A0A087Y5M9_POEFO Loading...

Ganglioside-induced differentiation-associated protein 1

Regulates the mitochondrial network by promoting mitochondrial fission.

AlphaFold DB , UniProt , Accession A0A087Y5M9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 362 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.5	Very low	34.6	Very low	246 Å²	246	136.8 Å²	136.8	100%	1.212	79%	0.786	S	S	*	*				0	124.1	0	-88.7	-178.9	158.1	0	0	107.4
2	A	35.1	Very low	35.1	Very low	93 Å²	93	141.1 Å²	141.1	77%	0.769	79%	0.794	S	S	*	*			trans	56.2	103.9	167.8	0	0	0	0	0	117.1
3	S	30.2	Very low	35.3	Very low	97 Å²	97	145 Å²	145	68%	0.678	80%	0.797	S	S	*	*				65.9	108.6	74.5	81.4	0	0	0	0	112.8
4	E	35.2	Very low	35.3	Very low	169 Å²	169	139.1 Å²	139.1	79%	0.79	78%	0.777	S	S	*	*				76.7	139.5	106.5	-74.9	-175.2	-175.3	0	0	112.3
5	N	31.8	Very low	35.5	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	78%	0.775	S	S	*	*			cis	-162.2	166.3	8.4	-93.4	-30.6	0	0	0	103.4
6	G	28.5	Very low	35.5	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	78%	0.779	S	S	*	*			cis	152.7	165.5	19.9	0	0	0	0	0	108.1
7	S	32.5	Very low	35.5	Very low	114 Å²	114	137 Å²	137	80%	0.797	77%	0.773	S	S	*	*			trans	67.1	95.8	176.9	75.9	0	0	0	0	116.8
8	E	36.2	Very low	35.3	Very low	157 Å²	157	138.9 Å²	138.9	73%	0.734	77%	0.774	S	S	*	*				50.4	118.6	68.3	-70.4	-167	150.5	0	0	114.7
9	T	35.2	Very low	35.2	Very low	123 Å²	123	137.1 Å²	137.1	76%	0.755	78%	0.779	S	S	*	*				-155.9	102	125.9	37.8	0	0	0	0	106.7	D11	T9-D11 VanDerWaalsContact C-N 3.33Å; T9-D11 PolarHBondContact O-N 3.24Å
10	Q	37.1	Very low	35.2	Very low	157 Å²	157	135.1 Å²	135.1	73%	0.734	77%	0.774	S	S	*	*				65.5	18.1	77.5	-72.2	-168.7	-12.2	0	0	116.1
11	D	42.8	Very low	35.1	Very low	138 Å²	138	133 Å²	133	74%	0.738	77%	0.767	S	S	*	*			trans	-117.9	-2.1	177.7	-88	-33.1	0	0	0	117.3	T9	T9-D11 VanDerWaalsContact C-N 3.33Å; T9-D11 PolarHBondContact O-N 3.24Å
12	E	39.7	Very low	34.7	Very low	188 Å²	188	129.5 Å²	129.5	88%	0.879	75%	0.748	S	S	*	*	S	Bend	trans	-110.4	-0.3	-179.7	-91.9	-175.7	156.7	0	0	115.6
13	K	37.8	Very low	34.3	Very low	192 Å²	192	132.7 Å²	132.7	84%	0.835	75%	0.747	S	S	*	*	S	Bend	trans	-108.6	-1.3	176.6	-94	-176.5	175.5	-179.7	0	115.2
14	A	36.3	Very low	34.2	Very low	63 Å²	63	137.3 Å²	137.3	52%	0.521	76%	0.758	S	S	.	*	S	Bend	trans	-87	-14	176.2	0	0	0	0	0	113.9	L16	A14-L16 PolarHBondContact O-N 2.8Å
15	A	37.3	Very low	33.7	Very low	91 Å²	91	134.8 Å²	134.8	75%	0.752	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	0.1	-173.7	0	0	0	0	0	115.7
16	L	35.9	Very low	33.6	Very low	158 Å²	158	136.1 Å²	136.1	83%	0.827	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	4.1	-174.3	-95.4	148.3	0	0	0	114.8	A14	A14-L16 PolarHBondContact O-N 2.8Å
17	I	34.6	Very low	33.6	Very low	132 Å²	132	144.9 Å²	144.9	68%	0.677	77%	0.769	S	S	*	*	S	Bend	trans	-123.2	-2.4	-178.8	-58.5	178.8	0	0	0	112.1
18	Q	32.7	Very low	33.8	Very low	171 Å²	171	149.1 Å²	149.1	80%	0.799	78%	0.776	S	S	*	*	S	Bend	trans	-104.5	19.8	-177.3	-138	172.5	9.1	0	0	114.2
19	A	34.3	Very low	33.3	Very low	105 Å²	105	144.7 Å²	144.7	87%	0.868	77%	0.773	S	S	*	*	S	Bend	trans	-105.8	4.8	173.9	0	0	0	0	0	113
20	S	35	Very low	33	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	78%	0.779	S	S	*	*	S	Bend	trans	-137.7	46.3	-169.7	64.3	0	0	0	0	112.8
21	S	32	Very low	32.8	Very low	90 Å²	90	141.1 Å²	141.1	63%	0.629	78%	0.779	S	S	*	*			trans	179.2	107.6	162.9	49.4	0	0	0	0	109
22	E	27.8	Very low	32.5	Very low	173 Å²	173	141 Å²	141	81%	0.808	78%	0.783	S	S	*	*			trans	152.6	90	155.1	-84.8	164.5	-160.4	0	0	107.1
23	E	27.1	Very low	32.4	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.752	78%	0.78	S	S	*	*				91.1	102.5	104.2	-80.8	-179.8	176.8	0	0	110.3
24	E	28.8	Very low	32.6	Very low	193 Å²	193	134.3 Å²	134.3	90%	0.902	77%	0.767	S	S	*	*				37.9	81.2	72.5	-95.4	-173.5	174.3	0	0	112.5
25	T	25.1	Very low	32.8	Very low	116 Å²	116	137.1 Å²	137.1	71%	0.712	77%	0.773	S	S	*	*			trans	-143.6	100.5	144.5	-46.1	0	0	0	0	110.3
26	Q	29.1	Very low	33.4	Very low	177 Å²	177	140.5 Å²	140.5	83%	0.827	78%	0.779	S	S	*	*			trans	27.3	108.4	149.3	-77.3	165.3	-23.1	0	0	118.8
27	R	28.4	Very low	34.4	Very low	246 Å²	246	139.8 Å²	139.8	93%	0.928	78%	0.776	S	S	*	*			trans	-130.6	116.4	135.1	-74.6	-170.4	179.4	-177	0.2	109.6
28	Q	36.2	Very low	36.4	Very low	203 Å²	203	135.5 Å²	135.5	95%	0.949	76%	0.758	S	S	*	*			trans	-56.7	133.2	170.4	-73.3	170.5	-21.2	0	0	110.2
29	G	27	Very low	39.2	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	74%	0.741	S	S	*	*			trans	160.1	73.5	179.8	0	0	0	0	0	108.6	T31	G29-T31 PolarHBondContact O-N 2.92Å
30	G	28.4	Very low	42.1	Very low	85 Å²	85	127.6 Å²	127.6	88%	0.876	70%	0.702	S	S	*	*			trans	-67.6	90.6	-177	0	0	0	0	0	111.6
31	T	32.1	Very low	45.1	Very low	120 Å²	120	123.8 Å²	123.8	74%	0.736	67%	0.674	S	S	*	*			trans	-90	103.4	158.6	-51.4	0	0	0	0	106.8	G29 L33	G29-T31 PolarHBondContact O-N 2.92Å; T31-L33 PolarHBondContact O-N 3.37Å
32	V	37.6	Very low	48.3	Very low	134 Å²	134	119.5 Å²	119.5	81%	0.812	64%	0.644	S	S	*	*			trans	-63.1	104.2	167.2	177.5	0	0	0	0	106.5	C34	V32-C34 PolarHBondContact O-N 3.41Å; V32-C34 VanDerWaalsContact O-N 3.11Å
33	L	37.3	Very low	51.7	Low	155 Å²	155	113.9 Å²	113.9	81%	0.812	62%	0.616	S	S	*	*			trans	-62.9	111.2	166.8	-74.3	165.7	0	0	0	106.7	T31 N35	T31-L33 PolarHBondContact O-N 3.37Å; L33-N35 PolarHBondContact O-N 3.3Å
34	C	40.8	Very low	55	Low	86 Å²	86	106.4 Å²	106.4	58%	0.581	58%	0.581	S	S	*	*			trans	-59.1	109.7	171.9	28.6	0	0	0	0	108.4	V32 N36	V32-C34 PolarHBondContact O-N 3.41Å; V32-C34 VanDerWaalsContact O-N 3.11Å; C34-N36 PolarHBondContact O-N 3.03Å; C34-N36 VanDerWaalsContact O-N 3.13Å
35	N	40.5	Very low	58.3	Low	121 Å²	121	99.4 Å²	99.4	65%	0.647	55%	0.547	S	S	*	.			trans	-65.4	113.3	172.7	-141.5	15	0	0	0	106.8	L33 D37 S38	L33-N35 PolarHBondContact O-N 3.3Å; N35-D37 PolarHBondContact O-N 2.94Å; N35-S38 PolarHBondContact O-N 2.85Å
