HydrophobicContact CB-CG 4.02Å; L677-Q734 HydrophobicContact CD1-CG 4.11Å; N678-Q734 PolarHBondContact OD1-NE2 2.86Å; E681-Q734 PolarHBondContact OE2-NE2 3.33Å; E681-Q734 PolarHBondContact OE2-OE1 3.28Å; I730-Q734 HydrophobicContact CG2-CG 4.43Å; I730-Q734 WeakPolarHBondContact O-CB 3.27Å; I730-Q734 WeakPolarHBondContact O-CG 3.26Å; I730-Q734 PolarHBondContact O-N 3.19Å; Q734-E736 PolarHBondContact O-N 3.04Å; Q734-I737 PolarHBondContact O-N 3Å; Q734-E738 WeakPolarHBondContact O-CB 3.22Å; Q734-E738 VanDerWaalsContact O-CG 3.3Å; Q734-E738 WeakPolarHBondContact O-CG 3.28Å; Q734-E738 PolarHBondContact O-N 3.35Å
735	N	88	Confident	84.5	Confident	9 Å²	9	43.7 Å²	43.7	5%	0.048	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-36.6	-179.2	-169.8	-109.1	0	0	0	113.6	N341 T345 K731 R732 I737 N739	N341-N735 HydrophobicContact CB-CB 4.03Å; N341-N735 VanDerWaalsContact CG-CB 3.43Å; N341-N735 PolarHBondContact O-OD1 3.47Å; N341-N735 WeakPolarHBondContact OD1-CB 3.26Å; T345-N735 PolarHBondContact OG1-ND2 3.06Å; K731-N735 PolarHBondContact O-N 2.91Å; R732-N735 PolarHBondContact O-N 3.47Å; N735-I737 VanDerWaalsContact C-N 3.35Å; N735-N739 VanDerWaalsContact O-CB 3.25Å; N735-N739 WeakPolarHBondContact O-CB 3.21Å; N735-N739 VanDerWaalsContact O-CG 3.26Å; N735-N739 PolarHBondContact O-N 3.39Å; N735-N739 PolarHBondContact O-ND2 3.06Å; N735-N739 PolarHBondContact OD1-ND2 2.66Å
736	E	87.2	Confident	83.1	Confident	96 Å²	96	44 Å²	44	45%	0.449	21%	0.21	S	C	.	.	H	α-helix	trans	-61.4	-44.2	173.8	-168.2	-168.3	138.3	0	0	111.2	V663 R732 G733 Q734 N739 R740	V663-E736 WeakPolarHBondContact CG1-OE2 3.4Å; R732-E736 PolarHBondContact O-N 3.03Å; G733-E736 PolarHBondContact O-N 3.31Å; Q734-E736 PolarHBondContact O-N 3.04Å; E736-N739 PolarHBondContact O-N 3.41Å; E736-R740 VanDerWaalsContact O-CG 3.28Å; E736-R740 WeakPolarHBondContact O-CG 3.4Å; E736-R740 PolarHBondContact O-N 3.48Å; E736-R740 IonicContact OE1-NH1 3.76Å
737	I	87.4	Confident	81.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.7	-44.6	178.4	-68.9	159.7	0	0	0	111.1	V663 L670 Q673 L674 L677 G733 Q734 N735 N739 R740 I741	V663-I737 HydrophobicContact CG2-CD1 4.32Å; L670-I737 HydrophobicContact CB-CG2 4.1Å; L670-I737 VanDerWaalsContact O-CG2 3.3Å; L670-I737 WeakPolarHBondContact O-CG2 3.26Å; Q673-I737 HydrophobicContact CB-CD1 3.65Å; Q673-I737 HydrophobicContact CB-CG1 4.37Å; L674-I737 HydrophobicContact CB-CG2 4.01Å; L674-I737 HydrophobicContact CD1-CG2 4.49Å; L677-I737 HydrophobicContact CD1-CD1 3.62Å; L677-I737 HydrophobicContact CG-CD1 4.36Å; G733-I737 WeakPolarHBondContact O-CD1 3.39Å; G733-I737 WeakPolarHBondContact O-CG1 3.35Å; G733-I737 PolarHBondContact O-N 2.63Å; Q734-I737 PolarHBondContact O-N 3Å; N735-I737 VanDerWaalsContact C-N 3.35Å; I737-N739 VanDerWaalsContact C-N 3.28Å; I737-N739 PolarHBondContact O-N 3.15Å; I737-R740 CarbonylContact O-C 3.42Å; I737-R740 WeakPolarHBondContact O-CA 3.25Å; I737-R740 WeakPolarHBondContact O-CB 3.47Å; I737-R740 PolarHBondContact O-N 3.36Å; I737-I741 HydrophobicContact CG2-CD1 3.97Å; I737-I741 HydrophobicContact CG2-CG1 4.42Å; I737-I741 WeakPolarHBondContact O-CG1 3.22Å; I737-I741 PolarHBondContact O-N 3.09Å
738	E	86.6	Confident	79.6	Confident	88 Å²	88	46.9 Å²	46.9	41%	0.411	23%	0.231	S	C	.	.	H	α-helix	trans	-58.7	-38.8	174.4	-73.4	171	168.9	0	0	112.3	L674 Q734 I741 T742	L674-E738 HydrophobicContact CD1-CG 4.24Å; L674-E738 HydrophobicContact CD2-CG 4.3Å; Q734-E738 WeakPolarHBondContact O-CB 3.22Å; Q734-E738 VanDerWaalsContact O-CG 3.3Å; Q734-E738 WeakPolarHBondContact O-CG 3.28Å; Q734-E738 PolarHBondContact O-N 3.35Å; E738-I741 PolarHBondContact O-N 3.1Å; E738-T742 WeakPolarHBondContact O-CB 3.49Å; E738-T742 PolarHBondContact O-N 3.5Å; E738-T742 PolarHBondContact O-OG1 2.87Å
739	N	81.1	Confident	78.1	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-68	-34.9	173.9	-80.3	-42.4	0	0	0	112.5	T345 T348 N735 E736 I737 A743	T345-N739 WeakPolarHBondContact CA-OD1 3.25Å; T348-N739 HydrophobicContact CG2-CB 4.07Å; N735-N739 VanDerWaalsContact O-CB 3.25Å; N735-N739 WeakPolarHBondContact O-CB 3.21Å; N735-N739 VanDerWaalsContact O-CG 3.26Å; N735-N739 PolarHBondContact O-N 3.39Å; N735-N739 PolarHBondContact O-ND2 3.06Å; N735-N739 PolarHBondContact OD1-ND2 2.66Å; E736-N739 PolarHBondContact O-N 3.41Å; I737-N739 VanDerWaalsContact C-N 3.28Å; I737-N739 PolarHBondContact O-N 3.15Å; N739-A743 VanDerWaalsContact O-CB 3.28Å; N739-A743 WeakPolarHBondContact O-CB 3.38Å; N739-A743 PolarHBondContact O-N 3.37Å
740	R	81.4	Confident	76.6	Confident	83 Å²	83	48.3 Å²	48.3	31%	0.313	24%	0.241	S	C	.	.	H	α-helix	trans	-70.4	-37.3	172.7	-71.6	165.7	62.6	-169	-5.7	112.2	V663 L670 E736 I737 A743 N744	V663-R740 PolarHBondContact O-NH1 3.12Å; V663-R740 VanDerWaalsContact O-NH1 3.16Å; L670-R740 HydrophobicContact CD1-CB 3.84Å; L670-R740 HydrophobicContact CD2-CB 4.33Å; E736-R740 VanDerWaalsContact O-CG 3.28Å; E736-R740 WeakPolarHBondContact O-CG 3.4Å; E736-R740 PolarHBondContact O-N 3.48Å; E736-R740 IonicContact OE1-NH1 3.76Å; I737-R740 CarbonylContact O-C 3.42Å; I737-R740 WeakPolarHBondContact O-CA 3.25Å; I737-R740 WeakPolarHBondContact O-CB 3.47Å; I737-R740 PolarHBondContact O-N 3.36Å; R740-A743 PolarHBondContact O-N 2.96Å; R740-N744 PolarHBondContact O-N 3.45Å
741	I	80.3	Confident	75.2	Confident	29 Å²	29	56.5 Å²	56.5	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-51.5	172.2	-66.8	167.4	0	0	0	109.2	L670 L674 I737 E738 A743 N744 D745	L670-I741 HydrophobicContact CB-CD1 3.95Å; L670-I741 HydrophobicContact CB-CG1 3.5Å; L670-I741 VanDerWaalsContact CB-CG1 3.5Å; L670-I741 HydrophobicContact CD1-CB 4.47Å; L670-I741 HydrophobicContact CD1-CG1 3.71Å; L670-I741 HydrophobicContact CG-CG1 4.25Å; L674-I741 HydrophobicContact CD2-CD1 4.27Å; I737-I741 HydrophobicContact CG2-CD1 3.97Å; I737-I741 HydrophobicContact CG2-CG1 4.42Å; I737-I741 WeakPolarHBondContact O-CG1 3.22Å; I737-I741 PolarHBondContact O-N 3.09Å; E738-I741 PolarHBondContact O-N 3.1Å; I741-A743 PolarHBondContact O-N 2.69Å; I741-N744 CarbonylContact O-C 3.58Å; I741-N744 WeakPolarHBondContact O-CA 3.37Å; I741-N744 WeakPolarHBondContact O-CB 3.41Å; I741-N744 PolarHBondContact O-N 3.41Å; I741-D745 PolarHBondContact O-N 3.2Å
742	T	73.3	Confident	74	Confident	41 Å²	41	61.3 Å²	61.3	25%	0.252	30%	0.303	S	S	.	.	H	α-helix	trans	-54.9	-39.4	175.8	-56.3	0	0	0	0	111.7	L352 E738 N744 Y746	L352-T742 HydrophobicContact CD1-CG2 4.2Å; E738-T742 WeakPolarHBondContact O-CB 3.49Å; E738-T742 PolarHBondContact O-N 3.5Å; E738-T742 PolarHBondContact O-OG1 2.87Å; T742-N744 VanDerWaalsContact C-N 3.35Å; T742-Y746 WeakPolarHBondContact O-CB 3.42Å; T742-Y746 PolarHBondContact O-N 3.45Å
743	A	68.8	Low	72.9	Confident	18 Å²	18	60.2 Å²	60.2	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-73.2	-20.7	176.2	0	0	0	0	0	114.5	L352 N739 R740 I741 R747	L352-A743 HydrophobicContact CD1-CB 4.05Å; L352-A743 HydrophobicContact CD2-CB 4.09Å; N739-A743 VanDerWaalsContact O-CB 3.28Å; N739-A743 WeakPolarHBondContact O-CB 3.38Å; N739-A743 PolarHBondContact O-N 3.37Å; R740-A743 PolarHBondContact O-N 2.96Å; I741-A743 PolarHBondContact O-N 2.69Å; A743-R747 WeakPolarHBondContact O-CG 3.43Å; A743-R747 PolarHBondContact O-NE 3.37Å
744	N	66.7	Low	71.9	Confident	64 Å²	64	62 Å²	62	34%	0.342	31%	0.31	S	S	.	.	H	α-helix	trans	-81.6	-46.9	169.8	-77.8	-11.4	0	0	0	110.8	L670 R740 I741 T742 Y746 R747	L670-N744 VanDerWaalsContact CD1-ND2 3.34Å; L670-N744 WeakPolarHBondContact CD1-ND2 3.33Å; R740-N744 PolarHBondContact O-N 3.45Å; I741-N744 CarbonylContact O-C 3.58Å; I741-N744 WeakPolarHBondContact O-CA 3.37Å; I741-N744 WeakPolarHBondContact O-CB 3.41Å; I741-N744 PolarHBondContact O-N 3.41Å; T742-N744 VanDerWaalsContact C-N 3.35Å; N744-Y746 VanDerWaalsContact C-N 3.28Å; N744-Y746 PolarHBondContact O-N 3.37Å; N744-R747 VanDerWaalsContact O-CB 3.28Å; N744-R747 WeakPolarHBondContact O-CB 3.42Å; N744-R747 PolarHBondContact O-N 3.39Å
745	D	65.2	Low	71.1	Confident	115 Å²	115	64.9 Å²	64.9	62%	0.615	32%	0.324	S	S	*	.	H	α-helix	trans	-59.2	-40.8	177	-67.4	-19.8	0	0	0	111.3	I741 R747 G748	I741-D745 PolarHBondContact O-N 3.2Å; D745-R747 PolarHBondContact O-N 3.45Å; D745-G748 PolarHBondContact O-N 2.9Å
746	Y	60.2	Low	70.6	Confident	94 Å²	94	70 Å²	70	37%	0.369	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.3	175.7	-162.4	-86.5	0	0	0	113.6	L352 A353 T742 N744 G748	L352-Y746 HydrophobicContact CB-CD1 3.72Å; L352-Y746 HydrophobicContact CB-CD2 4.17Å; L352-Y746 HydrophobicContact CB-CE1 4.03Å; L352-Y746 HydrophobicContact CB-CE2 4.42Å; L352-Y746 HydrophobicContact CB-CG 3.84Å; L352-Y746 HydrophobicContact CD1-CG 4.28Å; L352-Y746 HydrophobicContact CD2-CD1 3.99Å; L352-Y746 HydrophobicContact CD2-CG 4.29Å; L352-Y746 HydrophobicContact CG-CD1 4.34Å; L352-Y746 HydrophobicContact CG-CG 4.35Å; L352-Y746 WeakPolarHBondContact O-CE1 3.43Å; L352-Y746 VanDerWaalsContact O-CZ 3.23Å; L352-Y746 PolarHBondContact O-OH 3.44Å; A353-Y746 WeakPolarHBondContact CA-OH 3.37Å; T742-Y746 WeakPolarHBondContact O-CB 3.42Å; T742-Y746 PolarHBondContact O-N 3.45Å; N744-Y746 VanDerWaalsContact C-N 3.28Å; N744-Y746 PolarHBondContact O-N 3.37Å; Y746-G748 VanDerWaalsContact C-N 3.26Å
747	R	57.5	Low	70.2	Confident	66 Å²	66	65.7 Å²	65.7	25%	0.249	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-19.1	168.9	-67.7	170.5	-172.8	-153.1	-3.8	111.9	A743 N744 D745 V749 S823 M827	A743-R747 WeakPolarHBondContact O-CG 3.43Å; A743-R747 PolarHBondContact O-NE 3.37Å; N744-R747 VanDerWaalsContact O-CB 3.28Å; N744-R747 WeakPolarHBondContact O-CB 3.42Å; N744-R747 PolarHBondContact O-N 3.39Å; D745-R747 PolarHBondContact O-N 3.45Å; R747-V749 HydrophobicContact CB-CG2 4.23Å; R747-V749 WeakPolarHBondContact O-CG2 3.38Å; R747-V749 PolarHBondContact O-N 3.44Å; R747-S823 VanDerWaalsContact O-CB 3.3Å; R747-S823 WeakPolarHBondContact O-CB 3.47Å; R747-M827 VanDerWaalsContact C-SD 3.52Å; R747-M827 WeakPolarHBondContact O-CG 3.49Å
748	G	54.8	Low	69.9	Low	37 Å²	37	70.5 Å²	70.5	38%	0.381	35%	0.346	S	S	.	.			trans	63.1	9.2	-179.8	0	0	0	0	0	114.8	D745 Y746 M827	D745-G748 PolarHBondContact O-N 2.9Å; Y746-G748 VanDerWaalsContact C-N 3.26Å; G748-M827 VanDerWaalsContact CA-SD 3.55Å; G748-M827 PolarHBondContact N-SD 2.71Å; G748-M827 VanDerWaalsContact N-SD 3.44Å
749	V	57.5	Low	69.7	Low	14 Å²	14	74.1 Å²	74.1	9%	0.085	36%	0.356	C	S	.	.			trans	-92.2	117.8	179.9	-170.3	0	0	0	0	107.7	R747 Q753 I754 M819	R747-V749 HydrophobicContact CB-CG2 4.23Å; R747-V749 WeakPolarHBondContact O-CG2 3.38Å; R747-V749 PolarHBondContact O-N 3.44Å; V749-Q753 HydrophobicContact CG1-CB 3.33Å; V749-Q753 HydrophobicContact CG1-CG 4.5Å; V749-I754 HydrophobicContact CB-CG1 3.93Å; V749-I754 HydrophobicContact CG1-CG1 3.64Å; V749-M819 HydrophobicContact CB-CE 4.35Å; V749-M819 HydrophobicContact CG1-CE 4.16Å; V749-M819 HydrophobicContact CG2-CE 4.23Å
750	T	60.3	Low	69.9	Low	76 Å²	76	74.8 Å²	74.8	47%	0.466	36%	0.361	S	S	.	.			trans	-59.7	152.7	175.7	60.6	0	0	0	0	110.9	Q752 Q753 I754	T750-Q752 PolarHBondContact O-N 3.14Å; T750-Q752 VanDerWaalsContact O-N 3.11Å; T750-Q753 CarbonylContact O-C 3.56Å; T750-Q753 WeakPolarHBondContact O-CA 3.35Å; T750-Q753 WeakPolarHBondContact O-CB 3.48Å; T750-Q753 PolarHBondContact O-N 3.18Å; T750-Q753 VanDerWaalsContact OG1-CD 3.31Å; T750-Q753 VanDerWaalsContact OG1-CG 3.27Å; T750-Q753 WeakPolarHBondContact OG1-CG 3.47Å; T750-Q753 PolarHBondContact OG1-N 3.35Å; T750-Q753 PolarHBondContact OG1-OE1 2.74Å; T750-I754 WeakPolarHBondContact O-CG1 3.31Å; T750-I754 PolarHBondContact O-N 2.85Å
751	E	62.4	Low	70.2	Confident	173 Å²	173	70.9 Å²	70.9	81%	0.808	35%	0.346	S	S	*	.	H	α-helix	trans	-54.8	-34.8	178.6	-167.3	-179.7	-164	0	0	112.3	I754 E755	E751-I754 PolarHBondContact O-N 2.7Å; E751-E755 WeakPolarHBondContact O-CB 3.41Å; E751-E755 PolarHBondContact O-N 2.94Å
752	Q	66.6	Low	70.4	Confident	164 Å²	164	74 Å²	74	77%	0.766	36%	0.363	S	S	*	.	H	α-helix	trans	-62.3	-45.3	172.7	-68.1	-176.1	-11.4	0	0	112.8	T750 E755 E756	T750-Q752 PolarHBondContact O-N 3.14Å; T750-Q752 VanDerWaalsContact O-N 3.11Å; Q752-E755 PolarHBondContact O-N 3.36Å; Q752-E756 WeakPolarHBondContact O-CB 3.25Å; Q752-E756 PolarHBondContact O-N 2.65Å
753	Q	65.7	Low	71	Confident	69 Å²	69	78.8 Å²	78.8	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-69.1	-33.5	175.5	-71.8	164.4	-48.5	0	0	112.3	V749 T750 E755 E756 C757	V749-Q753 HydrophobicContact CG1-CB 3.33Å; V749-Q753 HydrophobicContact CG1-CG 4.5Å; T750-Q753 CarbonylContact O-C 3.56Å; T750-Q753 WeakPolarHBondContact O-CA 3.35Å; T750-Q753 WeakPolarHBondContact O-CB 3.48Å; T750-Q753 PolarHBondContact O-N 3.18Å; T750-Q753 VanDerWaalsContact OG1-CD 3.31Å; T750-Q753 VanDerWaalsContact OG1-CG 3.27Å; T750-Q753 WeakPolarHBondContact OG1-CG 3.47Å; T750-Q753 PolarHBondContact OG1-N 3.35Å; T750-Q753 PolarHBondContact OG1-OE1 2.74Å; Q753-E755 VanDerWaalsContact C-N 3.33Å; Q753-E756 PolarHBondContact O-N 3.04Å; Q753-C757 VanDerWaalsContact O-CB 3.24Å; Q753-C757 WeakPolarHBondContact O-CB 3.34Å; Q753-C757 PolarHBondContact O-N 3.47Å; Q753-C757 PolarHBondContact O-SG 2.72Å; Q753-C757 VanDerWaalsContact O-SG 3.34Å
754	I	69.1	Low	71.9	Confident	40 Å²	40	79 Å²	79	21%	0.205	38%	0.38	C	S	.	.	H	α-helix	trans	-63.3	-43.8	172.4	-61.7	178.5	0	0	0	109.8	V749 T750 E751 R758 M819	V749-I754 HydrophobicContact CB-CG1 3.93Å; V749-I754 HydrophobicContact CG1-CG1 3.64Å; T750-I754 WeakPolarHBondContact O-CG1 3.31Å; T750-I754 PolarHBondContact O-N 2.85Å; E751-I754 PolarHBondContact O-N 2.7Å; I754-R758 WeakPolarHBondContact O-CB 3.5Å; I754-R758 PolarHBondContact O-N 2.71Å; I754-M819 HydrophobicContact CB-CE 4.42Å; I754-M819 HydrophobicContact CG1-CE 3.89Å; I754-M819 HydrophobicContact CG2-CE 4.36Å