36	N	50.5	Low	61.6	Low	162 Å²	162	95.3 Å²	95.3	87%	0.866	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	1.4	-178	-115.3	-7	0	0	0	113.5	C34	C34-N36 PolarHBondContact O-N 3.03Å; C34-N36 VanDerWaalsContact O-N 3.13Å
37	D	57.2	Low	64.6	Low	143 Å²	143	87.3 Å²	87.3	77%	0.765	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	0.1	-175.4	-69.9	-25.1	0	0	0	113.9	N35 K39	N35-D37 PolarHBondContact O-N 2.94Å; D37-K39 PolarHBondContact O-N 3.01Å
38	S	75.9	Confident	67.8	Low	43 Å²	43	76.4 Å²	76.4	30%	0.301	45%	0.446	S	S	.	.			trans	-73.9	125.6	-179.4	71.3	0	0	0	0	111.5	N35 H96 D97	N35-S38 PolarHBondContact O-N 2.85Å; S38-H96 VanDerWaalsContact CB-NE2 3.26Å; S38-H96 WeakPolarHBondContact CB-NE2 3.45Å; S38-H96 PolarHBondContact OG-NE2 3.22Å; S38-D97 WeakPolarHBondContact CA-OD1 3.26Å; S38-D97 VanDerWaalsContact CB-OD2 3.28Å; S38-D97 WeakPolarHBondContact CB-OD2 3.5Å
39	K	91.2	Very high	70.7	Confident	101 Å²	101	67.9 Å²	67.9	44%	0.439	41%	0.405	S	S	.	.			trans	-93.3	113.7	-169	-177.7	175.2	170.9	148.8	0	110.3	D37 T41 E66 D97	D37-K39 PolarHBondContact O-N 3.01Å; K39-T41 WeakPolarHBondContact CE-OG1 3.42Å; K39-E66 WeakPolarHBondContact CE-OE1 3.43Å; K39-E66 WeakPolarHBondContact CE-OE2 3.39Å; K39-E66 IonicContact NZ-OE1 3.94Å; K39-E66 PolarHBondContact NZ-OE1 2.69Å; K39-E66 IonicContact NZ-OE2 3.15Å; K39-E66 PolarHBondContact NZ-OE2 3.09Å; K39-D97 PolarHBondContact N-OD1 2.97Å; K39-D97 PolarHBondContact O-N 3.47Å
40	L	96.4	Very high	74.1	Confident	9 Å²	9	67.6 Å²	67.6	5%	0.047	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	112.8	175.6	-168.6	66.3	0	0	0	110.7	L63 C65 E66 L94 H96 L111 F115	L40-L63 HydrophobicContact CD2-CB 4.43Å; L40-L63 HydrophobicContact CD2-CD1 4.33Å; L40-C65 HydrophobicContact CD2-CB 4.08Å; L40-C65 HydrophobicContact CG-CB 4.3Å; L40-C65 CarbonylContact O-C 3.47Å; L40-C65 WeakPolarHBondContact O-CA 3.2Å; L40-C65 PolarHBondContact O-SG 2.94Å; L40-C65 VanDerWaalsContact O-SG 3.39Å; L40-E66 PolarHBondContact O-N 3.32Å; L40-L94 HydrophobicContact CD1-CD1 3.72Å; L40-L94 HydrophobicContact CD1-CD2 3.92Å; L40-L94 HydrophobicContact CD1-CG 3.94Å; L40-L94 HydrophobicContact CG-CD1 4.16Å; L40-H96 HydrophobicContact CD1-CB 3.9Å; L40-L111 HydrophobicContact CD2-CD2 4.15Å; L40-F115 HydrophobicContact CD1-CE2 4.35Å; L40-F115 HydrophobicContact CD1-CZ 3.97Å; L40-F115 HydrophobicContact CD2-CE1 4.33Å; L40-F115 HydrophobicContact CD2-CZ 4.02Å; L40-F115 HydrophobicContact CG-CZ 4.49Å
41	T	98	Very high	77.4	Confident	16 Å²	16	63.5 Å²	63.5	10%	0.098	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.3	-179.9	-48.6	0	0	0	0	110.7	K39 Y43 E66 V95	K39-T41 WeakPolarHBondContact CE-OG1 3.42Å; T41-Y43 HydrophobicContact CG2-CD2 4.42Å; T41-Y43 HydrophobicContact CG2-CE2 3.91Å; T41-E66 CarbonylContact C-O 3.23Å; T41-E66 VanDerWaalsContact CA-O 3.26Å; T41-E66 WeakPolarHBondContact CA-O 3.34Å; T41-E66 HydrophobicContact CG2-CB 4.35Å; T41-V95 PolarHBondContact N-O 3.48Å; T41-V95 PolarHBondContact O-N 2.88Å
42	L	98.6	Very high	80.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.6	175.4	-175.8	75.9	0	0	0	110.6	H44 V54 R55 I58 C65 E66 Y68 P92 L94	L42-H44 HydrophobicContact CD2-CB 3.92Å; L42-H44 HydrophobicContact CG-CB 4.05Å; L42-V54 HydrophobicContact CD1-CG1 3.58Å; L42-V54 HydrophobicContact CD2-CG1 4.11Å; L42-R55 HydrophobicContact CD2-CG 3.46Å; L42-R55 VanDerWaalsContact CD2-CG 3.46Å; L42-I58 HydrophobicContact CB-CD1 4.48Å; L42-I58 HydrophobicContact CD1-CD1 4.41Å; L42-I58 HydrophobicContact CD2-CD1 4.02Å; L42-C65 VanDerWaalsContact CB-SG 3.58Å; L42-E66 PolarHBondContact N-O 3.34Å; L42-Y68 PolarHBondContact O-N 3.36Å; L42-P92 HydrophobicContact CD1-CB 3.89Å; L42-L94 HydrophobicContact CB-CD1 4.46Å; L42-L94 HydrophobicContact CD1-CB 4.47Å; L42-L94 HydrophobicContact CD1-CD1 3.99Å
43	Y	98.6	Very high	83.5	Confident	55 Å²	55	51.6 Å²	51.6	22%	0.216	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.5	166.3	-60.3	-96.8	0	0	0	108.7	T41 Y68 V70 W81 F82 L85 P92 V93 V95	T41-Y43 HydrophobicContact CG2-CD2 4.42Å; T41-Y43 HydrophobicContact CG2-CE2 3.91Å; Y43-Y68 WeakPolarHBondContact CA-O 3.44Å; Y43-Y68 AromaticContact CD1-CD1 3.56Å; Y43-Y68 HydrophobicContact CD1-CD1 3.56Å; Y43-Y68 HydrophobicContact CD1-CE1 4.4Å; Y43-Y68 AromaticContact CD1-CG 3.91Å; Y43-Y68 HydrophobicContact CD1-CG 3.91Å; Y43-Y68 AromaticContact CE1-CD1 3.9Å; Y43-Y68 HydrophobicContact CE1-CD1 3.9Å; Y43-Y68 AromaticContact CE1-CG 3.98Å; Y43-Y68 HydrophobicContact CE1-CG 3.98Å; Y43-V70 HydrophobicContact CD1-CG2 4.21Å; Y43-W81 HydrophobicContact CD1-CH2 4.16Å; Y43-W81 AromaticContact CD1-CZ3 3.86Å; Y43-W81 HydrophobicContact CD1-CZ3 3.86Å; Y43-W81 HydrophobicContact CE1-CH2 4.34Å; Y43-W81 AromaticContact CE1-CZ3 3.74Å; Y43-W81 HydrophobicContact CE1-CZ3 3.74Å; Y43-F82 HydrophobicContact CG-CE2 4.43Å; Y43-L85 HydrophobicContact CD1-CD2 4.34Å; Y43-L85 HydrophobicContact CD2-CD2 3.51Å; Y43-L85 HydrophobicContact CE1-CD2 4.48Å; Y43-L85 HydrophobicContact CE2-CD2 3.68Å; Y43-L85 HydrophobicContact CG-CD2 3.87Å; Y43-P92 CarbonylContact O-C 3.56Å; Y43-P92 WeakPolarHBondContact O-CA 3.32Å; Y43-V93 PolarHBondContact N-O 3.41Å; Y43-V93 PolarHBondContact O-N 2.92Å; Y43-V95 HydrophobicContact CD2-CG2 4.09Å; Y43-V95 HydrophobicContact CE2-CB 4.4Å; Y43-V95 HydrophobicContact CE2-CG2 3.69Å
44	H	98.2	Very high	86.4	Confident	5 Å²	5	44.2 Å²	44.2	2%	0.023	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	171.8	-171.8	74.5	84.1	0	0	0	111.8	L42 R55 E67 Y68 D69 V70 P92	L42-H44 HydrophobicContact CD2-CB 3.92Å; L42-H44 HydrophobicContact CG-CB 4.05Å; H44-R55 PolarHBondContact CE1-NE 3.43Å; H44-R55 WeakPolarHBondContact ND1-CD 3.48Å; H44-E67 IonicContact CD2-OE2 2.86Å; H44-E67 IonicContact CE1-OE2 3.09Å; H44-E67 WeakPolarHBondContact NE2-CB 3.18Å; H44-E67 IonicContact NE2-OE2 2.7Å; H44-E67 PolarHBondContact NE2-OE2 2.9Å; H44-E67 VanDerWaalsContact NE2-OE2 3.13Å; H44-Y68 PolarHBondContact N-O 3.47Å; H44-D69 IonicContact CE1-OD2 3.6Å; H44-D69 IonicContact ND1-OD2 3.8Å; H44-D69 CarbonylContact O-C 3.58Å; H44-D69 VanDerWaalsContact O-CA 3.29Å; H44-D69 WeakPolarHBondContact O-CA 3.45Å; H44-V70 PolarHBondContact O-N 2.87Å; H44-P92 HydrophobicContact CB-CB 4.49Å
45	W	96.6	Very high	89.1	Confident	46 Å²	46	41.4 Å²	41.4	17%	0.174	21%	0.212	C	C	.	.			trans	-126.2	130.4	162.6	-178.7	48.9	0	0	0	109.5	Q47 S48 S51 V70 L72 P73 V91	W45-Q47 HydrophobicContact CD2-CB 3.82Å; W45-Q47 HydrophobicContact CE3-CB 3.72Å; W45-Q47 HydrophobicContact CH2-CB 3.45Å; W45-Q47 VanDerWaalsContact CH2-CB 3.45Å; W45-Q47 HydrophobicContact CH2-CG 4.32Å; W45-Q47 HydrophobicContact CZ2-CB 3.5Å; W45-Q47 HydrophobicContact CZ2-CG 4.04Å; W45-Q47 HydrophobicContact CZ3-CB 3.55Å; W45-Q47 PolarHBondContact O-N 2.94Å; W45-S48 PolarHBondContact O-N 3.04Å; W45-S51 PolarHBondContact N-OG 3.02Å; W45-S51 VanDerWaalsContact N-OG 3.13Å; W45-S51 WeakPolarHBondContact O-CB 3.37Å; W45-V70 WeakPolarHBondContact CB-O 3.47Å; W45-L72 HydrophobicContact CB-CD1 3.75Å; W45-L72 HydrophobicContact CD2-CB 3.94Å; W45-L72 HydrophobicContact CD2-CD1 4.1Å; W45-L72 HydrophobicContact CD2-CD2 4.32Å; W45-L72 HydrophobicContact CD2-CG 4.33Å; W45-L72 HydrophobicContact CE3-CB 3.96Å; W45-L72 HydrophobicContact CE3-CD1 4.19Å; W45-L72 HydrophobicContact CE3-CD2 3.64Å; W45-L72 HydrophobicContact CE3-CG 4.13Å; W45-L72 HydrophobicContact CG-CB 4.47Å; W45-L72 HydrophobicContact CG-CD1 3.95Å; W45-L72 HydrophobicContact CH2-CB 4.33Å; W45-L72 HydrophobicContact CZ2-CB 4.33Å; W45-L72 HydrophobicContact CZ3-CB 4.15Å; W45-L72 HydrophobicContact CZ3-CD2 3.92Å; W45-P73 HydrophobicContact CH2-CG 4.49Å; W45-P73 HydrophobicContact CZ2-CG 3.7Å; W45-V91 HydrophobicContact CB-CG2 3.9Å
46	T	94.5	Very high	91.9	Very high	29 Å²	29	35.6 Å²	35.6	18%	0.178	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-32.1	-175.1	-61.3	0	0	0	0	113.4	Q52 D69 V310	T46-Q52 PolarHBondContact O-NE2 2.84Å; T46-D69 PolarHBondContact N-OD2 2.82Å; T46-D69 PolarHBondContact OG1-OD2 3.16Å; T46-V310 HydrophobicContact CG2-CG2 4.16Å
47	Q	92.9	Very high	94.2	Very high	9 Å²	9	28 Å²	28	4%	0.042	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-2.5	179.3	-71	-62.2	-26.3	0	0	115	W45 R271 V310 I313 S316 A317	W45-Q47 HydrophobicContact CD2-CB 3.82Å; W45-Q47 HydrophobicContact CE3-CB 3.72Å; W45-Q47 HydrophobicContact CH2-CB 3.45Å; W45-Q47 VanDerWaalsContact CH2-CB 3.45Å; W45-Q47 HydrophobicContact CH2-CG 4.32Å; W45-Q47 HydrophobicContact CZ2-CB 3.5Å; W45-Q47 HydrophobicContact CZ2-CG 4.04Å; W45-Q47 HydrophobicContact CZ3-CB 3.55Å; W45-Q47 PolarHBondContact O-N 2.94Å; Q47-R271 PolarHBondContact O-NH1 3.03Å; Q47-R271 PolarHBondContact O-NH2 3.09Å; Q47-V310 PolarHBondContact NE2-O 3.21Å; Q47-I313 HydrophobicContact CG-CD1 4.46Å; Q47-S316 PolarHBondContact NE2-OG 3.02Å; Q47-A317 HydrophobicContact CG-CB 4.06Å
48	S	96	Very high	96.1	Very high	18 Å²	18	21.4 Å²	21.4	13%	0.126	11%	0.105	C	C	.	.			trans	-76.3	130.1	174.9	163.8	0	0	0	0	110.4	W45 N50 S51 Q52 V91	W45-S48 PolarHBondContact O-N 3.04Å; S48-N50 PolarHBondContact O-N 2.92Å; S48-S51 WeakPolarHBondContact CB-OG 3.23Å; S48-S51 WeakPolarHBondContact O-CB 3.48Å; S48-S51 PolarHBondContact O-N 3.4Å; S48-S51 PolarHBondContact OG-N 2.92Å; S48-S51 PolarHBondContact OG-OG 2.73Å; S48-Q52 WeakPolarHBondContact O-CG 3.24Å; S48-Q52 PolarHBondContact O-N 3.46Å; S48-V91 PolarHBondContact OG-O 3.48Å
49	F	97.3	Very high	97.2	Very high	23 Å²	23	19.9 Å²	19.9	10%	0.101	10%	0.095	C	C	.	.	H	α-helix	trans	-57.2	-48.6	177.5	172.4	-99.2	0	0	0	112.1	S51 Q52 K53 M147 V267 R271	F49-S51 VanDerWaalsContact C-N 3.32Å; F49-S51 PolarHBondContact O-N 3.41Å; F49-Q52 WeakPolarHBondContact O-CB 3.4Å; F49-Q52 PolarHBondContact O-N 3.25Å; F49-Q52 VanDerWaalsContact O-N 3.15Å; F49-K53 HydrophobicContact CD1-CD 4.37Å; F49-K53 HydrophobicContact CE1-CD 3.62Å; F49-K53 HydrophobicContact CE1-CG 4.37Å; F49-K53 HydrophobicContact CZ-CD 3.79Å; F49-K53 HydrophobicContact CZ-CG 4.28Å; F49-K53 PolarHBondContact O-N 2.95Å; F49-K53 VanDerWaalsContact O-N 3.12Å; F49-M147 HydrophobicContact CD1-CB 3.76Å; F49-M147 HydrophobicContact CD1-CG 3.9Å; F49-M147 HydrophobicContact CD2-CB 4.35Å; F49-M147 HydrophobicContact CD2-CG 4.02Å; F49-M147 HydrophobicContact CE1-CB 3.98Å; F49-M147 HydrophobicContact CE1-CG 3.65Å; F49-M147 HydrophobicContact CE2-CG 3.77Å; F49-M147 HydrophobicContact CE2-SD 4.26Å; F49-M147 HydrophobicContact CG-CB 3.97Å; F49-M147 HydrophobicContact CG-CG 4.09Å; F49-M147 HydrophobicContact CZ-CB 4.38Å; F49-M147 HydrophobicContact CZ-CG 3.59Å; F49-V267 HydrophobicContact CD2-CG1 3.67Å; F49-V267 HydrophobicContact CE2-CB 4.16Å; F49-V267 HydrophobicContact CE2-CG1 3.59Å; F49-V267 HydrophobicContact CZ-CG1 4.42Å; F49-R271 HydrophobicContact CD2-CB 3.98Å; F49-R271 HydrophobicContact CD2-CG 4.1Å; F49-R271 HydrophobicContact CE2-CB 4.33Å
50	N	97.9	Very high	97.4	Very high	59 Å²	59	16.3 Å²	16.3	32%	0.316	8%	0.08	S	C	.	.	H	α-helix	trans	-67.2	-34.7	179.3	-72.8	-32.3	0	0	0	112.1	S48 Q52 K53 V54 P104	S48-N50 PolarHBondContact O-N 2.92Å; N50-Q52 VanDerWaalsContact C-N 3.34Å; N50-K53 PolarHBondContact O-N 3.22Å; N50-V54 PolarHBondContact O-N 3.31Å; N50-P104 HydrophobicContact CB-CB 3.94Å; N50-P104 HydrophobicContact CB-CG 4.01Å
51	S	98.3	Very high	97.4	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.2	-41.5	172.5	-70.3	0	0	0	0	111.6	W45 S48 F49 K53 V54 R55	W45-S51 PolarHBondContact N-OG 3.02Å; W45-S51 VanDerWaalsContact N-OG 3.13Å; W45-S51 WeakPolarHBondContact O-CB 3.37Å; S48-S51 WeakPolarHBondContact CB-OG 3.23Å; S48-S51 WeakPolarHBondContact O-CB 3.48Å; S48-S51 PolarHBondContact O-N 3.4Å; S48-S51 PolarHBondContact OG-N 2.92Å; S48-S51 PolarHBondContact OG-OG 2.73Å; F49-S51 VanDerWaalsContact C-N 3.32Å; F49-S51 PolarHBondContact O-N 3.41Å; S51-K53 VanDerWaalsContact C-N 3.35Å; S51-K53 PolarHBondContact O-N 3.36Å; S51-V54 PolarHBondContact O-N 3.4Å; S51-R55 WeakPolarHBondContact O-CB 3.37Å; S51-R55 WeakPolarHBondContact O-CD 3.47Å; S51-R55 WeakPolarHBondContact O-CG 3.39Å; S51-R55 PolarHBondContact O-N 2.89Å