755	E	72.6	Confident	73	Confident	74 Å²	74	76.5 Å²	76.5	35%	0.346	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-37.1	177.9	175.9	59.1	-168.7	0	0	112.2	E751 Q752 Q753 R758 R759	E751-E755 WeakPolarHBondContact O-CB 3.41Å; E751-E755 PolarHBondContact O-N 2.94Å; Q752-E755 PolarHBondContact O-N 3.36Å; Q753-E755 VanDerWaalsContact C-N 3.33Å; E755-R758 PolarHBondContact O-N 2.81Å; E755-R759 WeakPolarHBondContact O-CB 3.43Å; E755-R759 VanDerWaalsContact O-CG 3.25Å; E755-R759 WeakPolarHBondContact O-CG 3.33Å; E755-R759 PolarHBondContact O-N 2.74Å; E755-R759 IonicContact OE1-CZ 3.65Å; E755-R759 VanDerWaalsContact OE1-CZ 3.26Å; E755-R759 IonicContact OE1-NE 3.39Å; E755-R759 PolarHBondContact OE1-NE 3.09Å; E755-R759 IonicContact OE1-NH2 3.51Å; E755-R759 PolarHBondContact OE1-NH2 2.85Å
756	E	78.1	Confident	73.7	Confident	116 Å²	116	77.5 Å²	77.5	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-65	-51.4	172.6	-175	166.1	-140.5	0	0	111.8	Q752 Q753 R758 R759 C760 L784	Q752-E756 WeakPolarHBondContact O-CB 3.25Å; Q752-E756 PolarHBondContact O-N 2.65Å; Q753-E756 PolarHBondContact O-N 3.04Å; E756-R758 PolarHBondContact O-N 3.3Å; E756-R759 WeakPolarHBondContact O-CB 3.5Å; E756-R759 PolarHBondContact O-N 3.18Å; E756-R759 VanDerWaalsContact O-N 3.08Å; E756-C760 PolarHBondContact O-N 3.36Å; E756-L784 HydrophobicContact CG-CD2 4.4Å
757	C	78.1	Confident	74.7	Confident	6 Å²	6	80.6 Å²	80.6	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-54.4	-40.6	171.3	-78.4	0	0	0	0	112	Q753 F761 F818 M819	Q753-C757 VanDerWaalsContact O-CB 3.24Å; Q753-C757 WeakPolarHBondContact O-CB 3.34Å; Q753-C757 PolarHBondContact O-N 3.47Å; Q753-C757 PolarHBondContact O-SG 2.72Å; Q753-C757 VanDerWaalsContact O-SG 3.34Å; C757-F761 VanDerWaalsContact O-CB 3.3Å; C757-F761 WeakPolarHBondContact O-CB 3.09Å; C757-F761 PolarHBondContact O-N 3.13Å; C757-F818 HydrophobicContact CB-CE1 3.8Å; C757-F818 HydrophobicContact CB-CZ 4.07Å; C757-M819 HydrophobicContact CB-SD 3.73Å
758	R	81.6	Confident	75.7	Confident	100 Å²	100	88.3 Å²	88.3	38%	0.377	41%	0.412	S	S	.	.	H	α-helix	trans	-66.8	-40.4	176.4	-175.4	178.5	-59.6	-67.7	5.5	112.2	I754 E755 E756 N762 F815	I754-R758 WeakPolarHBondContact O-CB 3.5Å; I754-R758 PolarHBondContact O-N 2.71Å; E755-R758 PolarHBondContact O-N 2.81Å; E756-R758 PolarHBondContact O-N 3.3Å; R758-N762 WeakPolarHBondContact O-CB 3.05Å; R758-N762 PolarHBondContact O-N 2.84Å; R758-N762 PolarHBondContact O-ND2 3.49Å; R758-F815 HydrophobicContact CB-CE2 4.02Å; R758-F815 HydrophobicContact CB-CZ 3.9Å; R758-F815 HydrophobicContact CG-CE2 4.45Å; R758-F815 HydrophobicContact CG-CZ 4.37Å; R758-F815 VanDerWaalsContact NH1-CE1 3.28Å
759	R	82.9	Confident	76.9	Confident	165 Å²	165	90.2 Å²	90.2	62%	0.623	42%	0.416	S	S	*	.	H	α-helix	trans	-64.4	-46.4	174.8	-74.8	169.5	-169.7	179	8.4	111.4	E755 E756 N762 H763	E755-R759 WeakPolarHBondContact O-CB 3.43Å; E755-R759 VanDerWaalsContact O-CG 3.25Å; E755-R759 WeakPolarHBondContact O-CG 3.33Å; E755-R759 PolarHBondContact O-N 2.74Å; E755-R759 IonicContact OE1-CZ 3.65Å; E755-R759 VanDerWaalsContact OE1-CZ 3.26Å; E755-R759 IonicContact OE1-NE 3.39Å; E755-R759 PolarHBondContact OE1-NE 3.09Å; E755-R759 IonicContact OE1-NH2 3.51Å; E755-R759 PolarHBondContact OE1-NH2 2.85Å; E756-R759 WeakPolarHBondContact O-CB 3.5Å; E756-R759 PolarHBondContact O-N 3.18Å; E756-R759 VanDerWaalsContact O-N 3.08Å; R759-N762 PolarHBondContact O-N 3.43Å; R759-H763 WeakPolarHBondContact O-CB 3.49Å; R759-H763 PolarHBondContact O-N 2.92Å
760	C	84.6	Confident	78.1	Confident	26 Å²	26	98.6 Å²	98.6	18%	0.176	45%	0.447	C	S	.	.	H	α-helix	trans	-61.5	-50.3	175.6	-70.6	0	0	0	0	111.4	E756 N762 H763 F764 L784	E756-C760 PolarHBondContact O-N 3.36Å; C760-N762 VanDerWaalsContact C-N 3.35Å; C760-N762 PolarHBondContact O-N 3.07Å; C760-H763 WeakPolarHBondContact O-CB 3.46Å; C760-H763 PolarHBondContact O-N 3.46Å; C760-F764 VanDerWaalsContact O-CD2 3.26Å; C760-F764 WeakPolarHBondContact O-CD2 3.48Å; C760-F764 PolarHBondContact O-N 3.32Å; C760-L784 HydrophobicContact CB-CD1 4.13Å; C760-L784 HydrophobicContact CB-CD2 4.04Å; C760-L784 HydrophobicContact CB-CG 4.05Å; C760-L784 VanDerWaalsContact SG-CD2 3.6Å
761	F	87	Confident	79.3	Confident	2 Å²	2	100.5 Å²	100.5	1%	0.009	45%	0.445	C	S	.	.	H	α-helix	trans	-58.6	-45	178.1	-170.4	-81.2	0	0	0	112.1	C757 H763 F764 D765 L772 F815 F818	C757-F761 VanDerWaalsContact O-CB 3.3Å; C757-F761 WeakPolarHBondContact O-CB 3.09Å; C757-F761 PolarHBondContact O-N 3.13Å; F761-H763 VanDerWaalsContact C-N 3.28Å; F761-H763 PolarHBondContact O-N 2.92Å; F761-F764 PolarHBondContact O-N 2.96Å; F761-D765 PolarHBondContact O-N 3.43Å; F761-L772 HydrophobicContact CD2-CD1 3.53Å; F761-L772 HydrophobicContact CD2-CG 3.95Å; F761-L772 HydrophobicContact CE1-CG 4.24Å; F761-L772 HydrophobicContact CE2-CD1 3.66Å; F761-L772 HydrophobicContact CE2-CG 3.63Å; F761-L772 HydrophobicContact CG-CD1 4.09Å; F761-L772 HydrophobicContact CG-CG 4.4Å; F761-L772 HydrophobicContact CZ-CD1 4.3Å; F761-L772 HydrophobicContact CZ-CG 3.78Å; F761-F815 HydrophobicContact CB-CD2 3.86Å; F761-F815 HydrophobicContact CB-CE2 4.11Å; F761-F815 HydrophobicContact CD1-CB 4.35Å; F761-F815 AromaticContact CD1-CD2 3.94Å; F761-F815 HydrophobicContact CD1-CD2 3.94Å; F761-F815 AromaticContact CD2-CD2 3.95Å; F761-F815 HydrophobicContact CD2-CD2 3.95Å; F761-F815 HydrophobicContact CE1-CB 4.07Å; F761-F815 HydrophobicContact CE1-CD2 4.48Å; F761-F815 HydrophobicContact CE2-CB 4.29Å; F761-F815 HydrophobicContact CE2-CD2 4.47Å; F761-F815 AromaticContact CG-CD2 3.65Å; F761-F815 HydrophobicContact CG-CD2 3.65Å; F761-F815 HydrophobicContact CG-CE2 4.4Å; F761-F815 HydrophobicContact CZ-CB 4.04Å; F761-F818 HydrophobicContact CB-CD1 4.28Å; F761-F818 HydrophobicContact CB-CE1 4.17Å; F761-F818 HydrophobicContact CD2-CB 4.2Å; F761-F818 AromaticContact CD2-CD1 3.54Å; F761-F818 HydrophobicContact CD2-CD1 3.54Å; F761-F818 HydrophobicContact CD2-CE1 4.21Å; F761-F818 HydrophobicContact CD2-CG 4.05Å; F761-F818 HydrophobicContact CE2-CB 4.16Å; F761-F818 HydrophobicContact CE2-CD1 4.31Å; F761-F818 HydrophobicContact CE2-CG 4.49Å; F761-F818 HydrophobicContact CG-CD1 4.3Å
762	N	85.3	Confident	80.6	Confident	95 Å²	95	92.4 Å²	92.4	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-67.8	-24.3	177.1	-72.2	-19.5	0	0	0	113.6	R758 R759 C760	R758-N762 WeakPolarHBondContact O-CB 3.05Å; R758-N762 PolarHBondContact O-N 2.84Å; R758-N762 PolarHBondContact O-ND2 3.49Å; R759-N762 PolarHBondContact O-N 3.43Å; C760-N762 VanDerWaalsContact C-N 3.35Å; C760-N762 PolarHBondContact O-N 3.07Å
763	H	86.7	Confident	81.6	Confident	140 Å²	140	88.1 Å²	88.1	65%	0.648	39%	0.39	S	S	*	.	H	α-helix	trans	-69.5	-37.8	173.9	-178.1	85.4	0	0	0	111.3	R759 C760 F761	R759-H763 WeakPolarHBondContact O-CB 3.49Å; R759-H763 PolarHBondContact O-N 2.92Å; C760-H763 WeakPolarHBondContact O-CB 3.46Å; C760-H763 PolarHBondContact O-N 3.46Å; F761-H763 VanDerWaalsContact C-N 3.28Å; F761-H763 PolarHBondContact O-N 2.92Å
764	F	88	Confident	82.7	Confident	24 Å²	24	87.1 Å²	87.1	11%	0.105	39%	0.389	C	S	.	.	H	α-helix	trans	-84.6	-25.3	178.2	-70.4	-73.6	0	0	0	113.7	C760 F761 K766 L772 D776 A779 C780 S783	C760-F764 VanDerWaalsContact O-CD2 3.26Å; C760-F764 WeakPolarHBondContact O-CD2 3.48Å; C760-F764 PolarHBondContact O-N 3.32Å; F761-F764 PolarHBondContact O-N 2.96Å; F764-K766 PolarHBondContact O-N 3.39Å; F764-L772 VanDerWaalsContact C-CD2 3.4Å; F764-L772 HydrophobicContact CB-CD1 4.15Å; F764-L772 HydrophobicContact CB-CD2 3.66Å; F764-D776 HydrophobicContact CB-CB 4.23Å; F764-A779 HydrophobicContact CD1-CB 3.83Å; F764-A779 HydrophobicContact CE1-CB 3.36Å; F764-A779 HydrophobicContact CZ-CB 3.89Å; F764-C780 HydrophobicContact CB-CB 4.45Å; F764-C780 VanDerWaalsContact CD2-CA 3.47Å; F764-C780 HydrophobicContact CD2-CB 3.56Å; F764-C780 HydrophobicContact CE2-CB 4.15Å; F764-C780 HydrophobicContact CG-CB 4.1Å; F764-S783 VanDerWaalsContact CE2-OG 3.31Å; F764-S783 WeakPolarHBondContact CE2-OG 3.41Å; F764-S783 WeakPolarHBondContact CZ-OG 3.25Å
765	D	88.3	Confident	83.6	Confident	11 Å²	11	91.7 Å²	91.7	6%	0.059	41%	0.413	C	S	.	.			trans	-77	63.9	172.7	-176.4	20.1	0	0	0	111.9	F761 H767 R768 T769 R770 L772	F761-D765 PolarHBondContact O-N 3.43Å; D765-H767 PolarHBondContact O-N 2.81Å; D765-R768 PolarHBondContact O-N 2.93Å; D765-R768 WeakPolarHBondContact OD1-CA 3.37Å; D765-R768 PolarHBondContact OD1-N 3.22Å; D765-R768 VanDerWaalsContact OD1-N 3.09Å; D765-R768 VanDerWaalsContact OD2-C 3.24Å; D765-R768 VanDerWaalsContact OD2-CA 3.23Å; D765-R768 WeakPolarHBondContact OD2-CA 3.28Å; D765-T769 VanDerWaalsContact CG-N 3.31Å; D765-T769 PolarHBondContact OD1-N 3.27Å; D765-T769 PolarHBondContact OD1-OG1 3.3Å; D765-T769 PolarHBondContact OD2-N 3.1Å; D765-R770 VanDerWaalsContact OD2-CA 3.29Å; D765-R770 WeakPolarHBondContact OD2-CA 3.33Å; D765-R770 PolarHBondContact OD2-N 3.14Å; D765-L772 HydrophobicContact CB-CD2 3.86Å; D765-L772 VanDerWaalsContact N-CD2 3.31Å
766	K	80.9	Confident	84.4	Confident	135 Å²	135	89.6 Å²	89.6	59%	0.587	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.6	-177.3	-60.4	175.7	-158.2	106.2	0	113.2	F764 D776	F764-K766 PolarHBondContact O-N 3.39Å; K766-D776 IonicContact NZ-OD1 2.69Å; K766-D776 PolarHBondContact NZ-OD1 2.99Å; K766-D776 IonicContact NZ-OD2 3.69Å; K766-D776 PolarHBondContact NZ-OD2 3.37Å
767	H	80.7	Confident	85	Confident	160 Å²	160	84 Å²	84	74%	0.741	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	1.2	-177.4	-63	-59.8	0	0	0	113.9	D765 T769	D765-H767 PolarHBondContact O-N 2.81Å; H767-T769 HydrophobicContact CB-CG2 3.71Å; H767-T769 PolarHBondContact O-N 2.73Å
768	R	77.6	Confident	85.5	Confident	228 Å²	228	85.8 Å²	85.8	86%	0.86	38%	0.384	S	S	*	.			trans	54.7	35.1	-178.1	-59.8	-176	175.4	-170	-2	113.7	D765 R770	D765-R768 PolarHBondContact O-N 2.93Å; D765-R768 WeakPolarHBondContact OD1-CA 3.37Å; D765-R768 PolarHBondContact OD1-N 3.22Å; D765-R768 VanDerWaalsContact OD1-N 3.09Å; D765-R768 VanDerWaalsContact OD2-C 3.24Å; D765-R768 VanDerWaalsContact OD2-CA 3.23Å; D765-R768 WeakPolarHBondContact OD2-CA 3.28Å; R768-R770 VanDerWaalsContact C-N 3.28Å
769	T	81.9	Confident	85.8	Confident	76 Å²	76	82.6 Å²	82.6	47%	0.466	38%	0.38	S	S	.	.			trans	-80	-8.5	-179.3	61.2	0	0	0	0	113.6	D765 H767 R771	D765-T769 VanDerWaalsContact CG-N 3.31Å; D765-T769 PolarHBondContact OD1-N 3.27Å; D765-T769 PolarHBondContact OD1-OG1 3.3Å; D765-T769 PolarHBondContact OD2-N 3.1Å; H767-T769 HydrophobicContact CB-CG2 3.71Å; H767-T769 PolarHBondContact O-N 2.73Å; T769-R771 PolarHBondContact O-N 3.41Å; T769-R771 PolarHBondContact OG1-N 3.29Å; T769-R771 PolarHBondContact OG1-O 3.08Å; T769-R771 VanDerWaalsContact OG1-O 3.08Å
770	R	81	Confident	86	Confident	191 Å²	191	74.8 Å²	74.8	72%	0.721	35%	0.35	S	S	*	.	S	Bend	trans	61.1	25.7	-169.6	-53.5	-178.6	177.2	-169.1	-2.2	113.3	D765 R768	D765-R770 VanDerWaalsContact OD2-CA 3.29Å; D765-R770 WeakPolarHBondContact OD2-CA 3.33Å; D765-R770 PolarHBondContact OD2-N 3.14Å; R768-R770 VanDerWaalsContact C-N 3.28Å
771	R	86.6	Confident	86.1	Confident	116 Å²	116	73.5 Å²	73.5	44%	0.438	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	140.6	-172.8	-65.3	174.6	-176.3	-152.6	-4.6	108.9	T769 Y812 V813	T769-R771 PolarHBondContact O-N 3.41Å; T769-R771 PolarHBondContact OG1-N 3.29Å; T769-R771 PolarHBondContact OG1-O 3.08Å; T769-R771 VanDerWaalsContact OG1-O 3.08Å; R771-Y812 HydrophobicContact CB-CD2 4.23Å; R771-Y812 HydrophobicContact CB-CG 4.42Å; R771-Y812 HydrophobicContact CG-CD2 3.77Å; R771-Y812 HydrophobicContact CG-CE2 4.33Å; R771-Y812 HydrophobicContact CG-CG 4.34Å; R771-Y812 VanDerWaalsContact CZ-CE2 3.48Å; R771-Y812 VanDerWaalsContact NH1-CE2 3.33Å; R771-Y812 PolarHBondContact NH1-OH 3.03Å; R771-V813 WeakPolarHBondContact CA-O 3.44Å
772	L	88.6	Confident	86	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.2	168.7	-59.8	-177.6	0	0	0	109.2	F761 F764 D765 D776 F777 C780 Y812 V813	F761-L772 HydrophobicContact CD2-CD1 3.53Å; F761-L772 HydrophobicContact CD2-CG 3.95Å; F761-L772 HydrophobicContact CE1-CG 4.24Å; F761-L772 HydrophobicContact CE2-CD1 3.66Å; F761-L772 HydrophobicContact CE2-CG 3.63Å; F761-L772 HydrophobicContact CG-CD1 4.09Å; F761-L772 HydrophobicContact CG-CG 4.4Å; F761-L772 HydrophobicContact CZ-CD1 4.3Å; F761-L772 HydrophobicContact CZ-CG 3.78Å; F764-L772 VanDerWaalsContact C-CD2 3.4Å; F764-L772 HydrophobicContact CB-CD1 4.15Å; F764-L772 HydrophobicContact CB-CD2 3.66Å; D765-L772 HydrophobicContact CB-CD2 3.86Å; D765-L772 VanDerWaalsContact N-CD2 3.31Å; L772-D776 HydrophobicContact CB-CB 4.43Å; L772-D776 HydrophobicContact CD2-CB 4.31Å; L772-F777 HydrophobicContact CB-CB 4.07Å; L772-F777 HydrophobicContact CD1-CD2 4.35Å; L772-C780 HydrophobicContact CD1-CB 3.9Å; L772-Y812 CarbonylContact O-C 3.44Å; L772-Y812 VanDerWaalsContact O-CA 3.23Å; L772-Y812 WeakPolarHBondContact O-CA 3.2Å; L772-V813 PolarHBondContact N-O 3.24Å; L772-V813 PolarHBondContact O-N 2.79Å
773	D	89.3	Confident	85.9	Confident	74 Å²	74	75.9 Å²	75.9	40%	0.396	36%	0.362	S	S	.	.			trans	-73.1	170.1	165.4	75.2	37.8	0	0	0	110.4	L775 D776 F777	D773-L775 PolarHBondContact O-N 2.96Å; D773-L775 WeakPolarHBondContact OD1-CA 3.37Å; D773-L775 WeakPolarHBondContact OD1-CB 3.45Å; D773-L775 PolarHBondContact OD1-N 3.41Å; D773-D776 PolarHBondContact O-N 2.76Å; D773-D776 PolarHBondContact OD1-N 2.7Å; D773-F777 WeakPolarHBondContact O-CB 3.47Å; D773-F777 PolarHBondContact O-N 3.38Å
774	P	88.6	Confident	85.6	Confident	48 Å²	48	71.1 Å²	71.1	31%	0.312	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-26.8	-177.3	-26	36.5	0	0	0	114.8	R778 F798 M802	P774-R778 WeakPolarHBondContact O-CB 3.42Å; P774-R778 PolarHBondContact O-N 2.61Å; P774-R778 VanDerWaalsContact O-N 3.08Å; P774-F798 HydrophobicContact CB-CE1 4.44Å; P774-F798 VanDerWaalsContact O-CZ 3.22Å; P774-F798 WeakPolarHBondContact O-CZ 3.37Å; P774-M802 HydrophobicContact CB-SD 4.18Å; P774-M802 HydrophobicContact CG-CE 4.47Å; P774-M802 HydrophobicContact CG-SD 4.3Å