52	Q	98.2	Very high	97.3	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-42.3	177.9	-73.1	166.8	4.2	0	0	112	T46 S48 F49 N50 L56 V267 L307	T46-Q52 PolarHBondContact O-NE2 2.84Å; S48-Q52 WeakPolarHBondContact O-CG 3.24Å; S48-Q52 PolarHBondContact O-N 3.46Å; F49-Q52 WeakPolarHBondContact O-CB 3.4Å; F49-Q52 PolarHBondContact O-N 3.25Å; F49-Q52 VanDerWaalsContact O-N 3.15Å; N50-Q52 VanDerWaalsContact C-N 3.34Å; Q52-L56 VanDerWaalsContact O-CB 3.31Å; Q52-L56 WeakPolarHBondContact O-CB 3.49Å; Q52-L56 PolarHBondContact O-N 2.96Å; Q52-V267 HydrophobicContact CB-CG1 3.58Å; Q52-V267 HydrophobicContact CB-CG2 4.48Å; Q52-L307 HydrophobicContact CB-CD2 3.54Å; Q52-L307 HydrophobicContact CG-CD2 3.44Å; Q52-L307 VanDerWaalsContact CG-CD2 3.44Å
53	K	97.9	Very high	97.1	Very high	3 Å²	3	18.9 Å²	18.9	1%	0.013	11%	0.107	C	C	.	.	H	α-helix	trans	-58	-55.4	174.5	-73.6	-179.6	57	-178.4	0	112.1	F49 N50 S51 R55 L56 A57 M108 D143 V263 S264 V267	F49-K53 HydrophobicContact CD1-CD 4.37Å; F49-K53 HydrophobicContact CE1-CD 3.62Å; F49-K53 HydrophobicContact CE1-CG 4.37Å; F49-K53 HydrophobicContact CZ-CD 3.79Å; F49-K53 HydrophobicContact CZ-CG 4.28Å; F49-K53 PolarHBondContact O-N 2.95Å; F49-K53 VanDerWaalsContact O-N 3.12Å; N50-K53 PolarHBondContact O-N 3.22Å; S51-K53 VanDerWaalsContact C-N 3.35Å; S51-K53 PolarHBondContact O-N 3.36Å; K53-R55 PolarHBondContact O-N 3.35Å; K53-L56 PolarHBondContact O-N 3.44Å; K53-A57 PolarHBondContact O-N 3Å; K53-M108 HydrophobicContact CB-SD 4.4Å; K53-D143 IonicContact NZ-OD1 3.54Å; K53-D143 PolarHBondContact NZ-OD1 2.87Å; K53-D143 IonicContact NZ-OD2 3.8Å; K53-D143 PolarHBondContact NZ-OD2 3.39Å; K53-V263 WeakPolarHBondContact O-CG1 3.4Å; K53-S264 WeakPolarHBondContact CE-OG 3.42Å; K53-S264 PolarHBondContact NZ-OG 2.93Å; K53-V267 HydrophobicContact CB-CG2 4.46Å; K53-V267 HydrophobicContact CG-CB 3.86Å; K53-V267 HydrophobicContact CG-CG1 3.96Å; K53-V267 HydrophobicContact CG-CG2 3.94Å
54	V	98.6	Very high	96.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-43.4	-177.7	171.1	0	0	0	0	111.4	L42 N50 S51 L56 A57 I58 P92 P104 I107 M108	L42-V54 HydrophobicContact CD1-CG1 3.58Å; L42-V54 HydrophobicContact CD2-CG1 4.11Å; N50-V54 PolarHBondContact O-N 3.31Å; S51-V54 PolarHBondContact O-N 3.4Å; V54-L56 VanDerWaalsContact C-N 3.32Å; V54-L56 PolarHBondContact O-N 2.96Å; V54-A57 PolarHBondContact O-N 3.41Å; V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.4Å; V54-I58 WeakPolarHBondContact O-CG1 3.42Å; V54-I58 PolarHBondContact O-N 3.39Å; V54-P92 HydrophobicContact CB-CG 4.08Å; V54-P92 HydrophobicContact CG2-CG 3.66Å; V54-P104 HydrophobicContact CG2-CB 4.22Å; V54-I107 HydrophobicContact CB-CG2 4.32Å; V54-I107 HydrophobicContact CG1-CG2 3.5Å; V54-I107 VanDerWaalsContact CG1-CG2 3.5Å; V54-I107 HydrophobicContact CG2-CB 4.19Å; V54-I107 HydrophobicContact CG2-CD1 4.49Å; V54-I107 HydrophobicContact CG2-CG2 3.8Å; V54-M108 HydrophobicContact CG2-CG 4.26Å
55	R	98.6	Very high	96.7	Very high	27 Å²	27	28.9 Å²	28.9	10%	0.102	15%	0.148	C	C	.	.	H	α-helix	trans	-62.2	-40.4	177.2	-68.6	170.7	81.7	-135.8	-2.4	111.7	L42 H44 S51 K53 A59 E67 V306	L42-R55 HydrophobicContact CD2-CG 3.46Å; L42-R55 VanDerWaalsContact CD2-CG 3.46Å; H44-R55 PolarHBondContact CE1-NE 3.43Å; H44-R55 WeakPolarHBondContact ND1-CD 3.48Å; S51-R55 WeakPolarHBondContact O-CB 3.37Å; S51-R55 WeakPolarHBondContact O-CD 3.47Å; S51-R55 WeakPolarHBondContact O-CG 3.39Å; S51-R55 PolarHBondContact O-N 2.89Å; K53-R55 PolarHBondContact O-N 3.35Å; R55-A59 WeakPolarHBondContact O-CB 3.45Å; R55-A59 PolarHBondContact O-N 2.98Å; R55-E67 IonicContact CZ-OE2 3.23Å; R55-E67 IonicContact NE-OE2 3.22Å; R55-E67 PolarHBondContact NE-OE2 2.96Å; R55-E67 IonicContact NH2-OE2 3.8Å; R55-E67 PolarHBondContact NH2-OE2 2.95Å; R55-V306 HydrophobicContact CB-CG1 3.44Å; R55-V306 VanDerWaalsContact CB-CG1 3.44Å; R55-V306 PolarHBondContact NH1-O 3.32Å
56	L	98.6	Very high	96.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-43.1	176.2	-176.5	59.6	0	0	0	111	Q52 K53 V54 A59 E60 V263 A266 V267 A302 F303 L307	Q52-L56 VanDerWaalsContact O-CB 3.31Å; Q52-L56 WeakPolarHBondContact O-CB 3.49Å; Q52-L56 PolarHBondContact O-N 2.96Å; K53-L56 PolarHBondContact O-N 3.44Å; V54-L56 VanDerWaalsContact C-N 3.32Å; V54-L56 PolarHBondContact O-N 2.96Å; L56-A59 PolarHBondContact O-N 2.89Å; L56-E60 HydrophobicContact CD1-CG 4.03Å; L56-E60 HydrophobicContact CG-CG 4.26Å; L56-E60 WeakPolarHBondContact O-CB 3.35Å; L56-E60 VanDerWaalsContact O-CG 3.29Å; L56-E60 WeakPolarHBondContact O-CG 3.39Å; L56-E60 PolarHBondContact O-N 3.04Å; L56-V263 HydrophobicContact CB-CG1 4.22Å; L56-V263 HydrophobicContact CD2-CG1 4.23Å; L56-V263 HydrophobicContact CG-CG1 4.31Å; L56-V263 HydrophobicContact CG-CG2 4.38Å; L56-A266 HydrophobicContact CD2-CB 3.94Å; L56-V267 HydrophobicContact CB-CG2 4.41Å; L56-V267 HydrophobicContact CD2-CG2 3.83Å; L56-A302 HydrophobicContact CD1-CB 4.31Å; L56-F303 HydrophobicContact CD1-CB 4.29Å; L56-F303 HydrophobicContact CD2-CD2 4.19Å; L56-L307 HydrophobicContact CD2-CD1 4.11Å
57	A	98.2	Very high	96.8	Very high	2 Å²	2	34.5 Å²	34.5	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-50.2	175.5	0	0	0	0	0	112.2	K53 V54 A59 E60 K61 M108 L123 V263	K53-A57 PolarHBondContact O-N 3Å; V54-A57 PolarHBondContact O-N 3.41Å; A57-A59 VanDerWaalsContact C-N 3.25Å; A57-A59 PolarHBondContact O-N 3.31Å; A57-E60 PolarHBondContact O-N 3.41Å; A57-K61 WeakPolarHBondContact O-CB 3.5Å; A57-K61 VanDerWaalsContact O-CG 3.32Å; A57-K61 WeakPolarHBondContact O-CG 3.38Å; A57-K61 PolarHBondContact O-N 2.93Å; A57-M108 HydrophobicContact CB-CG 4.39Å; A57-L123 HydrophobicContact CB-CD1 3.92Å; A57-V263 HydrophobicContact CB-CG1 4.38Å
58	I	98	Very high	97	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-55.1	-43.9	175.2	-71.1	170.9	0	0	0	110.8	L42 V54 G62 L63 C65 L94 L111	L42-I58 HydrophobicContact CB-CD1 4.48Å; L42-I58 HydrophobicContact CD1-CD1 4.41Å; L42-I58 HydrophobicContact CD2-CD1 4.02Å; V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.4Å; V54-I58 WeakPolarHBondContact O-CG1 3.42Å; V54-I58 PolarHBondContact O-N 3.39Å; I58-G62 PolarHBondContact O-N 2.91Å; I58-G62 VanDerWaalsContact O-N 3.14Å; I58-L63 HydrophobicContact CG2-CB 4.1Å; I58-L63 PolarHBondContact O-N 3.47Å; I58-L63 VanDerWaalsContact O-N 3.08Å; I58-C65 HydrophobicContact CD1-CB 4.35Å; I58-C65 HydrophobicContact CG2-CB 3.69Å; I58-L94 HydrophobicContact CD1-CD1 4.37Å; I58-L111 HydrophobicContact CD1-CD1 4.22Å; I58-L111 HydrophobicContact CG1-CD1 3.52Å; I58-L111 HydrophobicContact CG1-CD2 4.42Å
59	A	97.8	Very high	97	Very high	11 Å²	11	40 Å²	40	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-69.1	-38.5	-178.1	0	0	0	0	0	113.8	R55 L56 A57 G62 A302 R305 V306	R55-A59 WeakPolarHBondContact O-CB 3.45Å; R55-A59 PolarHBondContact O-N 2.98Å; L56-A59 PolarHBondContact O-N 2.89Å; A57-A59 VanDerWaalsContact C-N 3.25Å; A57-A59 PolarHBondContact O-N 3.31Å; A59-G62 PolarHBondContact O-N 3.09Å; A59-A302 HydrophobicContact CB-CB 3.9Å; A59-R305 VanDerWaalsContact CA-NH2 3.31Å; A59-R305 PolarHBondContact O-NH2 3.45Å; A59-V306 HydrophobicContact CB-CG2 3.45Å; A59-V306 VanDerWaalsContact CB-CG2 3.45Å
60	E	97.4	Very high	96.9	Very high	26 Å²	26	38.9 Å²	38.9	12%	0.121	19%	0.191	C	C	.	.	H	α-helix	trans	-71.8	-34.8	176.5	-70.5	-71.6	179.2	0	0	111.7	L56 A57 G62 L123 F258 R300 A302	L56-E60 HydrophobicContact CD1-CG 4.03Å; L56-E60 HydrophobicContact CG-CG 4.26Å; L56-E60 WeakPolarHBondContact O-CB 3.35Å; L56-E60 VanDerWaalsContact O-CG 3.29Å; L56-E60 WeakPolarHBondContact O-CG 3.39Å; L56-E60 PolarHBondContact O-N 3.04Å; A57-E60 PolarHBondContact O-N 3.41Å; E60-G62 PolarHBondContact O-N 3.29Å; E60-L123 HydrophobicContact CB-CD2 4.03Å; E60-F258 HydrophobicContact CG-CD1 4.19Å; E60-F258 HydrophobicContact CG-CE1 3.95Å; E60-R300 IonicContact OE1-CZ 3.94Å; E60-R300 IonicContact OE1-NE 3.73Å; E60-R300 PolarHBondContact OE1-NE 3.44Å; E60-R300 IonicContact OE1-NH2 3.55Å; E60-R300 PolarHBondContact OE1-NH2 2.71Å; E60-R300 IonicContact OE2-CZ 2.75Å; E60-R300 IonicContact OE2-NE 2.81Å; E60-R300 IonicContact OE2-NH2 3.16Å; E60-R300 PolarHBondContact OE2-NH2 3.42Å; E60-A302 VanDerWaalsContact CD-CB 3.47Å; E60-A302 HydrophobicContact CG-CB 3.86Å; E60-A302 WeakPolarHBondContact OE1-CB 3.34Å
61	K	95.8	Very high	96.7	Very high	3 Å²	3	36.1 Å²	36.1	1%	0.013	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.3	170.7	-65.5	-177.5	77.1	63.8	0	113.5	A57 L63 L111 E112 F115 T120 P121 L123	A57-K61 WeakPolarHBondContact O-CB 3.5Å; A57-K61 VanDerWaalsContact O-CG 3.32Å; A57-K61 WeakPolarHBondContact O-CG 3.38Å; A57-K61 PolarHBondContact O-N 2.93Å; K61-L63 HydrophobicContact CB-CD1 4.08Å; K61-L63 HydrophobicContact CB-CD2 4.29Å; K61-L63 HydrophobicContact CB-CG 3.7Å; K61-L63 HydrophobicContact CD-CD1 4.05Å; K61-L63 PolarHBondContact O-N 2.95Å; K61-L111 HydrophobicContact CD-CB 4.28Å; K61-L111 WeakPolarHBondContact CE-O 3.49Å; K61-E112 WeakPolarHBondContact CD-OE1 3.44Å; K61-E112 WeakPolarHBondContact CE-OE1 2.98Å; K61-E112 IonicContact NZ-OE1 2.82Å; K61-E112 PolarHBondContact NZ-OE1 2.88Å; K61-E112 IonicContact NZ-OE2 2.64Å; K61-F115 WeakPolarHBondContact CE-O 3.45Å; K61-F115 PolarHBondContact NZ-O 3.34Å; K61-F115 VanDerWaalsContact NZ-O 3.16Å; K61-T120 HydrophobicContact CB-CG2 4.21Å; K61-P121 PolarHBondContact NZ-O 3.42Å; K61-P121 WeakPolarHBondContact O-CD 3.48Å; K61-L123 HydrophobicContact CD-CD1 4.26Å; K61-L123 HydrophobicContact CG-CD1 3.83Å; K61-L123 HydrophobicContact CG-CG 3.99Å
62	G	94.8	Very high	96.4	Very high	59 Å²	59	38.2 Å²	38.2	61%	0.608	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	23.5	-178.9	0	0	0	0	0	114.2	I58 A59 E60	I58-G62 PolarHBondContact O-N 2.91Å; I58-G62 VanDerWaalsContact O-N 3.14Å; A59-G62 PolarHBondContact O-N 3.09Å; E60-G62 PolarHBondContact O-N 3.29Å
63	L	94.8	Very high	95.9	Very high	18 Å²	18	40.9 Å²	40.9	9%	0.094	20%	0.204	C	C	.	.			trans	-74.5	142.2	-177.4	-57	178.4	0	0	0	111.2	L40 I58 K61 C65 L111 F115 T120	L40-L63 HydrophobicContact CD2-CB 4.43Å; L40-L63 HydrophobicContact CD2-CD1 4.33Å; I58-L63 HydrophobicContact CG2-CB 4.1Å; I58-L63 PolarHBondContact O-N 3.47Å; I58-L63 VanDerWaalsContact O-N 3.08Å; K61-L63 HydrophobicContact CB-CD1 4.08Å; K61-L63 HydrophobicContact CB-CD2 4.29Å; K61-L63 HydrophobicContact CB-CG 3.7Å; K61-L63 HydrophobicContact CD-CD1 4.05Å; K61-L63 PolarHBondContact O-N 2.95Å; L63-C65 PolarHBondContact O-N 3.41Å; L63-L111 HydrophobicContact CD1-CD2 3.83Å; L63-F115 HydrophobicContact CD1-CB 4.04Å; L63-F115 HydrophobicContact CD1-CD1 4.2Å; L63-F115 HydrophobicContact CD1-CD2 4.28Å; L63-F115 HydrophobicContact CD1-CG 3.92Å; L63-F115 HydrophobicContact CD2-CB 3.79Å; L63-F115 HydrophobicContact CD2-CD1 3.81Å; L63-F115 HydrophobicContact CD2-CG 4.02Å; L63-T120 HydrophobicContact CD2-CG2 3.99Å
64	R	93.5	Very high	95.5	Very high	241 Å²	241	43.6 Å²	43.6	91%	0.909	22%	0.219	S	C	*	.			trans	-81.3	112.1	168.4	-66.1	-177	-179.1	-178.4	1.4	108.2
65	C	95.7	Very high	95.2	Very high	28 Å²	28	45.1 Å²	45.1	19%	0.189	23%	0.229	C	C	.	.			trans	-129.9	131.6	178.8	-175.1	0	0	0	0	109.5	L40 L42 I58 L63 E67	L40-C65 HydrophobicContact CD2-CB 4.08Å; L40-C65 HydrophobicContact CG-CB 4.3Å; L40-C65 CarbonylContact O-C 3.47Å; L40-C65 WeakPolarHBondContact O-CA 3.2Å; L40-C65 PolarHBondContact O-SG 2.94Å; L40-C65 VanDerWaalsContact O-SG 3.39Å; L42-C65 VanDerWaalsContact CB-SG 3.58Å; I58-C65 HydrophobicContact CD1-CB 4.35Å; I58-C65 HydrophobicContact CG2-CB 3.69Å; L63-C65 PolarHBondContact O-N 3.41Å; C65-E67 PolarHBondContact O-N 2.65Å