775	L	86.9	Confident	84.9	Confident	137 Å²	137	72.9 Å²	72.9	72%	0.717	37%	0.366	S	S	*	.	H	α-helix	trans	-77.6	-47.3	179	-65.8	170.5	0	0	0	110.7	D773 F777 R778 A779	D773-L775 PolarHBondContact O-N 2.96Å; D773-L775 WeakPolarHBondContact OD1-CA 3.37Å; D773-L775 WeakPolarHBondContact OD1-CB 3.45Å; D773-L775 PolarHBondContact OD1-N 3.41Å; L775-F777 VanDerWaalsContact C-N 3.31Å; L775-F777 PolarHBondContact O-N 3.37Å; L775-R778 PolarHBondContact O-N 3.33Å; L775-A779 PolarHBondContact O-N 2.8Å
776	D	90.3	Very high	84.3	Confident	29 Å²	29	75 Å²	75	16%	0.155	38%	0.375	C	S	.	.	H	α-helix	trans	-67	-32.7	175.8	-87.2	-21.3	0	0	0	111.7	F764 K766 L772 D773 A779 C780	F764-D776 HydrophobicContact CB-CB 4.23Å; K766-D776 IonicContact NZ-OD1 2.69Å; K766-D776 PolarHBondContact NZ-OD1 2.99Å; K766-D776 IonicContact NZ-OD2 3.69Å; K766-D776 PolarHBondContact NZ-OD2 3.37Å; L772-D776 HydrophobicContact CB-CB 4.43Å; L772-D776 HydrophobicContact CD2-CB 4.31Å; D773-D776 PolarHBondContact O-N 2.76Å; D773-D776 PolarHBondContact OD1-N 2.7Å; D776-A779 PolarHBondContact O-N 3.43Å; D776-C780 WeakPolarHBondContact O-CB 3.38Å; D776-C780 PolarHBondContact O-N 3.4Å
777	F	89.7	Confident	83.9	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-66.5	-43.5	171.8	-178	-116.2	0	0	0	112.5	L772 D773 L775 A779 C780 L781 F798 I801 M802 V805 V813 F818	L772-F777 HydrophobicContact CB-CB 4.07Å; L772-F777 HydrophobicContact CD1-CD2 4.35Å; D773-F777 WeakPolarHBondContact O-CB 3.47Å; D773-F777 PolarHBondContact O-N 3.38Å; L775-F777 VanDerWaalsContact C-N 3.31Å; L775-F777 PolarHBondContact O-N 3.37Å; F777-A779 VanDerWaalsContact C-N 3.32Å; F777-A779 PolarHBondContact O-N 2.85Å; F777-C780 WeakPolarHBondContact O-CB 3.33Å; F777-C780 PolarHBondContact O-N 2.94Å; F777-L781 HydrophobicContact CD1-CD1 4.26Å; F777-L781 HydrophobicContact CE1-CD1 3.72Å; F777-L781 HydrophobicContact CE1-CG 4.31Å; F777-L781 HydrophobicContact CE2-CD2 4.4Å; F777-L781 HydrophobicContact CE2-CG 4.34Å; F777-L781 HydrophobicContact CZ-CD1 3.91Å; F777-L781 HydrophobicContact CZ-CD2 4.17Å; F777-L781 HydrophobicContact CZ-CG 4.1Å; F777-L781 PolarHBondContact O-N 3.27Å; F777-F798 AromaticContact CD1-CE2 3.87Å; F777-F798 HydrophobicContact CD1-CE2 3.87Å; F777-F798 HydrophobicContact CD1-CZ 4.08Å; F777-F798 HydrophobicContact CE1-CE2 4.27Å; F777-I801 HydrophobicContact CE1-CG2 4Å; F777-I801 HydrophobicContact CZ-CG2 4.37Å; F777-M802 HydrophobicContact CD1-SD 4.29Å; F777-V805 HydrophobicContact CE1-CG2 3.77Å; F777-V805 HydrophobicContact CZ-CG1 4.12Å; F777-V805 HydrophobicContact CZ-CG2 3.99Å; F777-V813 HydrophobicContact CB-CG2 4.17Å; F777-V813 HydrophobicContact CD1-CG2 3.81Å; F777-V813 HydrophobicContact CD2-CB 3.95Å; F777-V813 HydrophobicContact CD2-CG1 3.95Å; F777-V813 HydrophobicContact CD2-CG2 3.9Å; F777-V813 HydrophobicContact CE1-CG2 4.16Å; F777-V813 HydrophobicContact CE2-CB 4.3Å; F777-V813 HydrophobicContact CE2-CG1 3.8Å; F777-V813 HydrophobicContact CE2-CG2 4.24Å; F777-V813 HydrophobicContact CG-CB 4.2Å; F777-V813 HydrophobicContact CG-CG2 3.68Å; F777-V813 HydrophobicContact CZ-CG1 4.3Å; F777-V813 HydrophobicContact CZ-CG2 4.37Å; F777-F818 HydrophobicContact CE2-CB 4.25Å; F777-F818 AromaticContact CE2-CD2 3.74Å; F777-F818 HydrophobicContact CE2-CD2 3.74Å; F777-F818 HydrophobicContact CE2-CG 4.31Å
778	R	88.9	Confident	83.8	Confident	42 Å²	42	68.4 Å²	68.4	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-59.1	-43.6	174	-169.6	-173.2	-171.6	130.1	-10.5	111.5	P774 L775 C780 L781 V782 I788 E795 F798	P774-R778 WeakPolarHBondContact O-CB 3.42Å; P774-R778 PolarHBondContact O-N 2.61Å; P774-R778 VanDerWaalsContact O-N 3.08Å; L775-R778 PolarHBondContact O-N 3.33Å; R778-C780 VanDerWaalsContact C-N 3.35Å; R778-L781 PolarHBondContact O-N 2.94Å; R778-V782 WeakPolarHBondContact O-CG2 3.46Å; R778-V782 PolarHBondContact O-N 3.44Å; R778-V782 VanDerWaalsContact O-N 3.09Å; R778-I788 HydrophobicContact CG-CD1 3.97Å; R778-E795 IonicContact CZ-OE2 3.3Å; R778-E795 VanDerWaalsContact NH1-CD 3.28Å; R778-E795 IonicContact NH1-OE1 2.7Å; R778-E795 PolarHBondContact NH1-OE1 3.03Å; R778-E795 VanDerWaalsContact NH1-OE1 3.13Å; R778-E795 IonicContact NH1-OE2 2.95Å; R778-E795 PolarHBondContact NH1-OE2 3.37Å; R778-E795 IonicContact NH2-OE2 3.56Å; R778-E795 PolarHBondContact NH2-OE2 3.29Å; R778-F798 HydrophobicContact CB-CD2 4.34Å; R778-F798 HydrophobicContact CB-CE1 4.33Å; R778-F798 HydrophobicContact CB-CE2 3.72Å; R778-F798 HydrophobicContact CB-CZ 3.73Å; R778-F798 HydrophobicContact CG-CD2 4.14Å; R778-F798 HydrophobicContact CG-CE2 4.03Å; R778-F798 HydrophobicContact CG-CZ 4.31Å
779	A	87.1	Confident	83.6	Confident	34 Å²	34	61 Å²	61	28%	0.281	34%	0.338	S	S	.	.	H	α-helix	trans	-66.7	-35.5	177.6	0	0	0	0	0	112.5	F764 L775 D776 F777 V782 S783	F764-A779 HydrophobicContact CD1-CB 3.83Å; F764-A779 HydrophobicContact CE1-CB 3.36Å; F764-A779 HydrophobicContact CZ-CB 3.89Å; L775-A779 PolarHBondContact O-N 2.8Å; D776-A779 PolarHBondContact O-N 3.43Å; F777-A779 VanDerWaalsContact C-N 3.32Å; F777-A779 PolarHBondContact O-N 2.85Å; A779-V782 PolarHBondContact O-N 3Å; A779-S783 WeakPolarHBondContact O-CB 3.44Å; A779-S783 PolarHBondContact O-N 3.02Å; A779-S783 PolarHBondContact O-OG 3.3Å
780	C	88.7	Confident	83.1	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-46.4	172.1	-170.6	0	0	0	0	112.2	F764 L772 D776 F777 R778 S783 L784	F764-C780 HydrophobicContact CB-CB 4.45Å; F764-C780 VanDerWaalsContact CD2-CA 3.47Å; F764-C780 HydrophobicContact CD2-CB 3.56Å; F764-C780 HydrophobicContact CE2-CB 4.15Å; F764-C780 HydrophobicContact CG-CB 4.1Å; L772-C780 HydrophobicContact CD1-CB 3.9Å; D776-C780 WeakPolarHBondContact O-CB 3.38Å; D776-C780 PolarHBondContact O-N 3.4Å; F777-C780 WeakPolarHBondContact O-CB 3.33Å; F777-C780 PolarHBondContact O-N 2.94Å; R778-C780 VanDerWaalsContact C-N 3.35Å; C780-S783 PolarHBondContact O-N 2.9Å; C780-L784 PolarHBondContact O-N 3.45Å
781	L	86.3	Confident	83.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-47.6	176.1	-69.9	177.3	0	0	0	112	F777 R778 S783 L784 G785 F786 I788 F798 I801 F818 F821	F777-L781 HydrophobicContact CD1-CD1 4.26Å; F777-L781 HydrophobicContact CE1-CD1 3.72Å; F777-L781 HydrophobicContact CE1-CG 4.31Å; F777-L781 HydrophobicContact CE2-CD2 4.4Å; F777-L781 HydrophobicContact CE2-CG 4.34Å; F777-L781 HydrophobicContact CZ-CD1 3.91Å; F777-L781 HydrophobicContact CZ-CD2 4.17Å; F777-L781 HydrophobicContact CZ-CG 4.1Å; F777-L781 PolarHBondContact O-N 3.27Å; R778-L781 PolarHBondContact O-N 2.94Å; L781-S783 VanDerWaalsContact C-N 3.25Å; L781-S783 PolarHBondContact O-N 2.84Å; L781-L784 PolarHBondContact O-N 2.61Å; L781-L784 VanDerWaalsContact O-N 3.08Å; L781-G785 PolarHBondContact O-N 3.39Å; L781-F786 HydrophobicContact CB-CB 4.08Å; L781-F786 HydrophobicContact CB-CD2 4.33Å; L781-F786 HydrophobicContact CB-CG 4.38Å; L781-F786 HydrophobicContact CD2-CD2 4.05Å; L781-F786 HydrophobicContact CD2-CE2 4.21Å; L781-F786 HydrophobicContact CD2-CG 4.42Å; L781-F786 WeakPolarHBondContact O-CB 3.24Å; L781-F786 WeakPolarHBondContact O-CD2 3.42Å; L781-F786 PolarHBondContact O-N 3.39Å; L781-F786 VanDerWaalsContact O-N 3.08Å; L781-I788 HydrophobicContact CB-CD1 4.2Å; L781-I788 HydrophobicContact CD1-CD1 4.13Å; L781-F798 HydrophobicContact CD1-CD2 4.39Å; L781-F798 HydrophobicContact CD1-CE2 4.17Å; L781-I801 HydrophobicContact CD1-CD1 4.44Å; L781-I801 HydrophobicContact CD1-CG2 4.16Å; L781-F818 HydrophobicContact CD2-CE2 4.39Å; L781-F821 HydrophobicContact CD2-CD1 4.24Å; L781-F821 HydrophobicContact CD2-CE1 3.72Å
782	V	85	Confident	82.6	Confident	77 Å²	77	58.5 Å²	58.5	47%	0.467	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-36.8	178	173.1	0	0	0	0	111.7	R778 A779 L784 G785 I788	R778-V782 WeakPolarHBondContact O-CG2 3.46Å; R778-V782 PolarHBondContact O-N 3.44Å; R778-V782 VanDerWaalsContact O-N 3.09Å; A779-V782 PolarHBondContact O-N 3Å; V782-L784 VanDerWaalsContact C-N 3.25Å; V782-L784 PolarHBondContact O-N 3.17Å; V782-G785 PolarHBondContact O-N 3.37Å; V782-G785 VanDerWaalsContact O-N 3.13Å; V782-I788 HydrophobicContact CG2-CD1 4.5Å
783	S	83.4	Confident	82	Confident	69 Å²	69	63.9 Å²	63.9	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-69.1	-22.1	178	-56.3	0	0	0	0	113.9	F764 A779 C780 L781 G785	F764-S783 VanDerWaalsContact CE2-OG 3.31Å; F764-S783 WeakPolarHBondContact CE2-OG 3.41Å; F764-S783 WeakPolarHBondContact CZ-OG 3.25Å; A779-S783 WeakPolarHBondContact O-CB 3.44Å; A779-S783 PolarHBondContact O-N 3.02Å; A779-S783 PolarHBondContact O-OG 3.3Å; C780-S783 PolarHBondContact O-N 2.9Å; L781-S783 VanDerWaalsContact C-N 3.25Å; L781-S783 PolarHBondContact O-N 2.84Å; S783-G785 VanDerWaalsContact C-N 3.33Å
784	L	78.8	Confident	81.5	Confident	41 Å²	41	60.4 Å²	60.4	22%	0.215	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	11.4	174.6	-69.7	161.7	0	0	0	112.6	E756 C760 C780 L781 V782 F786 F818	E756-L784 HydrophobicContact CG-CD2 4.4Å; C760-L784 HydrophobicContact CB-CD1 4.13Å; C760-L784 HydrophobicContact CB-CD2 4.04Å; C760-L784 HydrophobicContact CB-CG 4.05Å; C760-L784 VanDerWaalsContact SG-CD2 3.6Å; C780-L784 PolarHBondContact O-N 3.45Å; L781-L784 PolarHBondContact O-N 2.61Å; L781-L784 VanDerWaalsContact O-N 3.08Å; V782-L784 VanDerWaalsContact C-N 3.25Å; V782-L784 PolarHBondContact O-N 3.17Å; L784-F786 HydrophobicContact CB-CD2 4.3Å; L784-F786 HydrophobicContact CB-CE2 4.47Å; L784-F818 HydrophobicContact CD1-CE2 3.97Å; L784-F818 HydrophobicContact CD1-CZ 3.47Å; L784-F818 VanDerWaalsContact CD1-CZ 3.47Å
785	G	73.6	Confident	81.2	Confident	61 Å²	61	62 Å²	62	63%	0.629	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	1.2	175.3	0	0	0	0	0	115.7	L781 V782 S783 T787	L781-G785 PolarHBondContact O-N 3.39Å; V782-G785 PolarHBondContact O-N 3.37Å; V782-G785 VanDerWaalsContact O-N 3.13Å; S783-G785 VanDerWaalsContact C-N 3.33Å; G785-T787 PolarHBondContact O-N 3.03Å; G785-T787 VanDerWaalsContact O-N 3.14Å
786	F	76.5	Confident	81	Confident	54 Å²	54	57.8 Å²	57.8	24%	0.237	35%	0.353	C	S	.	.			trans	-72.7	108.7	176.3	-69.9	-96.6	0	0	0	111	L781 L784 I788 F821 M822 Q825	L781-F786 HydrophobicContact CB-CB 4.08Å; L781-F786 HydrophobicContact CB-CD2 4.33Å; L781-F786 HydrophobicContact CB-CG 4.38Å; L781-F786 HydrophobicContact CD2-CD2 4.05Å; L781-F786 HydrophobicContact CD2-CE2 4.21Å; L781-F786 HydrophobicContact CD2-CG 4.42Å; L781-F786 WeakPolarHBondContact O-CB 3.24Å; L781-F786 WeakPolarHBondContact O-CD2 3.42Å; L781-F786 PolarHBondContact O-N 3.39Å; L781-F786 VanDerWaalsContact O-N 3.08Å; L784-F786 HydrophobicContact CB-CD2 4.3Å; L784-F786 HydrophobicContact CB-CE2 4.47Å; F786-I788 PolarHBondContact O-N 2.89Å; F786-I788 VanDerWaalsContact O-N 3.12Å; F786-F821 HydrophobicContact CE1-CE1 4.22Å; F786-F821 HydrophobicContact CE1-CZ 4.36Å; F786-F821 HydrophobicContact CZ-CE1 4.15Å; F786-M822 HydrophobicContact CE2-CE 3.88Å; F786-M822 HydrophobicContact CE2-SD 3.59Å; F786-M822 VanDerWaalsContact CE2-SD 3.59Å; F786-M822 HydrophobicContact CZ-CE 4.25Å; F786-M822 HydrophobicContact CZ-SD 3.83Å; F786-Q825 HydrophobicContact CE1-CB 4.44Å; F786-Q825 HydrophobicContact CE1-CG 4.12Å; F786-Q825 HydrophobicContact CZ-CB 4.27Å; F786-Q825 HydrophobicContact CZ-CG 4.21Å
787	T	73.3	Confident	80.4	Confident	133 Å²	133	58.9 Å²	58.9	82%	0.816	36%	0.359	S	S	*	.			trans	-72.9	102.3	172.9	50.8	0	0	0	0	110.9	G785 P789	G785-T787 PolarHBondContact O-N 3.03Å; G785-T787 VanDerWaalsContact O-N 3.14Å; T787-P789 WeakPolarHBondContact O-CD 3.31Å
788	I	76.8	Confident	80.3	Confident	25 Å²	25	59.3 Å²	59.3	13%	0.128	36%	0.361	C	S	.	.			trans	-102.6	103	170.4	-57.4	171	0	0	0	107.7	R778 L781 V782 F786 G794 F798	R778-I788 HydrophobicContact CG-CD1 3.97Å; L781-I788 HydrophobicContact CB-CD1 4.2Å; L781-I788 HydrophobicContact CD1-CD1 4.13Å; V782-I788 HydrophobicContact CG2-CD1 4.5Å; F786-I788 PolarHBondContact O-N 2.89Å; F786-I788 VanDerWaalsContact O-N 3.12Å; I788-G794 WeakPolarHBondContact CG2-O 3.46Å; I788-F798 HydrophobicContact CD1-CD2 3.83Å; I788-F798 HydrophobicContact CG2-CB 4.16Å
789	P	74.2	Confident	80.1	Confident	71 Å²	71	62.4 Å²	62.4	46%	0.461	38%	0.378	S	S	.	.			trans	-62.5	145.3	-177.2	-23.3	34.3	0	0	0	112.5	T787 S791 G794	T787-P789 WeakPolarHBondContact O-CD 3.31Å; P789-S791 PolarHBondContact O-N 2.88Å; P789-G794 WeakPolarHBondContact O-CA 3.46Å
790	N	71.9	Confident	79.9	Confident	160 Å²	160	68.2 Å²	68.2	86%	0.856	39%	0.393	S	S	*	.	S	Bend	trans	-78.3	62.1	169.4	-73.6	-18.4	0	0	0	110.7
791	S	80.6	Confident	79.7	Confident	57 Å²	57	69.8 Å²	69.8	40%	0.399	40%	0.401	S	S	.	.	S	Bend	trans	-137.7	164	177.8	73.8	0	0	0	0	110	P789 Q793 G794 E795	P789-S791 PolarHBondContact O-N 2.88Å; S791-Q793 PolarHBondContact O-N 3.04Å; S791-Q793 VanDerWaalsContact O-N 3.1Å; S791-Q793 PolarHBondContact OG-N 3.46Å; S791-G794 PolarHBondContact O-N 3.42Å; S791-G794 VanDerWaalsContact O-N 3.08Å; S791-G794 PolarHBondContact OG-N 3.24Å; S791-E795 PolarHBondContact O-N 3.3Å
792	S	76.5	Confident	79.7	Confident	114 Å²	114	70.8 Å²	70.8	80%	0.797	41%	0.406	S	S	*	.	H	α-helix	trans	-56.7	-27.3	175.6	-47.1	0	0	0	0	113.1	A796	S792-A796 PolarHBondContact O-N 2.97Å
793	Q	75.5	Confident	79.6	Confident	115 Å²	115	74.3 Å²	74.3	54%	0.537	42%	0.415	S	S	.	.	H	α-helix	trans	-70.9	-49.9	174.9	-176.1	58.4	43.8	0	0	111.2	S791 E795 A796 D797	S791-Q793 PolarHBondContact O-N 3.04Å; S791-Q793 VanDerWaalsContact O-N 3.1Å; S791-Q793 PolarHBondContact OG-N 3.46Å; Q793-E795 PolarHBondContact O-N 2.87Å; Q793-A796 WeakPolarHBondContact O-CB 3.26Å; Q793-A796 PolarHBondContact O-N 3.32Å; Q793-D797 PolarHBondContact NE2-OD1 3.3Å; Q793-D797 PolarHBondContact NE2-OD2 3.39Å; Q793-D797 PolarHBondContact O-N 3Å