66	E	96.9	Very high	95.1	Very high	104 Å²	104	45 Å²	45	49%	0.486	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	118.9	168.8	-72.3	-171	-157	0	0	109.6	K39 L40 T41 L42	K39-E66 WeakPolarHBondContact CE-OE1 3.43Å; K39-E66 WeakPolarHBondContact CE-OE2 3.39Å; K39-E66 IonicContact NZ-OE1 3.94Å; K39-E66 PolarHBondContact NZ-OE1 2.69Å; K39-E66 IonicContact NZ-OE2 3.15Å; K39-E66 PolarHBondContact NZ-OE2 3.09Å; L40-E66 PolarHBondContact O-N 3.32Å; T41-E66 CarbonylContact C-O 3.23Å; T41-E66 VanDerWaalsContact CA-O 3.26Å; T41-E66 WeakPolarHBondContact CA-O 3.34Å; T41-E66 HydrophobicContact CG2-CB 4.35Å; L42-E66 PolarHBondContact N-O 3.34Å
67	E	96.2	Very high	95	Very high	89 Å²	89	46.3 Å²	46.3	42%	0.416	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.7	-179.5	-78.7	-177.6	-130.8	0	0	110.8	H44 R55 C65	H44-E67 IonicContact CD2-OE2 2.86Å; H44-E67 IonicContact CE1-OE2 3.09Å; H44-E67 WeakPolarHBondContact NE2-CB 3.18Å; H44-E67 IonicContact NE2-OE2 2.7Å; H44-E67 PolarHBondContact NE2-OE2 2.9Å; H44-E67 VanDerWaalsContact NE2-OE2 3.13Å; R55-E67 IonicContact CZ-OE2 3.23Å; R55-E67 IonicContact NE-OE2 3.22Å; R55-E67 PolarHBondContact NE-OE2 2.96Å; R55-E67 IonicContact NH2-OE2 3.8Å; R55-E67 PolarHBondContact NH2-OE2 2.95Å; C65-E67 PolarHBondContact O-N 2.65Å
68	Y	96.4	Very high	94.9	Very high	109 Å²	109	46.3 Å²	46.3	43%	0.427	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	107.3	172.5	-169.7	-87.3	0	0	0	110	L42 Y43 H44 V70 W81	L42-Y68 PolarHBondContact O-N 3.36Å; Y43-Y68 WeakPolarHBondContact CA-O 3.44Å; Y43-Y68 AromaticContact CD1-CD1 3.56Å; Y43-Y68 HydrophobicContact CD1-CD1 3.56Å; Y43-Y68 HydrophobicContact CD1-CE1 4.4Å; Y43-Y68 AromaticContact CD1-CG 3.91Å; Y43-Y68 HydrophobicContact CD1-CG 3.91Å; Y43-Y68 AromaticContact CE1-CD1 3.9Å; Y43-Y68 HydrophobicContact CE1-CD1 3.9Å; Y43-Y68 AromaticContact CE1-CG 3.98Å; Y43-Y68 HydrophobicContact CE1-CG 3.98Å; H44-Y68 PolarHBondContact N-O 3.47Å; Y68-V70 HydrophobicContact CD1-CG2 3.81Å; Y68-V70 HydrophobicContact CE1-CG2 4.17Å; Y68-V70 PolarHBondContact O-N 2.76Å; Y68-W81 HydrophobicContact CD1-CH2 4.14Å; Y68-W81 AromaticContact CE1-CH2 3.55Å; Y68-W81 HydrophobicContact CE1-CH2 3.55Å; Y68-W81 HydrophobicContact CE1-CZ2 4.02Å; Y68-W81 HydrophobicContact CE1-CZ3 4.41Å
69	D	95.4	Very high	94.8	Very high	34 Å²	34	49.2 Å²	49.2	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.7	179.5	-172.3	-94	0	0	0	110.1	H44 T46 R324	H44-D69 IonicContact CE1-OD2 3.6Å; H44-D69 IonicContact ND1-OD2 3.8Å; H44-D69 CarbonylContact O-C 3.58Å; H44-D69 VanDerWaalsContact O-CA 3.29Å; H44-D69 WeakPolarHBondContact O-CA 3.45Å; T46-D69 PolarHBondContact N-OD2 2.82Å; T46-D69 PolarHBondContact OG1-OD2 3.16Å; D69-R324 VanDerWaalsContact CB-NH2 3.32Å; D69-R324 VanDerWaalsContact O-CZ 3.28Å; D69-R324 PolarHBondContact O-NH1 2.71Å; D69-R324 PolarHBondContact O-NH2 2.64Å; D69-R324 IonicContact OD1-CZ 2.65Å; D69-R324 IonicContact OD1-NH2 2.71Å; D69-R324 PolarHBondContact OD1-NH2 3.23Å
70	V	96.6	Very high	94.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.			trans	-96.2	108.5	176.3	-176.7	0	0	0	0	108.5	Y43 H44 W45 Y68 L72 E76 H77 W81 F82 V91	Y43-V70 HydrophobicContact CD1-CG2 4.21Å; H44-V70 PolarHBondContact O-N 2.87Å; W45-V70 WeakPolarHBondContact CB-O 3.47Å; Y68-V70 HydrophobicContact CD1-CG2 3.81Å; Y68-V70 HydrophobicContact CE1-CG2 4.17Å; Y68-V70 PolarHBondContact O-N 2.76Å; V70-L72 WeakPolarHBondContact O-CD1 3.33Å; V70-L72 PolarHBondContact O-N 3.2Å; V70-L72 VanDerWaalsContact O-N 3.17Å; V70-E76 WeakPolarHBondContact CA-OE2 3.48Å; V70-E76 HydrophobicContact CG1-CB 3.82Å; V70-H77 HydrophobicContact CG1-CB 3.92Å; V70-W81 HydrophobicContact CG2-CH2 4.05Å; V70-F82 HydrophobicContact CG1-CD2 4.17Å; V70-F82 HydrophobicContact CG1-CE2 4.29Å; V70-F82 HydrophobicContact CG1-CG 4.47Å; V70-F82 HydrophobicContact CG2-CD2 3.99Å; V70-F82 HydrophobicContact CG2-CE2 3.83Å; V70-V91 HydrophobicContact CB-CG1 4.09Å; V70-V91 HydrophobicContact CG1-CG1 4.37Å; V70-V91 HydrophobicContact CG2-CG1 4.45Å
71	S	93.2	Very high	94.8	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	26%	0.263	C	S	.	.			trans	-74.4	107.2	-175.5	-178.2	0	0	0	0	111.7	L74 S75 E76	S71-L74 PolarHBondContact O-N 3.06Å; S71-L74 WeakPolarHBondContact OG-CB 3.46Å; S71-L74 WeakPolarHBondContact OG-CG 3.27Å; S71-L74 PolarHBondContact OG-N 3.41Å; S71-S75 PolarHBondContact O-N 2.9Å; S71-E76 PolarHBondContact N-OE2 3.47Å; S71-E76 PolarHBondContact O-N 3Å
72	L	91.4	Very high	94.9	Very high	44 Å²	44	52.5 Å²	52.5	23%	0.23	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-42.1	171.2	-90.3	65.8	0	0	0	113.1	W45 V70 L74 S75 H77 V91	W45-L72 HydrophobicContact CB-CD1 3.75Å; W45-L72 HydrophobicContact CD2-CB 3.94Å; W45-L72 HydrophobicContact CD2-CD1 4.1Å; W45-L72 HydrophobicContact CD2-CD2 4.32Å; W45-L72 HydrophobicContact CD2-CG 4.33Å; W45-L72 HydrophobicContact CE3-CB 3.96Å; W45-L72 HydrophobicContact CE3-CD1 4.19Å; W45-L72 HydrophobicContact CE3-CD2 3.64Å; W45-L72 HydrophobicContact CE3-CG 4.13Å; W45-L72 HydrophobicContact CG-CB 4.47Å; W45-L72 HydrophobicContact CG-CD1 3.95Å; W45-L72 HydrophobicContact CH2-CB 4.33Å; W45-L72 HydrophobicContact CZ2-CB 4.33Å; W45-L72 HydrophobicContact CZ3-CB 4.15Å; W45-L72 HydrophobicContact CZ3-CD2 3.92Å; V70-L72 WeakPolarHBondContact O-CD1 3.33Å; V70-L72 PolarHBondContact O-N 3.2Å; V70-L72 VanDerWaalsContact O-N 3.17Å; L72-L74 PolarHBondContact O-N 3.35Å; L72-S75 PolarHBondContact O-N 2.86Å; L72-H77 HydrophobicContact CD1-CB 4.15Å; L72-V91 HydrophobicContact CD1-CG1 4.44Å; L72-V91 HydrophobicContact CD1-CG2 3.85Å
73	P	88.5	Confident	95	Very high	56 Å²	56	49.7 Å²	49.7	36%	0.364	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.7	176.3	-26.9	36.1	0	0	0	114.1	W45 V321	W45-P73 HydrophobicContact CH2-CG 4.49Å; W45-P73 HydrophobicContact CZ2-CG 3.7Å; P73-V321 HydrophobicContact CB-CG2 4.01Å; P73-V321 HydrophobicContact CG-CG2 4.09Å