794	G	78.8	Confident	79.5	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.01	42%	0.415	C	S	.	.	H	α-helix	trans	-62.6	-31.1	177.6	0	0	0	0	0	113.3	I788 P789 S791 F798	I788-G794 WeakPolarHBondContact CG2-O 3.46Å; P789-G794 WeakPolarHBondContact O-CA 3.46Å; S791-G794 PolarHBondContact O-N 3.42Å; S791-G794 VanDerWaalsContact O-N 3.08Å; S791-G794 PolarHBondContact OG-N 3.24Å; G794-F798 WeakPolarHBondContact O-CB 3.31Å; G794-F798 PolarHBondContact O-N 2.91Å
795	E	82.3	Confident	79.7	Confident	82 Å²	82	73.4 Å²	73.4	38%	0.383	41%	0.408	S	S	.	.	H	α-helix	trans	-68	-41.7	171.7	-157.2	60.3	-141.4	0	0	112.3	R778 S791 Q793 D797 F798 M799	R778-E795 IonicContact CZ-OE2 3.3Å; R778-E795 VanDerWaalsContact NH1-CD 3.28Å; R778-E795 IonicContact NH1-OE1 2.7Å; R778-E795 PolarHBondContact NH1-OE1 3.03Å; R778-E795 VanDerWaalsContact NH1-OE1 3.13Å; R778-E795 IonicContact NH1-OE2 2.95Å; R778-E795 PolarHBondContact NH1-OE2 3.37Å; R778-E795 IonicContact NH2-OE2 3.56Å; R778-E795 PolarHBondContact NH2-OE2 3.29Å; S791-E795 PolarHBondContact O-N 3.3Å; Q793-E795 PolarHBondContact O-N 2.87Å; E795-D797 VanDerWaalsContact C-N 3.34Å; E795-F798 PolarHBondContact O-N 3.24Å; E795-M799 WeakPolarHBondContact O-CB 3.22Å; E795-M799 VanDerWaalsContact O-CG 3.26Å; E795-M799 WeakPolarHBondContact O-CG 3.45Å; E795-M799 PolarHBondContact O-N 2.92Å
796	A	81.8	Confident	80.3	Confident	49 Å²	49	71.1 Å²	71.1	41%	0.405	38%	0.381	S	S	.	.	H	α-helix	trans	-65.9	-36.6	175.8	0	0	0	0	0	112.3	S792 Q793 R800	S792-A796 PolarHBondContact O-N 2.97Å; Q793-A796 WeakPolarHBondContact O-CB 3.26Å; Q793-A796 PolarHBondContact O-N 3.32Å; A796-R800 PolarHBondContact O-N 3.2Å
797	D	78.3	Confident	80.4	Confident	51 Å²	51	72.7 Å²	72.7	27%	0.273	40%	0.397	S	S	.	.	H	α-helix	trans	-71.8	-41.4	176.5	-65.5	-37.8	0	0	0	111.3	Q793 E795 M799 R800 I801	Q793-D797 PolarHBondContact NE2-OD1 3.3Å; Q793-D797 PolarHBondContact NE2-OD2 3.39Å; Q793-D797 PolarHBondContact O-N 3Å; E795-D797 VanDerWaalsContact C-N 3.34Å; D797-M799 PolarHBondContact O-N 3.12Å; D797-R800 WeakPolarHBondContact O-CB 3.38Å; D797-R800 PolarHBondContact O-N 3.22Å; D797-R800 VanDerWaalsContact O-N 3.13Å; D797-R800 IonicContact OD1-CZ 3.56Å; D797-R800 IonicContact OD1-NH1 2.71Å; D797-R800 IonicContact OD1-NH2 3.39Å; D797-R800 PolarHBondContact OD1-NH2 2.87Å; D797-I801 WeakPolarHBondContact O-CG1 3.26Å; D797-I801 PolarHBondContact O-N 3.02Å
798	F	87.8	Confident	80.8	Confident	10 Å²	10	74 Å²	74	4%	0.044	39%	0.394	C	S	.	.	H	α-helix	trans	-62.4	-42.3	172.2	-178.3	-110.5	0	0	0	112.4	P774 F777 R778 L781 I788 G794 E795 R800 I801 M802	P774-F798 HydrophobicContact CB-CE1 4.44Å; P774-F798 VanDerWaalsContact O-CZ 3.22Å; P774-F798 WeakPolarHBondContact O-CZ 3.37Å; F777-F798 AromaticContact CD1-CE2 3.87Å; F777-F798 HydrophobicContact CD1-CE2 3.87Å; F777-F798 HydrophobicContact CD1-CZ 4.08Å; F777-F798 HydrophobicContact CE1-CE2 4.27Å; R778-F798 HydrophobicContact CB-CD2 4.34Å; R778-F798 HydrophobicContact CB-CE1 4.33Å; R778-F798 HydrophobicContact CB-CE2 3.72Å; R778-F798 HydrophobicContact CB-CZ 3.73Å; R778-F798 HydrophobicContact CG-CD2 4.14Å; R778-F798 HydrophobicContact CG-CE2 4.03Å; R778-F798 HydrophobicContact CG-CZ 4.31Å; L781-F798 HydrophobicContact CD1-CD2 4.39Å; L781-F798 HydrophobicContact CD1-CE2 4.17Å; I788-F798 HydrophobicContact CD1-CD2 3.83Å; I788-F798 HydrophobicContact CG2-CB 4.16Å; G794-F798 WeakPolarHBondContact O-CB 3.31Å; G794-F798 PolarHBondContact O-N 2.91Å; E795-F798 PolarHBondContact O-N 3.24Å; F798-R800 PolarHBondContact O-N 3.4Å; F798-I801 WeakPolarHBondContact O-CB 3.44Å; F798-I801 PolarHBondContact O-N 2.7Å; F798-M802 HydrophobicContact CZ-SD 4.42Å; F798-M802 WeakPolarHBondContact O-CB 3.37Å; F798-M802 PolarHBondContact O-N 3.29Å
799	M	84.9	Confident	80.9	Confident	106 Å²	106	78.1 Å²	78.1	52%	0.522	42%	0.423	S	S	.	.	H	α-helix	trans	-64.8	-25.9	174.4	-74.3	-68.3	-76	0	0	113	E795 D797 K803	E795-M799 WeakPolarHBondContact O-CB 3.22Å; E795-M799 VanDerWaalsContact O-CG 3.26Å; E795-M799 WeakPolarHBondContact O-CG 3.45Å; E795-M799 PolarHBondContact O-N 2.92Å; D797-M799 PolarHBondContact O-N 3.12Å; M799-K803 WeakPolarHBondContact O-CG 3.31Å; M799-K803 PolarHBondContact O-N 3.32Å
800	R	82.7	Confident	81.3	Confident	157 Å²	157	77.7 Å²	77.7	59%	0.592	42%	0.42	S	S	*	.	H	α-helix	trans	-70.7	-47.4	171.1	-164.1	-175.9	-53.2	145.4	21.6	110.9	A796 D797 F798 M802 K803 T804	A796-R800 PolarHBondContact O-N 3.2Å; D797-R800 WeakPolarHBondContact O-CB 3.38Å; D797-R800 PolarHBondContact O-N 3.22Å; D797-R800 VanDerWaalsContact O-N 3.13Å; D797-R800 IonicContact OD1-CZ 3.56Å; D797-R800 IonicContact OD1-NH1 2.71Å; D797-R800 IonicContact OD1-NH2 3.39Å; D797-R800 PolarHBondContact OD1-NH2 2.87Å; F798-R800 PolarHBondContact O-N 3.4Å; R800-M802 VanDerWaalsContact C-N 3.31Å; R800-M802 PolarHBondContact O-N 3.03Å; R800-K803 PolarHBondContact O-N 3.06Å; R800-T804 PolarHBondContact O-N 3.04Å; R800-T804 PolarHBondContact O-OG1 3.18Å
801	I	84.3	Confident	81.9	Confident	32 Å²	32	72 Å²	72	16%	0.164	40%	0.399	C	S	.	.	H	α-helix	trans	-57.4	-46.1	174.7	-65.1	167.6	0	0	0	110.4	F777 L781 D797 F798 K803 T804 V805 F821	F777-I801 HydrophobicContact CE1-CG2 4Å; F777-I801 HydrophobicContact CZ-CG2 4.37Å; L781-I801 HydrophobicContact CD1-CD1 4.44Å; L781-I801 HydrophobicContact CD1-CG2 4.16Å; D797-I801 WeakPolarHBondContact O-CG1 3.26Å; D797-I801 PolarHBondContact O-N 3.02Å; F798-I801 WeakPolarHBondContact O-CB 3.44Å; F798-I801 PolarHBondContact O-N 2.7Å; I801-K803 VanDerWaalsContact C-N 3.29Å; I801-K803 PolarHBondContact O-N 3.13Å; I801-T804 WeakPolarHBondContact O-CA 3.38Å; I801-T804 WeakPolarHBondContact O-CB 3.41Å; I801-T804 PolarHBondContact O-N 2.91Å; I801-V805 PolarHBondContact O-N 3.32Å; I801-V805 VanDerWaalsContact O-N 3.1Å; I801-F821 HydrophobicContact CB-CE2 4.27Å; I801-F821 HydrophobicContact CB-CZ 4.45Å; I801-F821 HydrophobicContact CD1-CZ 4.04Å; I801-F821 HydrophobicContact CG1-CE2 3.95Å; I801-F821 HydrophobicContact CG1-CZ 3.98Å; I801-F821 HydrophobicContact CG2-CD2 4.08Å; I801-F821 HydrophobicContact CG2-CE1 4.21Å; I801-F821 HydrophobicContact CG2-CE2 3.59Å; I801-F821 HydrophobicContact CG2-CZ 3.66Å
802	M	86.3	Confident	82.2	Confident	21 Å²	21	72.9 Å²	72.9	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-38.7	-178.9	-163.9	71.4	-136.4	0	0	112.4	P774 F777 F798 R800 T804 V805 D806 V813	P774-M802 HydrophobicContact CB-SD 4.18Å; P774-M802 HydrophobicContact CG-CE 4.47Å; P774-M802 HydrophobicContact CG-SD 4.3Å; F777-M802 HydrophobicContact CD1-SD 4.29Å; F798-M802 HydrophobicContact CZ-SD 4.42Å; F798-M802 WeakPolarHBondContact O-CB 3.37Å; F798-M802 PolarHBondContact O-N 3.29Å; R800-M802 VanDerWaalsContact C-N 3.31Å; R800-M802 PolarHBondContact O-N 3.03Å; M802-T804 VanDerWaalsContact C-N 3.27Å; M802-T804 PolarHBondContact O-N 3.08Å; M802-V805 HydrophobicContact CE-CG2 4.18Å; M802-V805 PolarHBondContact O-N 3.28Å; M802-V805 HydrophobicContact SD-CG2 4.34Å; M802-D806 HydrophobicContact CE-CB 3.45Å; M802-D806 VanDerWaalsContact CE-CB 3.45Å; M802-D806 PolarHBondContact O-N 3.22Å; M802-V813 HydrophobicContact CE-CG2 3.52Å; M802-V813 HydrophobicContact SD-CG2 4.25Å
803	K	84	Confident	82.7	Confident	151 Å²	151	67.4 Å²	67.4	66%	0.657	36%	0.356	S	S	*	.	H	α-helix	trans	-66	-25.9	173.6	-75.3	-179.8	177.3	-176.2	0	113.8	M799 R800 I801 P807	M799-K803 WeakPolarHBondContact O-CG 3.31Å; M799-K803 PolarHBondContact O-N 3.32Å; R800-K803 PolarHBondContact O-N 3.06Å; I801-K803 VanDerWaalsContact C-N 3.29Å; I801-K803 PolarHBondContact O-N 3.13Å; K803-P807 WeakPolarHBondContact O-CA 3.3Å
804	T	80.5	Confident	83.2	Confident	78 Å²	78	64.3 Å²	64.3	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-78.2	-39.6	176	-53.3	0	0	0	0	111.7	R800 I801 M802	R800-T804 PolarHBondContact O-N 3.04Å; R800-T804 PolarHBondContact O-OG1 3.18Å; I801-T804 WeakPolarHBondContact O-CA 3.38Å; I801-T804 WeakPolarHBondContact O-CB 3.41Å; I801-T804 PolarHBondContact O-N 2.91Å; M802-T804 VanDerWaalsContact C-N 3.27Å; M802-T804 PolarHBondContact O-N 3.08Å
805	V	82.3	Confident	83.4	Confident	13 Å²	13	65.5 Å²	65.5	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-89	-22.7	-178.5	-65.7	0	0	0	0	114.8	F777 I801 M802 V813 A817 F821	F777-V805 HydrophobicContact CE1-CG2 3.77Å; F777-V805 HydrophobicContact CZ-CG1 4.12Å; F777-V805 HydrophobicContact CZ-CG2 3.99Å; I801-V805 PolarHBondContact O-N 3.32Å; I801-V805 VanDerWaalsContact O-N 3.1Å; M802-V805 HydrophobicContact CE-CG2 4.18Å; M802-V805 PolarHBondContact O-N 3.28Å; M802-V805 HydrophobicContact SD-CG2 4.34Å; V805-V813 HydrophobicContact CB-CG1 4.09Å; V805-V813 HydrophobicContact CB-CG2 4.35Å; V805-V813 HydrophobicContact CG2-CG1 4.25Å; V805-V813 HydrophobicContact CG2-CG2 3.67Å; V805-A817 HydrophobicContact CB-CB 4.44Å; V805-A817 WeakPolarHBondContact O-CB 3.23Å; V805-F821 HydrophobicContact CG1-CB 3.48Å; V805-F821 VanDerWaalsContact CG1-CB 3.48Å; V805-F821 HydrophobicContact CG1-CD2 4.29Å; V805-F821 HydrophobicContact CG1-CG 3.95Å
806	D	86.2	Confident	83	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.07	36%	0.358	C	S	.	.			trans	-134.5	65.5	176.3	-175.8	23.8	0	0	0	110.8	M802 H808 C809 T810 G811	M802-D806 HydrophobicContact CE-CB 3.45Å; M802-D806 VanDerWaalsContact CE-CB 3.45Å; M802-D806 PolarHBondContact O-N 3.22Å; D806-H808 PolarHBondContact O-N 3.39Å; D806-C809 PolarHBondContact O-N 3.45Å; D806-C809 PolarHBondContact OD1-N 3.44Å; D806-C809 VanDerWaalsContact OD2-C 3.32Å; D806-C809 WeakPolarHBondContact OD2-CA 3.4Å; D806-T810 VanDerWaalsContact CG-OG1 3.29Å; D806-T810 WeakPolarHBondContact OD1-CB 3.49Å; D806-T810 PolarHBondContact OD1-N 2.92Å; D806-T810 PolarHBondContact OD1-OG1 3.48Å; D806-T810 PolarHBondContact OD2-N 3.04Å; D806-T810 PolarHBondContact OD2-OG1 3.3Å; D806-G811 PolarHBondContact OD2-N 3.37Å
807	P	79.5	Confident	83	Confident	87 Å²	87	65.1 Å²	65.1	57%	0.565	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.3	-178.9	27	-35.9	0	0	0	113.6	K803	K803-P807 WeakPolarHBondContact O-CA 3.3Å
808	H	81.3	Confident	83.2	Confident	161 Å²	161	62.7 Å²	62.7	75%	0.745	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	2.6	178.2	-59.1	-51.8	0	0	0	113.5	D806 T810	D806-H808 PolarHBondContact O-N 3.39Å; H808-T810 HydrophobicContact CB-CG2 3.98Å; H808-T810 PolarHBondContact O-N 3.02Å
809	C	79.2	Confident	82.7	Confident	111 Å²	111	62.3 Å²	62.3	75%	0.75	33%	0.332	S	S	*	.			trans	52	40.3	-178.4	-60.5	0	0	0	0	113.3	D806 G811	D806-C809 PolarHBondContact O-N 3.45Å; D806-C809 PolarHBondContact OD1-N 3.44Å; D806-C809 VanDerWaalsContact OD2-C 3.32Å; D806-C809 WeakPolarHBondContact OD2-CA 3.4Å; C809-G811 PolarHBondContact O-N 3.32Å
810	T	83.1	Confident	81.9	Confident	63 Å²	63	62.5 Å²	62.5	39%	0.387	33%	0.331	S	S	.	.			trans	-67.5	-18.3	176.9	64.6	0	0	0	0	113.3	D806 H808 Y812	D806-T810 VanDerWaalsContact CG-OG1 3.29Å; D806-T810 WeakPolarHBondContact OD1-CB 3.49Å; D806-T810 PolarHBondContact OD1-N 2.92Å; D806-T810 PolarHBondContact OD1-OG1 3.48Å; D806-T810 PolarHBondContact OD2-N 3.04Å; D806-T810 PolarHBondContact OD2-OG1 3.3Å; H808-T810 HydrophobicContact CB-CG2 3.98Å; H808-T810 PolarHBondContact O-N 3.02Å; T810-Y812 VanDerWaalsContact O-CD1 3.25Å; T810-Y812 WeakPolarHBondContact O-CD1 3.48Å; T810-Y812 WeakPolarHBondContact O-CE1 3.36Å; T810-Y812 PolarHBondContact OG1-O 3.36Å
811	G	84.2	Confident	81.6	Confident	41 Å²	41	55.3 Å²	55.3	42%	0.423	30%	0.304	S	S	.	.	S	Bend	trans	85.4	11.8	177.7	0	0	0	0	0	114	D806 C809	D806-G811 PolarHBondContact OD2-N 3.37Å; C809-G811 PolarHBondContact O-N 3.32Å
812	Y	86.5	Confident	81.1	Confident	74 Å²	74	54.7 Å²	54.7	29%	0.29	30%	0.301	S	S	.	.			trans	-151.3	148.6	177.6	55.4	-91.7	0	0	0	112.5	R771 L772 T810 T814	R771-Y812 HydrophobicContact CB-CD2 4.23Å; R771-Y812 HydrophobicContact CB-CG 4.42Å; R771-Y812 HydrophobicContact CG-CD2 3.77Å; R771-Y812 HydrophobicContact CG-CE2 4.33Å; R771-Y812 HydrophobicContact CG-CG 4.34Å; R771-Y812 VanDerWaalsContact CZ-CE2 3.48Å; R771-Y812 VanDerWaalsContact NH1-CE2 3.33Å; R771-Y812 PolarHBondContact NH1-OH 3.03Å; L772-Y812 CarbonylContact O-C 3.44Å; L772-Y812 VanDerWaalsContact O-CA 3.23Å; L772-Y812 WeakPolarHBondContact O-CA 3.2Å; T810-Y812 VanDerWaalsContact O-CD1 3.25Å; T810-Y812 WeakPolarHBondContact O-CD1 3.48Å; T810-Y812 WeakPolarHBondContact O-CE1 3.36Å; T810-Y812 PolarHBondContact OG1-O 3.36Å; Y812-T814 HydrophobicContact CD2-CG2 4.35Å; Y812-T814 HydrophobicContact CE2-CG2 4.31Å
813	V	86.8	Confident	80.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.8	175.6	-173.2	0	0	0	0	109.8	R771 L772 F777 M802 V805 A817 F818	R771-V813 WeakPolarHBondContact CA-O 3.44Å; L772-V813 PolarHBondContact N-O 3.24Å; L772-V813 PolarHBondContact O-N 2.79Å; F777-V813 HydrophobicContact CB-CG2 4.17Å; F777-V813 HydrophobicContact CD1-CG2 3.81Å; F777-V813 HydrophobicContact CD2-CB 3.95Å; F777-V813 HydrophobicContact CD2-CG1 3.95Å; F777-V813 HydrophobicContact CD2-CG2 3.9Å; F777-V813 HydrophobicContact CE1-CG2 4.16Å; F777-V813 HydrophobicContact CE2-CB 4.3Å; F777-V813 HydrophobicContact CE2-CG1 3.8Å; F777-V813 HydrophobicContact CE2-CG2 4.24Å; F777-V813 HydrophobicContact CG-CB 4.2Å; F777-V813 HydrophobicContact CG-CG2 3.68Å; F777-V813 HydrophobicContact CZ-CG1 4.3Å; F777-V813 HydrophobicContact CZ-CG2 4.37Å; M802-V813 HydrophobicContact CE-CG2 3.52Å; M802-V813 HydrophobicContact SD-CG2 4.25Å; V805-V813 HydrophobicContact CB-CG1 4.09Å; V805-V813 HydrophobicContact CB-CG2 4.35Å; V805-V813 HydrophobicContact CG2-CG1 4.25Å; V805-V813 HydrophobicContact CG2-CG2 3.67Å; V813-A817 HydrophobicContact CG1-CB 4.24Å; V813-F818 HydrophobicContact CG1-CB 3.95Å