74	L	89.8	Confident	95.1	Very high	60 Å²	60	57 Å²	57	31%	0.314	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	9.2	175.1	-61.5	179.9	0	0	0	113.1	S71 L72 E76 V321 R324 V325	S71-L74 PolarHBondContact O-N 3.06Å; S71-L74 WeakPolarHBondContact OG-CB 3.46Å; S71-L74 WeakPolarHBondContact OG-CG 3.27Å; S71-L74 PolarHBondContact OG-N 3.41Å; L72-L74 PolarHBondContact O-N 3.35Å; L74-E76 HydrophobicContact CB-CG 4.29Å; L74-E76 PolarHBondContact O-N 3.31Å; L74-V321 HydrophobicContact CD1-CG1 4.43Å; L74-V321 HydrophobicContact CD2-CG1 3.92Å; L74-V321 HydrophobicContact CG-CG1 4.1Å; L74-R324 HydrophobicContact CD1-CB 3.71Å; L74-R324 HydrophobicContact CD1-CG 4.42Å; L74-V325 HydrophobicContact CD1-CG2 4.3Å; L74-V325 HydrophobicContact CD2-CG2 3.74Å
75	S	92.8	Very high	95.2	Very high	32 Å²	32	47.3 Å²	47.3	22%	0.224	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	24.1	179.4	-64.8	0	0	0	0	115	S71 L72 H77 N78	S71-S75 PolarHBondContact O-N 2.9Å; L72-S75 PolarHBondContact O-N 2.86Å; S75-H77 PolarHBondContact O-N 3.31Å; S75-N78 WeakPolarHBondContact O-CA 3.44Å; S75-N78 VanDerWaalsContact O-CB 3.31Å; S75-N78 WeakPolarHBondContact O-CB 3.49Å; S75-N78 PolarHBondContact O-N 3.05Å
76	E	95.1	Very high	95.3	Very high	24 Å²	24	46.5 Å²	46.5	11%	0.112	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-62.8	-33.1	-178.7	-68.8	177.4	-173.8	0	0	112.3	V70 S71 L74 N78 E79 R324	V70-E76 WeakPolarHBondContact CA-OE2 3.48Å; V70-E76 HydrophobicContact CG1-CB 3.82Å; S71-E76 PolarHBondContact N-OE2 3.47Å; S71-E76 PolarHBondContact O-N 3Å; L74-E76 HydrophobicContact CB-CG 4.29Å; L74-E76 PolarHBondContact O-N 3.31Å; E76-N78 PolarHBondContact O-N 2.84Å; E76-N78 VanDerWaalsContact O-N 3.1Å; E76-E79 WeakPolarHBondContact O-CB 3.38Å; E76-E79 PolarHBondContact O-N 3.24Å; E76-R324 IonicContact OE1-CZ 2.94Å; E76-R324 IonicContact OE1-NH1 3.88Å; E76-R324 PolarHBondContact OE1-NH1 3.41Å; E76-R324 IonicContact OE2-CZ 3Å; E76-R324 IonicContact OE2-NH1 2.71Å; E76-R324 PolarHBondContact OE2-NH1 3.34Å
77	H	96	Very high	95.3	Very high	28 Å²	28	45 Å²	45	13%	0.13	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-63.7	-7	171.2	69.3	-56.6	0	0	0	114.8	V70 L72 S75 F82 G89 K202	V70-H77 HydrophobicContact CG1-CB 3.92Å; L72-H77 HydrophobicContact CD1-CB 4.15Å; S75-H77 PolarHBondContact O-N 3.31Å; H77-F82 HydrophobicContact CB-CD1 4.07Å; H77-F82 HydrophobicContact CB-CE1 4.09Å; H77-F82 WeakPolarHBondContact O-CD1 3.25Å; H77-G89 PolarHBondContact CD2-O 3.37Å; H77-G89 VanDerWaalsContact CD2-O 3.25Å; H77-K202 PolarHBondContact CD2-NZ 3.13Å; H77-K202 PolarHBondContact O-NZ 3.43Å; H77-K202 VanDerWaalsContact O-NZ 3.13Å
78	N	96.5	Very high	95.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-102	-7.7	170.6	-61.3	-37.2	0	0	0	111.8	S75 E76 L185 L188 Y199 K202	S75-N78 WeakPolarHBondContact O-CA 3.44Å; S75-N78 VanDerWaalsContact O-CB 3.31Å; S75-N78 WeakPolarHBondContact O-CB 3.49Å; S75-N78 PolarHBondContact O-N 3.05Å; E76-N78 PolarHBondContact O-N 2.84Å; E76-N78 VanDerWaalsContact O-N 3.1Å; N78-L185 HydrophobicContact CB-CD2 4.18Å; N78-L188 HydrophobicContact CB-CD1 3.95Å; N78-L188 WeakPolarHBondContact O-CD1 3.13Å; N78-Y199 VanDerWaalsContact O-CE1 3.29Å; N78-Y199 WeakPolarHBondContact O-CE1 3.49Å; N78-Y199 PolarHBondContact O-OH 3.2Å; N78-K202 VanDerWaalsContact OD1-CE 3.27Å; N78-K202 WeakPolarHBondContact OD1-CE 3.39Å; N78-K202 PolarHBondContact OD1-NZ 2.91Å
79	E	96.5	Very high	95.3	Very high	66 Å²	66	36.9 Å²	36.9	31%	0.308	19%	0.189	S	C	.	.	S	Bend	trans	-68.1	146.9	-178.5	-69.9	-176.8	159.9	0	0	110.8	E76 W81 F82 M83	E76-E79 WeakPolarHBondContact O-CB 3.38Å; E76-E79 PolarHBondContact O-N 3.24Å; E79-W81 PolarHBondContact O-N 3.34Å; E79-W81 VanDerWaalsContact O-N 3.09Å; E79-W81 PolarHBondContact OE2-NE1 2.88Å; E79-F82 PolarHBondContact O-N 3.18Å; E79-M83 WeakPolarHBondContact O-CG 3.3Å; E79-M83 PolarHBondContact O-N 2.94Å
80	P	97.8	Very high	95.3	Very high	32 Å²	32	39.6 Å²	39.6	21%	0.208	20%	0.201	C	C	.	.	H	α-helix	trans	-57.1	-30.8	-174.1	-28.3	35.4	0	0	0	114.7	R84 N192 L195	P80-R84 WeakPolarHBondContact O-CB 3.39Å; P80-R84 WeakPolarHBondContact O-CG 3.42Å; P80-R84 PolarHBondContact O-N 3.22Å; P80-R84 PolarHBondContact O-NE 3.43Å; P80-N192 WeakPolarHBondContact CG-OD1 3.35Å; P80-L195 HydrophobicContact CB-CD1 3.8Å
81	W	96.6	Very high	95.4	Very high	76 Å²	76	40.2 Å²	40.2	29%	0.288	21%	0.205	S	C	.	.	H	α-helix	trans	-67.5	-39.9	177.1	69.8	-94.9	0	0	0	111.7	Y43 Y68 V70 E79 L85	Y43-W81 HydrophobicContact CD1-CH2 4.16Å; Y43-W81 AromaticContact CD1-CZ3 3.86Å; Y43-W81 HydrophobicContact CD1-CZ3 3.86Å; Y43-W81 HydrophobicContact CE1-CH2 4.34Å; Y43-W81 AromaticContact CE1-CZ3 3.74Å; Y43-W81 HydrophobicContact CE1-CZ3 3.74Å; Y68-W81 HydrophobicContact CD1-CH2 4.14Å; Y68-W81 AromaticContact CE1-CH2 3.55Å; Y68-W81 HydrophobicContact CE1-CH2 3.55Å; Y68-W81 HydrophobicContact CE1-CZ2 4.02Å; Y68-W81 HydrophobicContact CE1-CZ3 4.41Å; V70-W81 HydrophobicContact CG2-CH2 4.05Å; E79-W81 PolarHBondContact O-N 3.34Å; E79-W81 VanDerWaalsContact O-N 3.09Å; E79-W81 PolarHBondContact OE2-NE1 2.88Å; W81-L85 PolarHBondContact O-N 2.83Å
82	F	98	Very high	95.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-76.7	-38.4	178.9	-171.2	-93.6	0	0	0	110.9	Y43 V70 H77 E79 R84 L85 N86 E90 V91 V93	Y43-F82 HydrophobicContact CG-CE2 4.43Å; V70-F82 HydrophobicContact CG1-CD2 4.17Å; V70-F82 HydrophobicContact CG1-CE2 4.29Å; V70-F82 HydrophobicContact CG1-CG 4.47Å; V70-F82 HydrophobicContact CG2-CD2 3.99Å; V70-F82 HydrophobicContact CG2-CE2 3.83Å; H77-F82 HydrophobicContact CB-CD1 4.07Å; H77-F82 HydrophobicContact CB-CE1 4.09Å; H77-F82 WeakPolarHBondContact O-CD1 3.25Å; E79-F82 PolarHBondContact O-N 3.18Å; F82-R84 VanDerWaalsContact C-N 3.26Å; F82-R84 PolarHBondContact O-N 2.8Å; F82-L85 HydrophobicContact CE2-CD2 4.42Å; F82-L85 CarbonylContact O-C 3.42Å; F82-L85 WeakPolarHBondContact O-CA 3.42Å; F82-L85 WeakPolarHBondContact O-CB 3.28Å; F82-L85 PolarHBondContact O-N 3.39Å; F82-N86 HydrophobicContact CE1-CB 4.35Å; F82-N86 PolarHBondContact O-N 2.78Å; F82-E90 WeakPolarHBondContact CZ-O 3.26Å; F82-V91 HydrophobicContact CE1-CG1 4.3Å; F82-V91 HydrophobicContact CE2-CG1 4.13Å; F82-V91 HydrophobicContact CZ-CG1 3.55Å; F82-V93 HydrophobicContact CE2-CG2 4.22Å; F82-V93 HydrophobicContact CZ-CG2 3.8Å