814	T	86.9	Confident	79.1	Confident	49 Å²	49	51.1 Å²	51.1	30%	0.301	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	159.2	172	63	0	0	0	0	110.9	Y812 D816 A817 F818	Y812-T814 HydrophobicContact CD2-CG2 4.35Å; Y812-T814 HydrophobicContact CE2-CG2 4.31Å; T814-D816 PolarHBondContact O-N 3.12Å; T814-A817 PolarHBondContact O-N 3.24Å; T814-A817 WeakPolarHBondContact OG1-CB 3.3Å; T814-A817 PolarHBondContact OG1-N 2.83Å; T814-F818 WeakPolarHBondContact O-CB 3.4Å; T814-F818 PolarHBondContact O-N 2.9Å
815	F	82.5	Confident	78.3	Confident	27 Å²	27	52.5 Å²	52.5	12%	0.118	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-35.8	176.5	-175.1	-103.5	0	0	0	112.5	R758 F761 F818 M819	R758-F815 HydrophobicContact CB-CE2 4.02Å; R758-F815 HydrophobicContact CB-CZ 3.9Å; R758-F815 HydrophobicContact CG-CE2 4.45Å; R758-F815 HydrophobicContact CG-CZ 4.37Å; R758-F815 VanDerWaalsContact NH1-CE1 3.28Å; F761-F815 HydrophobicContact CB-CD2 3.86Å; F761-F815 HydrophobicContact CB-CE2 4.11Å; F761-F815 HydrophobicContact CD1-CB 4.35Å; F761-F815 AromaticContact CD1-CD2 3.94Å; F761-F815 HydrophobicContact CD1-CD2 3.94Å; F761-F815 AromaticContact CD2-CD2 3.95Å; F761-F815 HydrophobicContact CD2-CD2 3.95Å; F761-F815 HydrophobicContact CE1-CB 4.07Å; F761-F815 HydrophobicContact CE1-CD2 4.48Å; F761-F815 HydrophobicContact CE2-CB 4.29Å; F761-F815 HydrophobicContact CE2-CD2 4.47Å; F761-F815 AromaticContact CG-CD2 3.65Å; F761-F815 HydrophobicContact CG-CD2 3.65Å; F761-F815 HydrophobicContact CG-CE2 4.4Å; F761-F815 HydrophobicContact CZ-CB 4.04Å; F815-F818 HydrophobicContact CD2-CD1 4.06Å; F815-F818 HydrophobicContact CE2-CD1 4.14Å; F815-F818 HydrophobicContact CE2-CE1 4.29Å; F815-M819 HydrophobicContact CD1-CG 3.92Å; F815-M819 HydrophobicContact CD2-CG 4.4Å; F815-M819 HydrophobicContact CE1-CG 3.39Å; F815-M819 HydrophobicContact CE1-SD 4.16Å; F815-M819 HydrophobicContact CE2-CG 3.93Å; F815-M819 HydrophobicContact CE2-SD 4.08Å; F815-M819 HydrophobicContact CG-CG 4.4Å; F815-M819 HydrophobicContact CZ-CG 3.41Å; F815-M819 VanDerWaalsContact CZ-CG 3.41Å; F815-M819 HydrophobicContact CZ-SD 3.6Å; F815-M819 VanDerWaalsContact CZ-SD 3.6Å; F815-M819 WeakPolarHBondContact O-CB 3.39Å; F815-M819 VanDerWaalsContact O-CG 3.31Å; F815-M819 WeakPolarHBondContact O-CG 3.48Å; F815-M819 PolarHBondContact O-N 2.97Å
816	D	75	Confident	77	Confident	104 Å²	104	55.1 Å²	55.1	56%	0.556	31%	0.305	S	S	*	.	H	α-helix	trans	-68.5	-42.9	178.4	-65.6	-58.6	0	0	0	112.7	T814 M819 Q820	T814-D816 PolarHBondContact O-N 3.12Å; D816-M819 PolarHBondContact O-N 3.08Å; D816-Q820 WeakPolarHBondContact O-CB 3.26Å; D816-Q820 PolarHBondContact O-N 3.02Å
817	A	80.9	Confident	75.4	Confident	19 Å²	19	57.6 Å²	57.6	16%	0.157	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-40.5	175.4	0	0	0	0	0	111.7	V805 V813 T814 Q820 F821	V805-A817 HydrophobicContact CB-CB 4.44Å; V805-A817 WeakPolarHBondContact O-CB 3.23Å; V813-A817 HydrophobicContact CG1-CB 4.24Å; T814-A817 PolarHBondContact O-N 3.24Å; T814-A817 WeakPolarHBondContact OG1-CB 3.3Å; T814-A817 PolarHBondContact OG1-N 2.83Å; A817-Q820 PolarHBondContact O-N 3.26Å; A817-F821 PolarHBondContact O-N 3.24Å
818	F	82.4	Confident	74	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-46.6	173.1	165.3	-121.1	0	0	0	112.2	C757 F761 F777 L781 L784 V813 T814 F815 Q820 F821 M822	C757-F818 HydrophobicContact CB-CE1 3.8Å; C757-F818 HydrophobicContact CB-CZ 4.07Å; F761-F818 HydrophobicContact CB-CD1 4.28Å; F761-F818 HydrophobicContact CB-CE1 4.17Å; F761-F818 HydrophobicContact CD2-CB 4.2Å; F761-F818 AromaticContact CD2-CD1 3.54Å; F761-F818 HydrophobicContact CD2-CD1 3.54Å; F761-F818 HydrophobicContact CD2-CE1 4.21Å; F761-F818 HydrophobicContact CD2-CG 4.05Å; F761-F818 HydrophobicContact CE2-CB 4.16Å; F761-F818 HydrophobicContact CE2-CD1 4.31Å; F761-F818 HydrophobicContact CE2-CG 4.49Å; F761-F818 HydrophobicContact CG-CD1 4.3Å; F777-F818 HydrophobicContact CE2-CB 4.25Å; F777-F818 AromaticContact CE2-CD2 3.74Å; F777-F818 HydrophobicContact CE2-CD2 3.74Å; F777-F818 HydrophobicContact CE2-CG 4.31Å; L781-F818 HydrophobicContact CD2-CE2 4.39Å; L784-F818 HydrophobicContact CD1-CE2 3.97Å; L784-F818 HydrophobicContact CD1-CZ 3.47Å; L784-F818 VanDerWaalsContact CD1-CZ 3.47Å; V813-F818 HydrophobicContact CG1-CB 3.95Å; T814-F818 WeakPolarHBondContact O-CB 3.4Å; T814-F818 PolarHBondContact O-N 2.9Å; F815-F818 HydrophobicContact CD2-CD1 4.06Å; F815-F818 HydrophobicContact CE2-CD1 4.14Å; F815-F818 HydrophobicContact CE2-CE1 4.29Å; F818-Q820 VanDerWaalsContact C-N 3.32Å; F818-Q820 PolarHBondContact O-N 2.9Å; F818-F821 PolarHBondContact O-N 2.94Å; F818-M822 HydrophobicContact CD2-CG 3.82Å; F818-M822 HydrophobicContact CE1-CG 4.39Å; F818-M822 HydrophobicContact CE2-CG 3.27Å; F818-M822 HydrophobicContact CE2-SD 3.66Å; F818-M822 HydrophobicContact CZ-CG 3.59Å; F818-M822 HydrophobicContact CZ-SD 4.15Å; F818-M822 WeakPolarHBondContact O-CG 3.46Å; F818-M822 PolarHBondContact O-N 2.71Å
819	M	76.8	Confident	72.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-35.2	176.7	-77.4	-57.5	-51	0	0	112.7	V749 I754 C757 F815 D816 M822 S823	V749-M819 HydrophobicContact CB-CE 4.35Å; V749-M819 HydrophobicContact CG1-CE 4.16Å; V749-M819 HydrophobicContact CG2-CE 4.23Å; I754-M819 HydrophobicContact CB-CE 4.42Å; I754-M819 HydrophobicContact CG1-CE 3.89Å; I754-M819 HydrophobicContact CG2-CE 4.36Å; C757-M819 HydrophobicContact CB-SD 3.73Å; F815-M819 HydrophobicContact CD1-CG 3.92Å; F815-M819 HydrophobicContact CD2-CG 4.4Å; F815-M819 HydrophobicContact CE1-CG 3.39Å; F815-M819 HydrophobicContact CE1-SD 4.16Å; F815-M819 HydrophobicContact CE2-CG 3.93Å; F815-M819 HydrophobicContact CE2-SD 4.08Å; F815-M819 HydrophobicContact CG-CG 4.4Å; F815-M819 HydrophobicContact CZ-CG 3.41Å; F815-M819 VanDerWaalsContact CZ-CG 3.41Å; F815-M819 HydrophobicContact CZ-SD 3.6Å; F815-M819 VanDerWaalsContact CZ-SD 3.6Å; F815-M819 WeakPolarHBondContact O-CB 3.39Å; F815-M819 VanDerWaalsContact O-CG 3.31Å; F815-M819 WeakPolarHBondContact O-CG 3.48Å; F815-M819 PolarHBondContact O-N 2.97Å; D816-M819 PolarHBondContact O-N 3.08Å; M819-M822 PolarHBondContact O-N 3.2Å; M819-S823 WeakPolarHBondContact O-CB 3.5Å; M819-S823 PolarHBondContact O-N 2.8Å; M819-S823 PolarHBondContact O-OG 2.79Å
820	Q	69.2	Low	72	Confident	110 Å²	110	47.4 Å²	47.4	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-47.3	173.2	-174.8	174.2	-0.9	0	0	110.7	D816 A817 F818 S823 Q824	D816-Q820 WeakPolarHBondContact O-CB 3.26Å; D816-Q820 PolarHBondContact O-N 3.02Å; A817-Q820 PolarHBondContact O-N 3.26Å; F818-Q820 VanDerWaalsContact C-N 3.32Å; F818-Q820 PolarHBondContact O-N 2.9Å; Q820-S823 PolarHBondContact O-N 2.7Å; Q820-S823 PolarHBondContact O-OG 3.32Å; Q820-Q824 WeakPolarHBondContact O-CG 2.84Å; Q820-Q824 PolarHBondContact O-N 3.01Å
821	F	76.5	Confident	71.4	Confident	6 Å²	6	47 Å²	47	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-48.7	173.9	171.8	-97.5	0	0	0	112.4	L781 F786 I801 V805 A817 F818 S823 Q824 Q825	L781-F821 HydrophobicContact CD2-CD1 4.24Å; L781-F821 HydrophobicContact CD2-CE1 3.72Å; F786-F821 HydrophobicContact CE1-CE1 4.22Å; F786-F821 HydrophobicContact CE1-CZ 4.36Å; F786-F821 HydrophobicContact CZ-CE1 4.15Å; I801-F821 HydrophobicContact CB-CE2 4.27Å; I801-F821 HydrophobicContact CB-CZ 4.45Å; I801-F821 HydrophobicContact CD1-CZ 4.04Å; I801-F821 HydrophobicContact CG1-CE2 3.95Å; I801-F821 HydrophobicContact CG1-CZ 3.98Å; I801-F821 HydrophobicContact CG2-CD2 4.08Å; I801-F821 HydrophobicContact CG2-CE1 4.21Å; I801-F821 HydrophobicContact CG2-CE2 3.59Å; I801-F821 HydrophobicContact CG2-CZ 3.66Å; V805-F821 HydrophobicContact CG1-CB 3.48Å; V805-F821 VanDerWaalsContact CG1-CB 3.48Å; V805-F821 HydrophobicContact CG1-CD2 4.29Å; V805-F821 HydrophobicContact CG1-CG 3.95Å; A817-F821 PolarHBondContact O-N 3.24Å; F818-F821 PolarHBondContact O-N 2.94Å; F821-S823 VanDerWaalsContact C-N 3.31Å; F821-S823 PolarHBondContact O-N 3.09Å; F821-Q824 WeakPolarHBondContact O-CB 3.4Å; F821-Q824 PolarHBondContact O-N 3.2Å; F821-Q824 VanDerWaalsContact O-N 3.1Å; F821-Q825 HydrophobicContact CD1-CG 4.31Å; F821-Q825 HydrophobicContact CD2-CG 4.33Å; F821-Q825 HydrophobicContact CE1-CG 3.83Å; F821-Q825 HydrophobicContact CE2-CG 3.85Å; F821-Q825 HydrophobicContact CZ-CG 3.58Å; F821-Q825 WeakPolarHBondContact O-CG 3.48Å; F821-Q825 PolarHBondContact O-N 3.19Å
822	M	72.9	Confident	71.2	Confident	19 Å²	19	45.8 Å²	45.8	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-45.1	176.9	-71.9	-59.2	-64.4	0	0	111.5	F786 F818 M819 Q824 Q825 T826	F786-M822 HydrophobicContact CE2-CE 3.88Å; F786-M822 HydrophobicContact CE2-SD 3.59Å; F786-M822 VanDerWaalsContact CE2-SD 3.59Å; F786-M822 HydrophobicContact CZ-CE 4.25Å; F786-M822 HydrophobicContact CZ-SD 3.83Å; F818-M822 HydrophobicContact CD2-CG 3.82Å; F818-M822 HydrophobicContact CE1-CG 4.39Å; F818-M822 HydrophobicContact CE2-CG 3.27Å; F818-M822 HydrophobicContact CE2-SD 3.66Å; F818-M822 HydrophobicContact CZ-CG 3.59Å; F818-M822 HydrophobicContact CZ-SD 4.15Å; F818-M822 WeakPolarHBondContact O-CG 3.46Å; F818-M822 PolarHBondContact O-N 2.71Å; M819-M822 PolarHBondContact O-N 3.2Å; M822-Q824 VanDerWaalsContact C-N 3.32Å; M822-Q824 PolarHBondContact O-N 2.92Å; M822-Q825 PolarHBondContact O-N 2.75Å; M822-Q825 VanDerWaalsContact O-N 3.13Å; M822-T826 PolarHBondContact O-N 3.47Å; M822-T826 PolarHBondContact O-OG1 3.42Å
823	S	64.9	Low	70.9	Confident	14 Å²	14	49.2 Å²	49.2	10%	0.098	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-37.8	176.8	68.4	0	0	0	0	113.3	R747 M819 Q820 F821 Q825 M827	R747-S823 VanDerWaalsContact O-CB 3.3Å; R747-S823 WeakPolarHBondContact O-CB 3.47Å; M819-S823 WeakPolarHBondContact O-CB 3.5Å; M819-S823 PolarHBondContact O-N 2.8Å; M819-S823 PolarHBondContact O-OG 2.79Å; Q820-S823 PolarHBondContact O-N 2.7Å; Q820-S823 PolarHBondContact O-OG 3.32Å; F821-S823 VanDerWaalsContact C-N 3.31Å; F821-S823 PolarHBondContact O-N 3.09Å; S823-Q825 VanDerWaalsContact C-N 3.33Å; S823-Q825 PolarHBondContact O-N 2.98Å; S823-M827 WeakPolarHBondContact O-CB 3.45Å; S823-M827 PolarHBondContact O-N 3.1Å
824	Q	64.4	Low	70.7	Confident	82 Å²	82	51.9 Å²	51.9	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-70.4	-25.1	175.8	-71.8	172.9	-14.1	0	0	113.5	Q820 F821 M822	Q820-Q824 WeakPolarHBondContact O-CG 2.84Å; Q820-Q824 PolarHBondContact O-N 3.01Å; F821-Q824 WeakPolarHBondContact O-CB 3.4Å; F821-Q824 PolarHBondContact O-N 3.2Å; F821-Q824 VanDerWaalsContact O-N 3.1Å; M822-Q824 VanDerWaalsContact C-N 3.32Å; M822-Q824 PolarHBondContact O-N 2.92Å
825	Q	62.9	Low	70.7	Confident	107 Å²	107	49.6 Å²	49.6	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-84.1	-39	173.9	-62.7	-58	-45.2	0	0	111.8	F786 F821 M822 S823	F786-Q825 HydrophobicContact CE1-CB 4.44Å; F786-Q825 HydrophobicContact CE1-CG 4.12Å; F786-Q825 HydrophobicContact CZ-CB 4.27Å; F786-Q825 HydrophobicContact CZ-CG 4.21Å; F821-Q825 HydrophobicContact CD1-CG 4.31Å; F821-Q825 HydrophobicContact CD2-CG 4.33Å; F821-Q825 HydrophobicContact CE1-CG 3.83Å; F821-Q825 HydrophobicContact CE2-CG 3.85Å; F821-Q825 HydrophobicContact CZ-CG 3.58Å; F821-Q825 WeakPolarHBondContact O-CG 3.48Å; F821-Q825 PolarHBondContact O-N 3.19Å; M822-Q825 PolarHBondContact O-N 2.75Å; M822-Q825 VanDerWaalsContact O-N 3.13Å; S823-Q825 VanDerWaalsContact C-N 3.33Å; S823-Q825 PolarHBondContact O-N 2.98Å
826	T	55	Low	71	Confident	69 Å²	69	49 Å²	49	42%	0.423	27%	0.273	S	S	.	.	H	α-helix	trans	-77.2	-40.5	-178.4	-48.9	0	0	0	0	112.2	M822 G828	M822-T826 PolarHBondContact O-N 3.47Å; M822-T826 PolarHBondContact O-OG1 3.42Å; T826-G828 PolarHBondContact O-N 3.14Å
827	M	51.7	Low	71.5	Confident	64 Å²	64	47.3 Å²	47.3	32%	0.315	26%	0.264	S	S	.	.	S	Bend	trans	-89.3	100.8	168.9	-59.3	-157.3	79.9	0	0	108.7	R747 G748 S823 A829	R747-M827 VanDerWaalsContact C-SD 3.52Å; R747-M827 WeakPolarHBondContact O-CG 3.49Å; G748-M827 VanDerWaalsContact CA-SD 3.55Å; G748-M827 PolarHBondContact N-SD 2.71Å; G748-M827 VanDerWaalsContact N-SD 3.44Å; S823-M827 WeakPolarHBondContact O-CB 3.45Å; S823-M827 PolarHBondContact O-N 3.1Å; M827-A829 PolarHBondContact O-N 3.07Å
828	G	51.1	Low	71.8	Confident	56 Å²	56	46.4 Å²	46.4	58%	0.577	26%	0.256	S	S	*	.			trans	-49.4	110.6	170.9	0	0	0	0	0	109.5	T826 D830	T826-G828 PolarHBondContact O-N 3.14Å; G828-D830 PolarHBondContact O-N 3.18Å
829	A	53.3	Low	72.1	Confident	45 Å²	45	46.4 Å²	46.4	37%	0.372	26%	0.256	S	S	.	.			trans	-58.6	130.2	-163.2	0	0	0	0	0	111.6	M827 T831 Q834	M827-A829 PolarHBondContact O-N 3.07Å; A829-T831 VanDerWaalsContact C-N 3.27Å; A829-T831 HydrophobicContact CB-CG2 3.91Å; A829-T831 PolarHBondContact O-N 2.95Å; A829-Q834 PolarHBondContact O-NE2 2.7Å; A829-Q834 PolarHBondContact O-OE1 3.34Å
830	D	64	Low	72.7	Confident	45 Å²	45	50.6 Å²	50.6	24%	0.241	27%	0.272	C	S	.	.			trans	-72.4	84.1	176.9	-164.9	31.2	0	0	0	108.7	V270 G828 Y894	V270-D830 VanDerWaalsContact CG2-OD1 3.28Å; V270-D830 WeakPolarHBondContact CG2-OD1 3.48Å; V270-D830 WeakPolarHBondContact CG2-OD2 3.31Å; G828-D830 PolarHBondContact O-N 3.18Å; D830-Y894 WeakPolarHBondContact O-CE1 3.45Å; D830-Y894 PolarHBondContact OD1-OH 3.09Å; D830-Y894 VanDerWaalsContact OD1-OH 3.1Å; D830-Y894 PolarHBondContact OD2-OH 3.35Å
831	T	71.5	Confident	73.4	Confident	53 Å²	53	48 Å²	48	33%	0.325	26%	0.264	S	S	.	.			trans	-101.1	160.2	-176.3	65.2	0	0	0	0	111.8	A829 E833 Q834 M835	A829-T831 VanDerWaalsContact C-N 3.27Å; A829-T831 HydrophobicContact CB-CG2 3.91Å; A829-T831 PolarHBondContact O-N 2.95Å; T831-E833 PolarHBondContact O-N 3.49Å; T831-Q834 PolarHBondContact O-N 2.82Å; T831-Q834 VanDerWaalsContact O-N 3.1Å; T831-Q834 PolarHBondContact OG1-N 3.04Å; T831-Q834 VanDerWaalsContact OG1-N 3.12Å; T831-M835 PolarHBondContact O-N 3.48Å
832	V	79.9	Confident	73.7	Confident	16 Å²	16	48 Å²	48	10%	0.097	26%	0.264	C	S	.	.	H	α-helix	trans	-52	-44.8	169.7	-177.6	0	0	0	0	110.6	Q834 M835 V836 A890 A891 Y894 E896	V832-Q834 PolarHBondContact O-N 3.49Å; V832-M835 PolarHBondContact O-N 3.19Å; V832-V836 HydrophobicContact CG1-CG2 4.15Å; V832-V836 WeakPolarHBondContact O-CB 3.03Å; V832-V836 VanDerWaalsContact O-CG2 3.23Å; V832-V836 WeakPolarHBondContact O-CG2 3.25Å; V832-V836 PolarHBondContact O-N 2.85Å; V832-A890 HydrophobicContact CG1-CB 4.18Å; V832-A891 HydrophobicContact CG1-CB 4.42Å; V832-Y894 HydrophobicContact CG2-CD2 3.59Å; V832-Y894 HydrophobicContact CG2-CE2 4.42Å; V832-Y894 HydrophobicContact CG2-CG 3.84Å; V832-E896 HydrophobicContact CG2-CG 4.18Å; V832-E896 WeakPolarHBondContact CG2-OE2 2.97Å
833	E	80.7	Confident	74.3	Confident	146 Å²	146	47.2 Å²	47.2	68%	0.682	26%	0.26	S	S	*	.	H	α-helix	trans	-59.5	-44.5	176.5	-63.1	-172.8	162.4	0	0	113.2	T831 M835 V836 N837	T831-E833 PolarHBondContact O-N 3.49Å; E833-M835 VanDerWaalsContact C-N 3.33Å; E833-M835 PolarHBondContact O-N 2.87Å; E833-V836 PolarHBondContact O-N 3.37Å; E833-N837 VanDerWaalsContact O-CB 3.28Å; E833-N837 WeakPolarHBondContact O-CB 3.44Å; E833-N837 PolarHBondContact O-N 3Å; E833-N837 PolarHBondContact O-ND2 2.61Å
834	Q	82	Confident	74.9	Confident	57 Å²	57	49.2 Å²	49.2	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-38.2	176.6	-73.4	-162.2	26.5	0	0	112	A829 T831 V832 S838	A829-Q834 PolarHBondContact O-NE2 2.7Å; A829-Q834 PolarHBondContact O-OE1 3.34Å; T831-Q834 PolarHBondContact O-N 2.82Å; T831-Q834 VanDerWaalsContact O-N 3.1Å; T831-Q834 PolarHBondContact OG1-N 3.04Å; T831-Q834 VanDerWaalsContact OG1-N 3.12Å; V832-Q834 PolarHBondContact O-N 3.49Å; Q834-S838 WeakPolarHBondContact O-CB 3.48Å; Q834-S838 PolarHBondContact O-N 3.35Å; Q834-S838 PolarHBondContact O-OG 2.92Å
835	M	86.5	Confident	75.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-45.7	176.4	-165.2	66.3	172.6	0	0	111.3	I267 V270 L271 T831 V832 E833 N837 S838 F839 A890 L893 Y894	I267-M835 HydrophobicContact CB-CE 4.09Å; I267-M835 HydrophobicContact CG1-CE 3.84Å; I267-M835 HydrophobicContact CG1-SD 3.87Å; I267-M835 HydrophobicContact CG2-CE 3.92Å; V270-M835 HydrophobicContact CB-CE 3.84Å; V270-M835 HydrophobicContact CB-SD 3.96Å; V270-M835 HydrophobicContact CG1-CE 3.88Å; V270-M835 HydrophobicContact CG1-SD 4.04Å; V270-M835 HydrophobicContact CG2-CE 4.39Å; V270-M835 HydrophobicContact CG2-SD 3.85Å; L271-M835 HydrophobicContact CD2-CE 4.44Å; L271-M835 HydrophobicContact CG-CE 4.43Å; T831-M835 PolarHBondContact O-N 3.48Å; V832-M835 PolarHBondContact O-N 3.19Å; E833-M835 VanDerWaalsContact C-N 3.33Å; E833-M835 PolarHBondContact O-N 2.87Å; M835-N837 PolarHBondContact O-N 3.13Å; M835-S838 WeakPolarHBondContact O-CB 3.32Å; M835-S838 PolarHBondContact O-N 2.7Å; M835-F839 HydrophobicContact CE-CD2 4.49Å; M835-F839 HydrophobicContact CE-CE2 3.57Å; M835-F839 HydrophobicContact CE-CZ 3.88Å; M835-F839 HydrophobicContact CG-CD2 4.12Å; M835-F839 HydrophobicContact CG-CE2 3.9Å; M835-F839 WeakPolarHBondContact O-CD2 3.44Å; M835-F839 PolarHBondContact O-N 3.23Å; M835-F839 HydrophobicContact SD-CE2 4.29Å; M835-A890 HydrophobicContact CB-CB 4.21Å; M835-A890 HydrophobicContact CG-CB 4.09Å; M835-L893 HydrophobicContact CE-CD1 4.14Å; M835-Y894 HydrophobicContact CB-CE2 4.32Å
836	V	89.1	Confident	76.8	Confident	16 Å²	16	48.2 Å²	48.2	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-44.1	174.5	168.4	0	0	0	0	111.4	V832 E833 S838 F839 R840 Y886 T887 A890	V832-V836 HydrophobicContact CG1-CG2 4.15Å; V832-V836 WeakPolarHBondContact O-CB 3.03Å; V832-V836 VanDerWaalsContact O-CG2 3.23Å; V832-V836 WeakPolarHBondContact O-CG2 3.25Å; V832-V836 PolarHBondContact O-N 2.85Å; E833-V836 PolarHBondContact O-N 3.37Å; V836-S838 VanDerWaalsContact C-N 3.32Å; V836-S838 PolarHBondContact O-N 3.01Å; V836-F839 PolarHBondContact O-N 2.99Å; V836-R840 WeakPolarHBondContact O-CB 3.44Å; V836-R840 PolarHBondContact O-N 3.03Å; V836-Y886 HydrophobicContact CG1-CE2 4.06Å; V836-Y886 WeakPolarHBondContact O-CE2 3.28Å; V836-T887 HydrophobicContact CG2-CG2 4.14Å; V836-A890 HydrophobicContact CG2-CB 3.62Å
837	N	85.5	Confident	78.2	Confident	68 Å²	68	47.9 Å²	47.9	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-65.5	-35.4	176.4	-70.1	-22.7	0	0	0	112	E833 M835 R840 T841	E833-N837 VanDerWaalsContact O-CB 3.28Å; E833-N837 WeakPolarHBondContact O-CB 3.44Å; E833-N837 PolarHBondContact O-N 3Å; E833-N837 PolarHBondContact O-ND2 2.61Å; M835-N837 PolarHBondContact O-N 3.13Å; N837-R840 PolarHBondContact O-N 2.93Å; N837-R840 PolarHBondContact OD1-NH1 2.87Å; N837-R840 PolarHBondContact OD1-NH2 2.95Å; N837-T841 PolarHBondContact O-N 2.75Å; N837-T841 PolarHBondContact O-OG1 3.31Å
838	S	86.9	Confident	80	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-45.4	175.7	-54	0	0	0	0	111	A263 R266 Q834 M835 V836 R840 T841 L842	A263-S838 WeakPolarHBondContact CB-O 3.39Å; R266-S838 WeakPolarHBondContact CD-OG 3.44Å; R266-S838 PolarHBondContact NH1-OG 3.39Å; Q834-S838 WeakPolarHBondContact O-CB 3.48Å; Q834-S838 PolarHBondContact O-N 3.35Å; Q834-S838 PolarHBondContact O-OG 2.92Å; M835-S838 WeakPolarHBondContact O-CB 3.32Å; M835-S838 PolarHBondContact O-N 2.7Å; V836-S838 VanDerWaalsContact C-N 3.32Å; V836-S838 PolarHBondContact O-N 3.01Å; S838-R840 PolarHBondContact O-N 3.31Å; S838-T841 WeakPolarHBondContact O-CB 3.3Å; S838-T841 PolarHBondContact O-N 3.35Å; S838-L842 PolarHBondContact O-N 2.66Å
839	F	89.8	Confident	81.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-39.5	174.4	-80.6	-62.7	0	0	0	112.4	I267 M835 V836 T841 L842 A843 I849 L854 M870 Y886 F889	I267-F839 HydrophobicContact CD1-CD1 3.57Å; I267-F839 HydrophobicContact CD1-CD2 4.3Å; I267-F839 HydrophobicContact CD1-CE1 3.75Å; I267-F839 HydrophobicContact CD1-CE2 4.48Å; I267-F839 HydrophobicContact CD1-CG 3.85Å; I267-F839 HydrophobicContact CD1-CZ 4.21Å; I267-F839 HydrophobicContact CG1-CD1 4.45Å; I267-F839 HydrophobicContact CG1-CE1 4.27Å; I267-F839 HydrophobicContact CG1-CE2 4.42Å; I267-F839 HydrophobicContact CG1-CZ 4.25Å; I267-F839 HydrophobicContact CG2-CE1 3.96Å; I267-F839 HydrophobicContact CG2-CZ 3.88Å; M835-F839 HydrophobicContact CE-CD2 4.49Å; M835-F839 HydrophobicContact CE-CE2 3.57Å; M835-F839 HydrophobicContact CE-CZ 3.88Å; M835-F839 HydrophobicContact CG-CD2 4.12Å; M835-F839 HydrophobicContact CG-CE2 3.9Å; M835-F839 WeakPolarHBondContact O-CD2 3.44Å; M835-F839 PolarHBondContact O-N 3.23Å; M835-F839 HydrophobicContact SD-CE2 4.29Å; V836-F839 PolarHBondContact O-N 2.99Å; F839-T841 VanDerWaalsContact C-N 3.25Å; F839-T841 PolarHBondContact O-N 2.94Å; F839-L842 PolarHBondContact O-N 2.92Å; F839-L842 VanDerWaalsContact O-N 3.13Å; F839-A843 WeakPolarHBondContact O-CB 3.48Å; F839-A843 PolarHBondContact O-N 3.45Å; F839-I849 HydrophobicContact CD1-CD1 4.2Å; F839-L854 HydrophobicContact CE1-CD2 4.2Å; F839-M870 HydrophobicContact CD1-CE 4.14Å; F839-M870 HydrophobicContact CE1-CE 3.49Å; F839-M870 VanDerWaalsContact CE1-CE 3.49Å; F839-M870 HydrophobicContact CE2-CE 4.14Å; F839-M870 HydrophobicContact CZ-CE 3.49Å; F839-M870 VanDerWaalsContact CZ-CE 3.49Å; F839-Y886 HydrophobicContact CB-CD1 4.08Å; F839-Y886 HydrophobicContact CB-CD2 3.29Å; F839-Y886 HydrophobicContact CB-CE2 3.82Å; F839-Y886 HydrophobicContact CB-CG 3.44Å; F839-Y886 VanDerWaalsContact CB-CG 3.44Å; F839-Y886 HydrophobicContact CD2-CD2 4.28Å; F839-Y886 HydrophobicContact CD2-CG 4.4Å; F839-Y886 HydrophobicContact CG-CD2 4.06Å; F839-Y886 AromaticContact CG-CG 3.97Å; F839-Y886 HydrophobicContact CG-CG 3.97Å; F839-F889 AromaticContact CE2-CD1 3.98Å; F839-F889 HydrophobicContact CE2-CD1 3.98Å; F839-F889 HydrophobicContact CE2-CE1 4.16Å; F839-F889 HydrophobicContact CZ-CD1 4.04Å; F839-F889 AromaticContact CZ-CE1 3.91Å; F839-F889 HydrophobicContact CZ-CE1 3.91Å
840	R	88.8	Confident	83.5	Confident	90 Å²	90	43.8 Å²	43.8	34%	0.34	24%	0.243	S	C	.	.	H	α-helix	trans	-57.2	-39.8	173.6	-170.7	-173.8	-57.4	120.1	9.6	111.7	V836 N837 S838 A843 G844 D845	V836-R840 WeakPolarHBondContact O-CB 3.44Å; V836-R840 PolarHBondContact O-N 3.03Å; N837-R840 PolarHBondContact O-N 2.93Å; N837-R840 PolarHBondContact OD1-NH1 2.87Å; N837-R840 PolarHBondContact OD1-NH2 2.95Å; S838-R840 PolarHBondContact O-N 3.31Å; R840-A843 PolarHBondContact O-N 3.05Å; R840-G844 PolarHBondContact O-N 2.94Å; R840-G844 VanDerWaalsContact O-N 3.16Å; R840-D845 VanDerWaalsContact CD-OD1 3.29Å; R840-D845 WeakPolarHBondContact CD-OD1 3.38Å; R840-D845 HydrophobicContact CG-CB 4.47Å; R840-D845 WeakPolarHBondContact CG-OD1 3.5Å; R840-D845 PolarHBondContact O-N 3.17Å
841	T	83.8	Confident	84.6	Confident	55 Å²	55	44 Å²	44	34%	0.337	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-42.1	176.3	-52.2	0	0	0	0	111.7	K259 A263 N837 S838 F839 G844	K259-T841 HydrophobicContact CB-CG2 4.08Å; A263-T841 HydrophobicContact CB-CG2 3.99Å; N837-T841 PolarHBondContact O-N 2.75Å; N837-T841 PolarHBondContact O-OG1 3.31Å; S838-T841 WeakPolarHBondContact O-CB 3.3Å; S838-T841 PolarHBondContact O-N 3.35Å; F839-T841 VanDerWaalsContact C-N 3.25Å; F839-T841 PolarHBondContact O-N 2.94Å; T841-G844 PolarHBondContact O-N 2.9Å
842	L	83.5	Confident	85.1	Confident	5 Å²	5	49 Å²	49	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-31.8	175.8	-61	-174.5	0	0	0	113.2	A260 A263 A264 I267 S838 F839 G844 I849 E857 L858	A260-L842 HydrophobicContact CB-CD2 4.32Å; A260-L842 WeakPolarHBondContact O-CD2 3.41Å; A263-L842 HydrophobicContact CB-CD2 4.16Å; A263-L842 HydrophobicContact CB-CG 4.34Å; A264-L842 HydrophobicContact CB-CD2 4.07Å; I267-L842 HydrophobicContact CD1-CD1 3.46Å; I267-L842 VanDerWaalsContact CD1-CD1 3.46Å; I267-L842 HydrophobicContact CD1-CG 4.17Å; S838-L842 PolarHBondContact O-N 2.66Å; F839-L842 PolarHBondContact O-N 2.92Å; F839-L842 VanDerWaalsContact O-N 3.13Å; L842-G844 VanDerWaalsContact C-N 3.26Å; L842-G844 PolarHBondContact O-N 3.19Å; L842-I849 HydrophobicContact CB-CD1 3.87Å; L842-E857 HydrophobicContact CD1-CB 4.3Å; L842-E857 HydrophobicContact CD2-CB 3.94Å; L842-E857 HydrophobicContact CD2-CG 4.05Å; L842-L858 HydrophobicContact CD1-CD2 4.38Å
843	A	84.7	Confident	85.3	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-70.7	-20.4	177.5	0	0	0	0	0	112.9	F839 R840 T846 Y848 I849 Q853 Y886	F839-A843 WeakPolarHBondContact O-CB 3.48Å; F839-A843 PolarHBondContact O-N 3.45Å; R840-A843 PolarHBondContact O-N 3.05Å; A843-T846 PolarHBondContact O-OG1 3Å; A843-T846 VanDerWaalsContact O-OG1 3.06Å; A843-Y848 WeakPolarHBondContact CB-O 3.43Å; A843-I849 HydrophobicContact CB-CB 4.28Å; A843-I849 HydrophobicContact CB-CG1 4.35Å; A843-Q853 PolarHBondContact O-NE2 3.02Å; A843-Y886 HydrophobicContact CB-CE1 4.2Å
844	G	78.6	Confident	85.5	Confident	56 Å²	56	42.8 Å²	42.8	58%	0.577	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.3	43.4	-171.5	0	0	0	0	0	111.8	R840 T841 L842 T846	R840-G844 PolarHBondContact O-N 2.94Å; R840-G844 VanDerWaalsContact O-N 3.16Å; T841-G844 PolarHBondContact O-N 2.9Å; L842-G844 VanDerWaalsContact C-N 3.26Å; L842-G844 PolarHBondContact O-N 3.19Å; G844-T846 PolarHBondContact O-N 3.45Å; G844-T846 VanDerWaalsContact O-N 3.16Å
845	D	80.8	Confident	85.6	Confident	126 Å²	126	45.8 Å²	45.8	67%	0.674	25%	0.248	S	C	*	.	S	Bend	trans	63.2	11.5	-179.4	-65.4	-56.4	0	0	0	116.5	R840	R840-D845 VanDerWaalsContact CD-OD1 3.29Å; R840-D845 WeakPolarHBondContact CD-OD1 3.38Å; R840-D845 HydrophobicContact CG-CB 4.47Å; R840-D845 WeakPolarHBondContact CG-OD1 3.5Å; R840-D845 PolarHBondContact O-N 3.17Å
846	T	84.8	Confident	85.3	Confident	43 Å²	43	54 Å²	54	26%	0.264	28%	0.279	S	S	.	.			trans	-76.1	148.3	166.6	52.8	0	0	0	0	112.1	A843 G844 Y848 Y886	A843-T846 PolarHBondContact O-OG1 3Å; A843-T846 VanDerWaalsContact O-OG1 3.06Å; G844-T846 PolarHBondContact O-N 3.45Å; G844-T846 VanDerWaalsContact O-N 3.16Å; T846-Y848 PolarHBondContact O-N 3.44Å; T846-Y848 VanDerWaalsContact O-N 3.12Å; T846-Y848 PolarHBondContact OG1-O 3.3Å; T846-Y886 PolarHBondContact O-OH 3.21Å; T846-Y886 VanDerWaalsContact O-OH 3.1Å
847	P	85.9	Confident	84.9	Confident	61 Å²	61	55.8 Å²	55.8	40%	0.396	29%	0.286	S	S	.	.	S	Bend	trans	-75	4.2	179.4	33	-37.5	0	0	0	114.1	Y873	P847-Y873 HydrophobicContact CB-CE2 4.42Å; P847-Y873 HydrophobicContact CG-CE1 4.45Å; P847-Y873 WeakPolarHBondContact O-CE2 3.38Å
848	Y	88.7	Confident	84.7	Confident	42 Å²	42	53.1 Å²	53.1	17%	0.165	27%	0.272	C	S	.	.	S	Bend	trans	-137.4	157.9	176.9	59.7	-100.6	0	0	0	109.4	A843 T846 T850 Y873 G877 V878 A883	A843-Y848 WeakPolarHBondContact CB-O 3.43Å; T846-Y848 PolarHBondContact O-N 3.44Å; T846-Y848 VanDerWaalsContact O-N 3.12Å; T846-Y848 PolarHBondContact OG1-O 3.3Å; Y848-T850 HydrophobicContact CE2-CG2 4.39Å; Y848-Y873 AromaticContact CD1-CD1 3.91Å; Y848-Y873 HydrophobicContact CD1-CD1 3.91Å; Y848-Y873 AromaticContact CD1-CE1 3.91Å; Y848-Y873 HydrophobicContact CD1-CE1 3.91Å; Y848-Y873 HydrophobicContact CG-CD1 4.2Å; Y848-G877 WeakPolarHBondContact CE1-O 3.46Å; Y848-G877 PolarHBondContact OH-O 3.22Å; Y848-V878 HydrophobicContact CD1-CG2 4.26Å; Y848-V878 HydrophobicContact CE1-CG2 4.28Å; Y848-A883 HydrophobicContact CD2-CB 3.74Å; Y848-A883 HydrophobicContact CE2-CB 4.35Å; Y848-A883 HydrophobicContact CG-CB 3.9Å
849	I	88.9	Confident	84.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.9	173	-164.4	164.5	0	0	0	110.1	F839 L842 A843 Q853 L854 M870 L884 Y886	F839-I849 HydrophobicContact CD1-CD1 4.2Å; L842-I849 HydrophobicContact CB-CD1 3.87Å; A843-I849 HydrophobicContact CB-CB 4.28Å; A843-I849 HydrophobicContact CB-CG1 4.35Å; I849-Q853 HydrophobicContact CD1-CB 4.42Å; I849-Q853 HydrophobicContact CG1-CB 3.84Å; I849-L854 HydrophobicContact CD1-CD2 3.73Å; I849-L854 HydrophobicContact CD1-CG 4.04Å; I849-L854 HydrophobicContact CG1-CD2 4.42Å; I849-L854 HydrophobicContact CG1-CG 4.21Å; I849-L854 HydrophobicContact CG2-CD1 4.27Å; I849-L854 HydrophobicContact CG2-CD2 4.45Å; I849-L854 HydrophobicContact CG2-CG 4.29Å; I849-M870 HydrophobicContact CG2-SD 4.09Å; I849-L884 HydrophobicContact CG2-CB 4.13Å; I849-L884 PolarHBondContact N-O 3.42Å; I849-L884 VanDerWaalsContact N-O 3.08Å; I849-L884 PolarHBondContact O-N 3.42Å; I849-Y886 HydrophobicContact CB-CD1 3.93Å; I849-Y886 HydrophobicContact CG2-CD1 3.99Å
850	T	88.2	Confident	84	Confident	37 Å²	37	62.2 Å²	62.2	23%	0.227	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	157.4	177.4	74.1	0	0	0	0	112.4	Y848 E852 Q853 L854 G882	Y848-T850 HydrophobicContact CE2-CG2 4.39Å; T850-E852 PolarHBondContact O-N 2.95Å; T850-Q853 PolarHBondContact O-N 3.24Å; T850-Q853 WeakPolarHBondContact OG1-CG 3.46Å; T850-Q853 PolarHBondContact OG1-N 2.88Å; T850-Q853 VanDerWaalsContact OG1-N 3.13Å; T850-Q853 PolarHBondContact OG1-OE1 3.31Å; T850-L854 PolarHBondContact O-N 3.23Å; T850-G882 WeakPolarHBondContact CA-O 3.38Å
851	T	87.1	Confident	83.7	Confident	50 Å²	50	65.4 Å²	65.4	31%	0.307	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-34.9	172.6	54.6	0	0	0	0	112.5	K855 I867 G882 L884	T851-K855 WeakPolarHBondContact O-CB 3.2Å; T851-K855 WeakPolarHBondContact O-CG 3.28Å; T851-K855 PolarHBondContact O-N 2.68Å; T851-K855 VanDerWaalsContact O-N 3.09Å; T851-I867 HydrophobicContact CG2-CD1 4.21Å; T851-I867 HydrophobicContact CG2-CG1 4.16Å; T851-I867 HydrophobicContact CG2-CG2 4.42Å; T851-G882 PolarHBondContact N-O 2.72Å; T851-L884 HydrophobicContact CG2-CD1 4.07Å
852	E	82.2	Confident	83.9	Confident	157 Å²	157	62.9 Å²	62.9	73%	0.734	33%	0.326	S	S	*	.	H	α-helix	trans	-69.6	-41.1	176.3	-62.2	-175.6	141.2	0	0	112.2	T850 K855 R856	T850-E852 PolarHBondContact O-N 2.95Å; E852-K855 PolarHBondContact O-N 3Å; E852-R856 WeakPolarHBondContact O-CB 3.34Å; E852-R856 PolarHBondContact O-N 3.44Å
853	Q	84.3	Confident	84	Confident	33 Å²	33	62.6 Å²	62.6	15%	0.154	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-48.2	174	-75.8	169.5	-37.8	0	0	110.9	A843 I849 T850 K855 R856 E857	A843-Q853 PolarHBondContact O-NE2 3.02Å; I849-Q853 HydrophobicContact CD1-CB 4.42Å; I849-Q853 HydrophobicContact CG1-CB 3.84Å; T850-Q853 PolarHBondContact O-N 3.24Å; T850-Q853 WeakPolarHBondContact OG1-CG 3.46Å; T850-Q853 PolarHBondContact OG1-N 2.88Å; T850-Q853 VanDerWaalsContact OG1-N 3.13Å; T850-Q853 PolarHBondContact OG1-OE1 3.31Å; Q853-K855 VanDerWaalsContact C-N 3.34Å; Q853-K855 PolarHBondContact O-N 2.89Å; Q853-R856 PolarHBondContact O-N 3.39Å; Q853-R856 VanDerWaalsContact O-N 3.16Å; Q853-E857 WeakPolarHBondContact O-CG 3.31Å; Q853-E857 PolarHBondContact O-N 2.88Å; Q853-E857 VanDerWaalsContact O-N 3.09Å
854	L	85.2	Confident	84.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-45	176.6	-72.7	170.8	0	0	0	112.2	F839 I849 T850 R856 L858 A863 C866 I867 M870 L884	F839-L854 HydrophobicContact CE1-CD2 4.2Å; I849-L854 HydrophobicContact CD1-CD2 3.73Å; I849-L854 HydrophobicContact CD1-CG 4.04Å; I849-L854 HydrophobicContact CG1-CD2 4.42Å; I849-L854 HydrophobicContact CG1-CG 4.21Å; I849-L854 HydrophobicContact CG2-CD1 4.27Å; I849-L854 HydrophobicContact CG2-CD2 4.45Å; I849-L854 HydrophobicContact CG2-CG 4.29Å; T850-L854 PolarHBondContact O-N 3.23Å; L854-R856 VanDerWaalsContact C-N 3.29Å; L854-R856 PolarHBondContact O-N 3.26Å; L854-L858 HydrophobicContact CD2-CD1 3.8Å; L854-L858 WeakPolarHBondContact O-CB 3.41Å; L854-L858 PolarHBondContact O-N 3.09Å; L854-A863 HydrophobicContact CB-CB 4.35Å; L854-C866 HydrophobicContact CD1-CB 4.03Å; L854-C866 HydrophobicContact CD2-CB 4.27Å; L854-I867 HydrophobicContact CD1-CG1 3.89Å; L854-M870 HydrophobicContact CD1-SD 3.98Å; L854-L884 HydrophobicContact CD1-CD1 3.72Å
855	K	84	Confident	84.6	Confident	119 Å²	119	64.2 Å²	64.2	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-73.3	-16.4	179.7	-71.4	-172.2	-179.2	-144.9	0	114.5	T851 E852 Q853 A863 D864 I867	T851-K855 WeakPolarHBondContact O-CB 3.2Å; T851-K855 WeakPolarHBondContact O-CG 3.28Å; T851-K855 PolarHBondContact O-N 2.68Å; T851-K855 VanDerWaalsContact O-N 3.09Å; E852-K855 PolarHBondContact O-N 3Å; Q853-K855 VanDerWaalsContact C-N 3.34Å; Q853-K855 PolarHBondContact O-N 2.89Å; K855-A863 HydrophobicContact CG-CB 3.83Å; K855-D864 WeakPolarHBondContact CE-OD1 3.34Å; K855-D864 IonicContact NZ-OD1 2.74Å; K855-D864 PolarHBondContact NZ-OD1 3.25Å; K855-D864 IonicContact NZ-OD2 3.62Å; K855-I867 HydrophobicContact CD-CD1 4.37Å; K855-I867 HydrophobicContact CG-CD1 4.23Å
856	R	81.3	Confident	85	Confident	173 Å²	173	58.2 Å²	58.2	65%	0.653	29%	0.286	S	S	*	.	H	α-helix	trans	-85.6	-37.4	175.3	-168.9	-178.3	73.8	-155.3	0.2	112.3	E852 Q853 L854	E852-R856 WeakPolarHBondContact O-CB 3.34Å; E852-R856 PolarHBondContact O-N 3.44Å; Q853-R856 PolarHBondContact O-N 3.39Å; Q853-R856 VanDerWaalsContact O-N 3.16Å; L854-R856 VanDerWaalsContact C-N 3.29Å; L854-R856 PolarHBondContact O-N 3.26Å
857	E	80	Confident	85.2	Confident	53 Å²	53	58.1 Å²	58.1	25%	0.248	28%	0.283	C	S	.	.	H	α-helix	trans	-102.5	-18.6	-170.2	-53.1	-63.6	157.2	0	0	114.3	A264 L842 Q853	A264-E857 WeakPolarHBondContact CB-O 3.33Å; L842-E857 HydrophobicContact CD1-CB 4.3Å; L842-E857 HydrophobicContact CD2-CB 3.94Å; L842-E857 HydrophobicContact CD2-CG 4.05Å; Q853-E857 WeakPolarHBondContact O-CG 3.31Å; Q853-E857 PolarHBondContact O-N 2.88Å; Q853-E857 VanDerWaalsContact O-N 3.09Å
858	L	81.1	Confident	85.3	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.063	30%	0.299	C	S	.	.	S	Bend	trans	-117.2	157	-179.2	-57.7	177.3	0	0	0	112.3	A264 I267 L842 L854 L862 A863	A264-L858 HydrophobicContact CB-CD2 4.16Å; I267-L858 HydrophobicContact CB-CD2 4.4Å; I267-L858 HydrophobicContact CG2-CD1 4.1Å; I267-L858 HydrophobicContact CG2-CD2 3.98Å; L842-L858 HydrophobicContact CD1-CD2 4.38Å; L854-L858 HydrophobicContact CD2-CD1 3.8Å; L854-L858 WeakPolarHBondContact O-CB 3.41Å; L854-L858 PolarHBondContact O-N 3.09Å; L858-L862 HydrophobicContact CB-CB 4.48Å; L858-A863 HydrophobicContact CB-CB 4.38Å
859	E	79.3	Confident	85.3	Confident	93 Å²	93	64.9 Å²	64.9	44%	0.435	31%	0.311	S	S	.	.			trans	-55.7	141.8	169	-68.4	173.8	172.1	0	0	110.7	K272 E861 L862 A863	K272-E859 WeakPolarHBondContact CE-OE2 3.48Å; K272-E859 IonicContact NZ-OE1 3.63Å; K272-E859 PolarHBondContact NZ-OE1 3.33Å; K272-E859 IonicContact NZ-OE2 2.73Å; K272-E859 PolarHBondContact NZ-OE2 3.43Å; E859-E861 VanDerWaalsContact C-N 3.31Å; E859-E861 PolarHBondContact O-N 3.37Å; E859-E861 VanDerWaalsContact O-N 3.15Å; E859-L862 HydrophobicContact CB-CG 4.49Å; E859-L862 PolarHBondContact O-N 2.99Å; E859-A863 PolarHBondContact O-N 3.03Å
860	P	82	Confident	85.3	Confident	99 Å²	99	65.5 Å²	65.5	64%	0.643	31%	0.314	S	S	*	.	H	α-helix	trans	-53.2	-41.9	-172.6	-30.1	35.8	0	0	0	114.9	L862 A863 D864	P860-L862 VanDerWaalsContact C-N 3.31Å; P860-L862 PolarHBondContact O-N 2.79Å; P860-A863 PolarHBondContact O-N 3.1Å; P860-D864 PolarHBondContact O-N 3.04Å
861	E	84.1	Confident	85.4	Confident	156 Å²	156	70.8 Å²	70.8	73%	0.729	33%	0.333	S	S	*	.	H	α-helix	trans	-63.5	-35.7	178.5	-61.7	-177.2	176.5	0	0	112.6	E859 Y865	E859-E861 VanDerWaalsContact C-N 3.31Å; E859-E861 PolarHBondContact O-N 3.37Å; E859-E861 VanDerWaalsContact O-N 3.15Å; E861-Y865 VanDerWaalsContact O-CB 3.29Å; E861-Y865 WeakPolarHBondContact O-CB 3.45Å; E861-Y865 PolarHBondContact O-N 2.85Å
862	L	87.2	Confident	85.4	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-79	-36.7	177.4	-65.6	-175.9	0	0	0	112.1	T268 L271 K272 L858 E859 P860 Y865 C866	T268-L862 HydrophobicContact CG2-CD1 3.73Å; L271-L862 HydrophobicContact CB-CD2 3.92Å; L271-L862 HydrophobicContact CD1-CB 4.29Å; L271-L862 HydrophobicContact CD1-CD2 4.46Å; K272-L862 HydrophobicContact CG-CD1 4.29Å; K272-L862 HydrophobicContact CG-CD2 4.22Å; L858-L862 HydrophobicContact CB-CB 4.48Å; E859-L862 HydrophobicContact CB-CG 4.49Å; E859-L862 PolarHBondContact O-N 2.99Å; P860-L862 VanDerWaalsContact C-N 3.31Å; P860-L862 PolarHBondContact O-N 2.79Å; L862-Y865 PolarHBondContact O-N 3.17Å; L862-C866 PolarHBondContact O-N 3.43Å
863	A	86.3	Confident	85.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-49.1	172.7	0	0	0	0	0	110.6	L854 K855 L858 E859 P860 Y865 C866 I867	L854-A863 HydrophobicContact CB-CB 4.35Å; K855-A863 HydrophobicContact CG-CB 3.83Å; L858-A863 HydrophobicContact CB-CB 4.38Å; E859-A863 PolarHBondContact O-N 3.03Å; P860-A863 PolarHBondContact O-N 3.1Å; A863-Y865 VanDerWaalsContact C-N 3.34Å; A863-Y865 PolarHBondContact O-N 3.33Å; A863-C866 PolarHBondContact O-N 3.01Å; A863-I867 WeakPolarHBondContact O-CD1 3.3Å; A863-I867 WeakPolarHBondContact O-CG1 3.46Å; A863-I867 PolarHBondContact O-N 3.34Å
864	D	88.3	Confident	85.3	Confident	65 Å²	65	72.2 Å²	72.2	35%	0.348	35%	0.351	S	S	.	.	H	α-helix	trans	-66.6	-33.4	177	-72.5	-24.1	0	0	0	112.1	K855 P860 I867 N868	K855-D864 WeakPolarHBondContact CE-OD1 3.34Å; K855-D864 IonicContact NZ-OD1 2.74Å; K855-D864 PolarHBondContact NZ-OD1 3.25Å; K855-D864 IonicContact NZ-OD2 3.62Å; P860-D864 PolarHBondContact O-N 3.04Å; D864-I867 PolarHBondContact O-N 3.27Å; D864-N868 WeakPolarHBondContact O-CB 3.28Å; D864-N868 VanDerWaalsContact O-CG 3.3Å; D864-N868 PolarHBondContact O-N 2.69Å; D864-N868 PolarHBondContact O-ND2 2.81Å
865	Y	87.3	Confident	84.7	Confident	28 Å²	28	73.5 Å²	73.5	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-44.9	171.7	-177.5	-98.5	0	0	0	112.8	L271 N274 Q275 E278 E861 L862 A863 R869	L271-Y865 HydrophobicContact CD2-CD1 4.1Å; L271-Y865 HydrophobicContact CD2-CE1 4.02Å; N274-Y865 PolarHBondContact OD1-OH 3.49Å; Q275-Y865 HydrophobicContact CG-CD2 4.02Å; Q275-Y865 HydrophobicContact CG-CE1 4.16Å; Q275-Y865 HydrophobicContact CG-CE2 3.61Å; Q275-Y865 HydrophobicContact CG-CG 4.43Å; Q275-Y865 VanDerWaalsContact NE2-CG 3.32Å; E278-Y865 PolarHBondContact OE2-OH 3.34Å; E861-Y865 VanDerWaalsContact O-CB 3.29Å; E861-Y865 WeakPolarHBondContact O-CB 3.45Å; E861-Y865 PolarHBondContact O-N 2.85Å; L862-Y865 PolarHBondContact O-N 3.17Å; A863-Y865 VanDerWaalsContact C-N 3.34Å; A863-Y865 PolarHBondContact O-N 3.33Å; Y865-R869 WeakPolarHBondContact O-CG 3.46Å; Y865-R869 VanDerWaalsContact OH-CZ 3.23Å; Y865-R869 PolarHBondContact OH-NH1 2.84Å
866	C	88.8	Confident	84	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-47.4	173.9	-77	0	0	0	0	111.8	L271 L854 L862 A863 N868 R869 M870	L271-C866 VanDerWaalsContact CD1-SG 3.51Å; L854-C866 HydrophobicContact CD1-CB 4.03Å; L854-C866 HydrophobicContact CD2-CB 4.27Å; L862-C866 PolarHBondContact O-N 3.43Å; A863-C866 PolarHBondContact O-N 3.01Å; C866-N868 VanDerWaalsContact C-N 3.29Å; C866-N868 PolarHBondContact O-N 3.18Å; C866-R869 PolarHBondContact O-N 3.34Å; C866-M870 HydrophobicContact CB-CE 3.96Å; C866-M870 HydrophobicContact CB-SD 4.15Å; C866-M870 WeakPolarHBondContact O-CB 3.2Å; C866-M870 WeakPolarHBondContact O-CG 3.33Å; C866-M870 PolarHBondContact O-N 2.9Å
867	I	88.8	Confident	83.3	Confident	40 Å²	40	67.9 Å²	67.9	21%	0.205	37%	0.373	C	S	.	.	H	α-helix	trans	-59.9	-38.6	-177.9	-69.2	165.2	0	0	0	111.7	T851 L854 K855 A863 D864 R869 L884	T851-I867 HydrophobicContact CG2-CD1 4.21Å; T851-I867 HydrophobicContact CG2-CG1 4.16Å; T851-I867 HydrophobicContact CG2-CG2 4.42Å; L854-I867 HydrophobicContact CD1-CG1 3.89Å; K855-I867 HydrophobicContact CD-CD1 4.37Å; K855-I867 HydrophobicContact CG-CD1 4.23Å; A863-I867 WeakPolarHBondContact O-CD1 3.3Å; A863-I867 WeakPolarHBondContact O-CG1 3.46Å; A863-I867 PolarHBondContact O-N 3.34Å; D864-I867 PolarHBondContact O-N 3.27Å; I867-R869 VanDerWaalsContact C-N 3.26Å; I867-R869 PolarHBondContact O-N 2.99Å; I867-L884 HydrophobicContact CG1-CD1 4.07Å
868	N	88.2	Confident	82.6	Confident	136 Å²	136	68.1 Å²	68.1	73%	0.727	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.1	179.4	-72.1	-43.8	0	0	0	114.4	D864 C866	D864-N868 WeakPolarHBondContact O-CB 3.28Å; D864-N868 VanDerWaalsContact O-CG 3.3Å; D864-N868 PolarHBondContact O-N 2.69Å; D864-N868 PolarHBondContact O-ND2 2.81Å; C866-N868 VanDerWaalsContact C-N 3.29Å; C866-N868 PolarHBondContact O-N 3.18Å
869	R	88.1	Confident	81.4	Confident	110 Å²	110	71.9 Å²	71.9	42%	0.415	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-26.7	-172.8	-70.6	-179.3	165.1	-130.8	-4.8	114.9	E278 Y865 C866 I867 F889	E278-R869 IonicContact OE1-CZ 2.72Å; E278-R869 IonicContact OE1-NH1 2.79Å; E278-R869 PolarHBondContact OE1-NH1 3.38Å; E278-R869 IonicContact OE1-NH2 3.67Å; E278-R869 PolarHBondContact OE1-NH2 3.12Å; E278-R869 IonicContact OE2-CZ 3.37Å; E278-R869 IonicContact OE2-NH1 3.1Å; E278-R869 IonicContact OE2-NH2 3.99Å; E278-R869 PolarHBondContact OE2-NH2 3.42Å; Y865-R869 WeakPolarHBondContact O-CG 3.46Å; Y865-R869 VanDerWaalsContact OH-CZ 3.23Å; Y865-R869 PolarHBondContact OH-NH1 2.84Å; C866-R869 PolarHBondContact O-N 3.34Å; I867-R869 VanDerWaalsContact C-N 3.26Å; I867-R869 PolarHBondContact O-N 2.99Å; R869-F889 HydrophobicContact CB-CD2 4.01Å; R869-F889 HydrophobicContact CB-CE2 3.63Å
870	M	90.3	Very high	80.3	Confident	13 Å²	13	74 Å²	74	6%	0.064	43%	0.425	C	S	.	.	S	Bend	trans	-69.4	136.1	174.3	-72.5	176.4	173.5	0	0	110.3	F839 I849 L854 C866 L884 F889	F839-M870 HydrophobicContact CD1-CE 4.14Å; F839-M870 HydrophobicContact CE1-CE 3.49Å; F839-M870 VanDerWaalsContact CE1-CE 3.49Å; F839-M870 HydrophobicContact CE2-CE 4.14Å; F839-M870 HydrophobicContact CZ-CE 3.49Å; F839-M870 VanDerWaalsContact CZ-CE 3.49Å; I849-M870 HydrophobicContact CG2-SD 4.09Å; L854-M870 HydrophobicContact CD1-SD 3.98Å; C866-M870 HydrophobicContact CB-CE 3.96Å; C866-M870 HydrophobicContact CB-SD 4.15Å; C866-M870 WeakPolarHBondContact O-CB 3.2Å; C866-M870 WeakPolarHBondContact O-CG 3.33Å; C866-M870 PolarHBondContact O-N 2.9Å; M870-L884 HydrophobicContact CB-CB 3.95Å; M870-L884 HydrophobicContact CB-CD1 4.27Å; M870-L884 HydrophobicContact CB-CD2 4.14Å; M870-L884 HydrophobicContact CB-CG 4.35Å; M870-L884 HydrophobicContact SD-CB 3.95Å; M870-L884 HydrophobicContact SD-CD1 4.14Å; M870-F889 HydrophobicContact CE-CB 4.44Å; M870-F889 HydrophobicContact CE-CD1 3.45Å; M870-F889 VanDerWaalsContact CE-CD1 3.45Å; M870-F889 HydrophobicContact CE-CE1 3.87Å; M870-F889 HydrophobicContact CE-CG 4.05Å; M870-F889 HydrophobicContact CG-CB 3.7Å; M870-F889 HydrophobicContact CG-CD1 4.02Å; M870-F889 HydrophobicContact CG-CD2 3.99Å; M870-F889 HydrophobicContact CG-CG 3.63Å
871	K	88.4	Confident	79.3	Confident	147 Å²	147	73.3 Å²	73.3	64%	0.639	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	152.3	171.2	-65.1	175.2	-177.8	173.3	0	109.3	D885	K871-D885 PolarHBondContact O-N 3.47Å
872	A	87	Confident	78.9	Confident	66 Å²	66	67.6 Å²	67.6	55%	0.545	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.4	172.4	0	0	0	0	0	110.7
873	Y	85.8	Confident	78.9	Confident	49 Å²	49	67.9 Å²	67.9	19%	0.192	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-84.1	124	179.8	-176.3	-93.5	0	0	0	111.3	P847 Y848 G875 V878 A883 D885	P847-Y873 HydrophobicContact CB-CE2 4.42Å; P847-Y873 HydrophobicContact CG-CE1 4.45Å; P847-Y873 WeakPolarHBondContact O-CE2 3.38Å; Y848-Y873 AromaticContact CD1-CD1 3.91Å; Y848-Y873 HydrophobicContact CD1-CD1 3.91Å; Y848-Y873 AromaticContact CD1-CE1 3.91Å; Y848-Y873 HydrophobicContact CD1-CE1 3.91Å; Y848-Y873 HydrophobicContact CG-CD1 4.2Å; Y873-G875 VanDerWaalsContact CE1-N 3.28Å; Y873-V878 HydrophobicContact CD1-CG2 3.67Å; Y873-V878 HydrophobicContact CE1-CG2 4.2Å; Y873-A883 PolarHBondContact N-O 2.92Å; Y873-D885 HydrophobicContact CD2-CB 4.06Å
874	N	78.9	Confident	79.1	Confident	156 Å²	156	68.7 Å²	68.7	83%	0.834	43%	0.425	S	S	*	.			trans	-110	12.8	-174.7	-65.2	-40.8	0	0	0	114
875	G	73.1	Confident	79.2	Confident	26 Å²	26	67 Å²	67	27%	0.268	42%	0.416	S	S	.	.	S	Bend	trans	-83.9	176.9	-178.2	0	0	0	0	0	114.7	Y873	Y873-G875 VanDerWaalsContact CE1-N 3.28Å
876	P	70.5	Confident	79.4	Confident	118 Å²	118	65.9 Å²	65.9	77%	0.766	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	146.3	177.8	28.5	-34.7	0	0	0	112.1
877	G	65.5	Low	79.4	Confident	57 Å²	57	68.9 Å²	68.9	59%	0.588	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	2.7	177	0	0	0	0	0	115.8	Y848 A879	Y848-G877 WeakPolarHBondContact CE1-O 3.46Å; Y848-G877 PolarHBondContact OH-O 3.22Å; G877-A879 PolarHBondContact O-N 3.47Å
878	V	64.5	Low	79.3	Confident	58 Å²	58	68.4 Å²	68.4	35%	0.352	43%	0.431	S	S	.	.			trans	-84.2	107.6	174.3	-176.2	0	0	0	0	110.1	Y848 Y873 N880 A883	Y848-V878 HydrophobicContact CD1-CG2 4.26Å; Y848-V878 HydrophobicContact CE1-CG2 4.28Å; Y873-V878 HydrophobicContact CD1-CG2 3.67Å; Y873-V878 HydrophobicContact CE1-CG2 4.2Å; V878-N880 VanDerWaalsContact CG1-O 3.28Å; V878-N880 WeakPolarHBondContact CG1-O 3.34Å; V878-A883 HydrophobicContact CG1-CB 4.04Å; V878-A883 HydrophobicContact CG2-CB 3.96Å
879	A	57.2	Low	79.4	Confident	91 Å²	91	62.2 Å²	62.2	75%	0.752	40%	0.397	S	S	*	.			trans	-88.2	-31	175.3	0	0	0	0	0	113.2	G877	G877-A879 PolarHBondContact O-N 3.47Å
880	N	56.6	Low	79.4	Confident	138 Å²	138	57 Å²	57	74%	0.738	38%	0.377	S	S	*	.	S	Bend	trans	-134.3	146.8	-174.7	-66.9	-36.8	0	0	0	110.3	V878	V878-N880 VanDerWaalsContact CG1-O 3.28Å; V878-N880 WeakPolarHBondContact CG1-O 3.34Å
881	G	60.6	Low	79	Confident	84 Å²	84	57.1 Å²	57.1	87%	0.866	38%	0.381	S	S	*	.	S	Bend	trans	-63.8	144.6	174.1	0	0	0	0	0	112.2
882	G	75.3	Confident	78.8	Confident	35 Å²	35	52.9 Å²	52.9	36%	0.361	37%	0.37	S	S	.	.			trans	119.3	4	-175.7	0	0	0	0	0	115.1	T850 T851	T850-G882 WeakPolarHBondContact CA-O 3.38Å; T851-G882 PolarHBondContact N-O 2.72Å
883	A	86.7	Confident	78.5	Confident	8 Å²	8	50.2 Å²	50.2	7%	0.066	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.3	172	0	0	0	0	0	111.7	Y848 Y873 V878	Y848-A883 HydrophobicContact CD2-CB 3.74Å; Y848-A883 HydrophobicContact CE2-CB 4.35Å; Y848-A883 HydrophobicContact CG-CB 3.9Å; Y873-A883 PolarHBondContact N-O 2.92Å; V878-A883 HydrophobicContact CG1-CB 4.04Å; V878-A883 HydrophobicContact CG2-CB 3.96Å
884	L	91.1	Very high	77.9	Confident	17 Å²	17	48.7 Å²	48.7	9%	0.089	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141	-178.2	-65.1	174	0	0	0	110.9	I849 T851 L854 I867 M870 Y886	I849-L884 HydrophobicContact CG2-CB 4.13Å; I849-L884 PolarHBondContact N-O 3.42Å; I849-L884 VanDerWaalsContact N-O 3.08Å; I849-L884 PolarHBondContact O-N 3.42Å; T851-L884 HydrophobicContact CG2-CD1 4.07Å; L854-L884 HydrophobicContact CD1-CD1 3.72Å; I867-L884 HydrophobicContact CG1-CD1 4.07Å; M870-L884 HydrophobicContact CB-CB 3.95Å; M870-L884 HydrophobicContact CB-CD1 4.27Å; M870-L884 HydrophobicContact CB-CD2 4.14Å; M870-L884 HydrophobicContact CB-CG 4.35Å; M870-L884 HydrophobicContact SD-CB 3.95Å; M870-L884 HydrophobicContact SD-CD1 4.14Å; L884-Y886 PolarHBondContact O-N 3.09Å
885	D	91.4	Very high	77.2	Confident	31 Å²	31	43.3 Å²	43.3	17%	0.166	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	100.3	176.2	177	19	0	0	0	110.5	K871 Y873 T887 S888	K871-D885 PolarHBondContact O-N 3.47Å; Y873-D885 HydrophobicContact CD2-CB 4.06Å; D885-T887 VanDerWaalsContact C-N 3.29Å; D885-T887 WeakPolarHBondContact OD1-CA 3.28Å; D885-T887 VanDerWaalsContact OD1-CB 3.31Å; D885-T887 WeakPolarHBondContact OD1-CB 3.46Å; D885-T887 PolarHBondContact OD1-N 3.1Å; D885-S888 VanDerWaalsContact CG-OG 3.32Å; D885-S888 PolarHBondContact OD1-N 3.08Å; D885-S888 WeakPolarHBondContact OD2-CB 3.41Å; D885-S888 PolarHBondContact OD2-N 3.26Å; D885-S888 PolarHBondContact OD2-OG 2.93Å
886	Y	91.1	Very high	76.4	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-77.6	-13.4	174.8	63.1	-103.6	0	0	0	113.3	V836 F839 A843 T846 I849 L884 A890	V836-Y886 HydrophobicContact CG1-CE2 4.06Å; V836-Y886 WeakPolarHBondContact O-CE2 3.28Å; F839-Y886 HydrophobicContact CB-CD1 4.08Å; F839-Y886 HydrophobicContact CB-CD2 3.29Å; F839-Y886 HydrophobicContact CB-CE2 3.82Å; F839-Y886 HydrophobicContact CB-CG 3.44Å; F839-Y886 VanDerWaalsContact CB-CG 3.44Å; F839-Y886 HydrophobicContact CD2-CD2 4.28Å; F839-Y886 HydrophobicContact CD2-CG 4.4Å; F839-Y886 HydrophobicContact CG-CD2 4.06Å; F839-Y886 AromaticContact CG-CG 3.97Å; F839-Y886 HydrophobicContact CG-CG 3.97Å; A843-Y886 HydrophobicContact CB-CE1 4.2Å; T846-Y886 PolarHBondContact O-OH 3.21Å; T846-Y886 VanDerWaalsContact O-OH 3.1Å; I849-Y886 HydrophobicContact CB-CD1 3.93Å; I849-Y886 HydrophobicContact CG2-CD1 3.99Å; L884-Y886 PolarHBondContact O-N 3.09Å; Y886-A890 VanDerWaalsContact O-CB 3.26Å; Y886-A890 WeakPolarHBondContact O-CB 3.2Å; Y886-A890 PolarHBondContact O-N 2.79Å
887	T	89	Confident	75.2	Confident	63 Å²	63	45.7 Å²	45.7	39%	0.387	32%	0.321	S	S	.	.	H	α-helix	trans	-79.3	-49.9	-176.1	-52.5	0	0	0	0	110.8	V836 D885 F889 A890 A891	V836-T887 HydrophobicContact CG2-CG2 4.14Å; D885-T887 VanDerWaalsContact C-N 3.29Å; D885-T887 WeakPolarHBondContact OD1-CA 3.28Å; D885-T887 VanDerWaalsContact OD1-CB 3.31Å; D885-T887 WeakPolarHBondContact OD1-CB 3.46Å; D885-T887 PolarHBondContact OD1-N 3.1Å; T887-F889 VanDerWaalsContact C-N 3.28Å; T887-F889 PolarHBondContact O-N 2.74Å; T887-A890 PolarHBondContact O-N 2.68Å; T887-A891 PolarHBondContact O-N 3.43Å
888	S	86.4	Confident	73.5	Confident	30 Å²	30	52.3 Å²	52.3	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-65.7	-32.8	173	62.6	0	0	0	0	112.5	D885 A891 S892	D885-S888 VanDerWaalsContact CG-OG 3.32Å; D885-S888 PolarHBondContact OD1-N 3.08Å; D885-S888 WeakPolarHBondContact OD2-CB 3.41Å; D885-S888 PolarHBondContact OD2-N 3.26Å; D885-S888 PolarHBondContact OD2-OG 2.93Å; S888-A891 PolarHBondContact O-N 3.04Å; S888-S892 WeakPolarHBondContact O-CB 3.46Å; S888-S892 PolarHBondContact O-N 3.01Å
889	F	89.9	Confident	72	Confident	5 Å²	5	61.1 Å²	61.1	2%	0.022	38%	0.381	C	S	.	.	H	α-helix	trans	-63.9	-46.6	172.4	176.6	-105	0	0	0	112	L271 F839 R869 M870 T887 A891 S892 L893	L271-F889 HydrophobicContact CD2-CE1 3.92Å; L271-F889 HydrophobicContact CD2-CZ 3.76Å; F839-F889 AromaticContact CE2-CD1 3.98Å; F839-F889 HydrophobicContact CE2-CD1 3.98Å; F839-F889 HydrophobicContact CE2-CE1 4.16Å; F839-F889 HydrophobicContact CZ-CD1 4.04Å; F839-F889 AromaticContact CZ-CE1 3.91Å; F839-F889 HydrophobicContact CZ-CE1 3.91Å; R869-F889 HydrophobicContact CB-CD2 4.01Å; R869-F889 HydrophobicContact CB-CE2 3.63Å; M870-F889 HydrophobicContact CE-CB 4.44Å; M870-F889 HydrophobicContact CE-CD1 3.45Å; M870-F889 VanDerWaalsContact CE-CD1 3.45Å; M870-F889 HydrophobicContact CE-CE1 3.87Å; M870-F889 HydrophobicContact CE-CG 4.05Å; M870-F889 HydrophobicContact CG-CB 3.7Å; M870-F889 HydrophobicContact CG-CD1 4.02Å; M870-F889 HydrophobicContact CG-CD2 3.99Å; M870-F889 HydrophobicContact CG-CG 3.63Å; T887-F889 VanDerWaalsContact C-N 3.28Å; T887-F889 PolarHBondContact O-N 2.74Å; F889-A891 PolarHBondContact O-N 2.9Å; F889-S892 PolarHBondContact O-N 2.93Å; F889-S892 PolarHBondContact O-OG 2.94Å; F889-L893 HydrophobicContact CD1-CD1 4.2Å; F889-L893 HydrophobicContact CE1-CD1 3.7Å; F889-L893 HydrophobicContact CE1-CG 4.42Å; F889-L893 HydrophobicContact CZ-CD1 3.96Å; F889-L893 HydrophobicContact CZ-CD2 4.3Å; F889-L893 HydrophobicContact CZ-CG 4.31Å; F889-L893 PolarHBondContact O-N 3.01Å
890	A	87.1	Confident	72.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.4	-47.8	174.1	0	0	0	0	0	111.4	V832 M835 V836 Y886 T887 S892 L893 Y894	V832-A890 HydrophobicContact CG1-CB 4.18Å; M835-A890 HydrophobicContact CB-CB 4.21Å; M835-A890 HydrophobicContact CG-CB 4.09Å; V836-A890 HydrophobicContact CG2-CB 3.62Å; Y886-A890 VanDerWaalsContact O-CB 3.26Å; Y886-A890 WeakPolarHBondContact O-CB 3.2Å; Y886-A890 PolarHBondContact O-N 2.79Å; T887-A890 PolarHBondContact O-N 2.68Å; A890-S892 VanDerWaalsContact C-N 3.31Å; A890-S892 PolarHBondContact O-N 2.77Å; A890-L893 PolarHBondContact O-N 3.25Å; A890-Y894 WeakPolarHBondContact O-CD2 3.22Å
891	A	84	Confident	73.6	Confident	17 Å²	17	55.5 Å²	55.5	14%	0.14	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-41.5	176.8	0	0	0	0	0	112.6	V832 T887 S888 F889 L893 Y894 G895 E896	V832-A891 HydrophobicContact CG1-CB 4.42Å; T887-A891 PolarHBondContact O-N 3.43Å; S888-A891 PolarHBondContact O-N 3.04Å; F889-A891 PolarHBondContact O-N 2.9Å; A891-L893 VanDerWaalsContact C-N 3.32Å; A891-L893 PolarHBondContact O-N 3.43Å; A891-Y894 PolarHBondContact O-N 2.94Å; A891-G895 PolarHBondContact O-N 3.49Å; A891-E896 HydrophobicContact CB-CB 4.15Å; A891-E896 PolarHBondContact O-N 3.35Å
892	S	82.8	Confident	74.3	Confident	58 Å²	58	53.9 Å²	53.9	41%	0.406	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-30	179.6	73.5	0	0	0	0	114.1	S888 F889 A890 Y894 G895 S897	S888-S892 WeakPolarHBondContact O-CB 3.46Å; S888-S892 PolarHBondContact O-N 3.01Å; F889-S892 PolarHBondContact O-N 2.93Å; F889-S892 PolarHBondContact O-OG 2.94Å; A890-S892 VanDerWaalsContact C-N 3.31Å; A890-S892 PolarHBondContact O-N 2.77Å; S892-Y894 VanDerWaalsContact C-N 3.25Å; S892-Y894 PolarHBondContact O-N 3.27Å; S892-G895 PolarHBondContact O-N 3.27Å; S892-S897 WeakPolarHBondContact CA-OG 3.4Å; S892-S897 WeakPolarHBondContact CB-OG 3.4Å
893	L	80.1	Confident	74.3	Confident	10 Å²	10	55.1 Å²	55.1	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-66.8	-25.6	178.5	-72.6	172.5	0	0	0	113.3	V270 L271 N274 R355 M835 F889 A890 A891	V270-L893 HydrophobicContact CG1-CD1 4.47Å; L271-L893 HydrophobicContact CD2-CD1 4.29Å; N274-L893 HydrophobicContact CB-CD2 4.24Å; N274-L893 WeakPolarHBondContact OD1-CD2 3.37Å; R355-L893 PolarHBondContact NH1-O 3.26Å; M835-L893 HydrophobicContact CE-CD1 4.14Å; F889-L893 HydrophobicContact CD1-CD1 4.2Å; F889-L893 HydrophobicContact CE1-CD1 3.7Å; F889-L893 HydrophobicContact CE1-CG 4.42Å; F889-L893 HydrophobicContact CZ-CD1 3.96Å; F889-L893 HydrophobicContact CZ-CD2 4.3Å; F889-L893 HydrophobicContact CZ-CG 4.31Å; F889-L893 PolarHBondContact O-N 3.01Å; A890-L893 PolarHBondContact O-N 3.25Å; A891-L893 VanDerWaalsContact C-N 3.32Å; A891-L893 PolarHBondContact O-N 3.43Å
894	Y	74.8	Confident	73.5	Confident	17 Å²	17	58 Å²	58	7%	0.067	33%	0.326	C	S	.	.	H	α-helix	trans	-111.6	0.9	179.7	-58.3	-92.8	0	0	0	113	V270 D830 V832 M835 A890 A891 S892	V270-Y894 WeakPolarHBondContact CG1-OH 3.33Å; D830-Y894 WeakPolarHBondContact O-CE1 3.45Å; D830-Y894 PolarHBondContact OD1-OH 3.09Å; D830-Y894 VanDerWaalsContact OD1-OH 3.1Å; D830-Y894 PolarHBondContact OD2-OH 3.35Å; V832-Y894 HydrophobicContact CG2-CD2 3.59Å; V832-Y894 HydrophobicContact CG2-CE2 4.42Å; V832-Y894 HydrophobicContact CG2-CG 3.84Å; M835-Y894 HydrophobicContact CB-CE2 4.32Å; A890-Y894 WeakPolarHBondContact O-CD2 3.22Å; A891-Y894 PolarHBondContact O-N 2.94Å; S892-Y894 VanDerWaalsContact C-N 3.25Å; S892-Y894 PolarHBondContact O-N 3.27Å
895	G	63.5	Low	72.3	Confident	42 Å²	42	60.7 Å²	60.7	43%	0.433	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	18.6	177.4	0	0	0	0	0	115.5	A891 S892	A891-G895 PolarHBondContact O-N 3.49Å; S892-G895 PolarHBondContact O-N 3.27Å
896	E	57	Low	70.9	Confident	141 Å²	141	62.9 Å²	62.9	66%	0.659	35%	0.354	S	S	*	.			trans	-85.5	-9	176	-69.1	-172.2	174.4	0	0	113.5	V832 A891	V832-E896 HydrophobicContact CG2-CG 4.18Å; V832-E896 WeakPolarHBondContact CG2-OE2 2.97Å; A891-E896 HydrophobicContact CB-CB 4.15Å; A891-E896 PolarHBondContact O-N 3.35Å
897	S	44.3	Very low	69.4	Low	53 Å²	53	67.4 Å²	67.4	37%	0.371	38%	0.38	S	S	.	.	S	Bend	trans	-82.6	119.7	176.6	65.2	0	0	0	0	111.7	S892 L899	S892-S897 WeakPolarHBondContact CA-OG 3.4Å; S892-S897 WeakPolarHBondContact CB-OG 3.4Å; S897-L899 PolarHBondContact O-N 2.87Å
898	E	30.3	Very low	67.8	Low	196 Å²	196	67.8 Å²	67.8	92%	0.916	38%	0.379	S	S	*	.			trans	-14.1	106.9	176.7	-64.6	179	156.2	0	0	116.7
899	L	33	Very low	66.1	Low	244 Å²	244	71.2 Å²	71.2	100%	1.277	40%	0.395	S	S	*	.			trans	-68.8	0	133.1	-94.7	165.3	0	0	0	109.4	S897	S897-L899 PolarHBondContact O-N 2.87Å

Retrieved 899 of 899 residues in 1314.9 ms (Link to these results)

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