83	M	97.9	Very high	96	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-29.4	176.5	-69.6	-68.8	-59.5	0	0	112.8	E79 L85 N86 P87 G89 L195 A198 Y199 K202	E79-M83 WeakPolarHBondContact O-CG 3.3Å; E79-M83 PolarHBondContact O-N 2.94Å; M83-L85 VanDerWaalsContact C-N 3.33Å; M83-N86 CarbonylContact O-C 3.47Å; M83-N86 VanDerWaalsContact O-C 3.23Å; M83-P87 VanDerWaalsContact CE-O 3.3Å; M83-P87 WeakPolarHBondContact CE-O 3.43Å; M83-P87 WeakPolarHBondContact O-CA 3.26Å; M83-P87 VanDerWaalsContact O-N 3.16Å; M83-G89 VanDerWaalsContact SD-CA 3.58Å; M83-L195 HydrophobicContact CB-CD1 3.91Å; M83-L195 HydrophobicContact CB-CD2 4.39Å; M83-A198 HydrophobicContact CE-CB 3.75Å; M83-Y199 HydrophobicContact CB-CE1 4.48Å; M83-Y199 HydrophobicContact CE-CD1 3.86Å; M83-Y199 HydrophobicContact CE-CE1 3.92Å; M83-Y199 HydrophobicContact CE-CG 4.48Å; M83-Y199 HydrophobicContact CG-CD1 4.49Å; M83-Y199 HydrophobicContact CG-CE1 3.61Å; M83-Y199 HydrophobicContact SD-CE1 4.13Å; M83-K202 HydrophobicContact CE-CD 4.45Å; M83-K202 HydrophobicContact SD-CD 4.26Å
84	R	96.6	Very high	96.5	Very high	171 Å²	171	35.4 Å²	35.4	65%	0.645	18%	0.176	S	C	*	.	H	α-helix	trans	-67.3	-34.1	169	-81	-176.7	-72	158.5	-5.4	112.5	P80 F82 L195	P80-R84 WeakPolarHBondContact O-CB 3.39Å; P80-R84 WeakPolarHBondContact O-CG 3.42Å; P80-R84 PolarHBondContact O-N 3.22Å; P80-R84 PolarHBondContact O-NE 3.43Å; F82-R84 VanDerWaalsContact C-N 3.26Å; F82-R84 PolarHBondContact O-N 2.8Å; R84-L195 HydrophobicContact CG-CD1 4.27Å; R84-L195 HydrophobicContact CG-CD2 3.97Å; R84-L195 HydrophobicContact CG-CG 4.5Å
85	L	96.1	Very high	96.9	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.199	17%	0.167	C	C	.	.	H	α-helix	trans	-74	-46.2	176.6	-173	71.4	0	0	0	111.3	Y43 W81 F82 M83 V93 V95 V100	Y43-L85 HydrophobicContact CD1-CD2 4.34Å; Y43-L85 HydrophobicContact CD2-CD2 3.51Å; Y43-L85 HydrophobicContact CE1-CD2 4.48Å; Y43-L85 HydrophobicContact CE2-CD2 3.68Å; Y43-L85 HydrophobicContact CG-CD2 3.87Å; W81-L85 PolarHBondContact O-N 2.83Å; F82-L85 HydrophobicContact CE2-CD2 4.42Å; F82-L85 CarbonylContact O-C 3.42Å; F82-L85 WeakPolarHBondContact O-CA 3.42Å; F82-L85 WeakPolarHBondContact O-CB 3.28Å; F82-L85 PolarHBondContact O-N 3.39Å; M83-L85 VanDerWaalsContact C-N 3.33Å; L85-V93 HydrophobicContact CD1-CG1 4.47Å; L85-V93 HydrophobicContact CD2-CB 4.05Å; L85-V93 HydrophobicContact CD2-CG1 3.72Å; L85-V93 HydrophobicContact CD2-CG2 4.49Å; L85-V93 HydrophobicContact CG-CG1 3.85Å; L85-V95 HydrophobicContact CD1-CG2 3.86Å; L85-V95 HydrophobicContact CD2-CG2 4.36Å; L85-V100 HydrophobicContact CD1-CB 4.34Å; L85-V100 HydrophobicContact CD1-CG1 3.62Å; L85-V100 HydrophobicContact CD1-CG2 3.7Å; L85-V100 HydrophobicContact CG-CG1 4.03Å
86	N	97.6	Very high	97	Very high	11 Å²	11	33.1 Å²	33.1	6%	0.059	16%	0.162	C	C	.	.			trans	-136.4	104.1	176.3	-178.6	6.9	0	0	0	110.5	F82 M83 A88 G89 E90 V93 C102	F82-N86 HydrophobicContact CE1-CB 4.35Å; F82-N86 PolarHBondContact O-N 2.78Å; M83-N86 CarbonylContact O-C 3.47Å; M83-N86 VanDerWaalsContact O-C 3.23Å; N86-A88 PolarHBondContact O-N 2.8Å; N86-A88 VanDerWaalsContact O-N 3.1Å; N86-A88 VanDerWaalsContact OD1-CB 3.25Å; N86-A88 WeakPolarHBondContact OD1-CB 3.38Å; N86-A88 PolarHBondContact OD1-N 3.42Å; N86-G89 WeakPolarHBondContact O-CA 3.36Å; N86-G89 PolarHBondContact O-N 3Å; N86-E90 PolarHBondContact ND2-N 3.33Å; N86-E90 PolarHBondContact ND2-O 2.97Å; N86-V93 HydrophobicContact CB-CG2 3.69Å; N86-C102 HydrophobicContact CB-CB 4.41Å
87	P	96.6	Very high	96.9	Very high	72 Å²	72	36 Å²	36	47%	0.468	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.2	177.2	-26.5	35.9	0	0	0	114.5	M83 G89 A198	M83-P87 VanDerWaalsContact CE-O 3.3Å; M83-P87 WeakPolarHBondContact CE-O 3.43Å; M83-P87 WeakPolarHBondContact O-CA 3.26Å; M83-P87 VanDerWaalsContact O-N 3.16Å; P87-G89 PolarHBondContact O-N 3.06Å; P87-A198 HydrophobicContact CB-CB 3.9Å
88	A	96.1	Very high	96.7	Very high	27 Å²	27	42.5 Å²	42.5	22%	0.223	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-27	170.6	0	0	0	0	0	111.7	N86 E90 K202 R205	N86-A88 PolarHBondContact O-N 2.8Å; N86-A88 VanDerWaalsContact O-N 3.1Å; N86-A88 VanDerWaalsContact OD1-CB 3.25Å; N86-A88 WeakPolarHBondContact OD1-CB 3.38Å; N86-A88 PolarHBondContact OD1-N 3.42Å; A88-E90 VanDerWaalsContact C-N 3.32Å; A88-E90 HydrophobicContact CB-CB 4.48Å; A88-E90 HydrophobicContact CB-CG 4.23Å; A88-K202 WeakPolarHBondContact O-CE 3.19Å; A88-R205 PolarHBondContact O-NH2 2.95Å
89	G	96.1	Very high	96.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.01	24%	0.235	C	C	.	.			trans	63.1	38.3	-174.2	0	0	0	0	0	111.9	H77 M83 N86 P87 K202	H77-G89 PolarHBondContact CD2-O 3.37Å; H77-G89 VanDerWaalsContact CD2-O 3.25Å; M83-G89 VanDerWaalsContact SD-CA 3.58Å; N86-G89 WeakPolarHBondContact O-CA 3.36Å; N86-G89 PolarHBondContact O-N 3Å; P87-G89 PolarHBondContact O-N 3.06Å; G89-K202 VanDerWaalsContact CA-NZ 3.32Å; G89-K202 PolarHBondContact O-NZ 3.26Å
90	E	96	Very high	96.8	Very high	91 Å²	91	47.3 Å²	47.3	43%	0.425	24%	0.239	S	C	.	.			trans	-113	154.6	179.3	-64.8	-173.3	156.6	0	0	110.2	F82 N86 A88 K209	F82-E90 WeakPolarHBondContact CZ-O 3.26Å; N86-E90 PolarHBondContact ND2-N 3.33Å; N86-E90 PolarHBondContact ND2-O 2.97Å; A88-E90 VanDerWaalsContact C-N 3.32Å; A88-E90 HydrophobicContact CB-CB 4.48Å; A88-E90 HydrophobicContact CB-CG 4.23Å; E90-K209 IonicContact OE1-NZ 2.88Å
91	V	97.9	Very high	96.8	Very high	13 Å²	13	46.3 Å²	46.3	8%	0.079	23%	0.232	C	C	.	.	S	Bend	trans	-115	148	175.3	-68.7	0	0	0	0	109.2	W45 S48 V70 L72 F82	W45-V91 HydrophobicContact CB-CG2 3.9Å; S48-V91 PolarHBondContact OG-O 3.48Å; V70-V91 HydrophobicContact CB-CG1 4.09Å; V70-V91 HydrophobicContact CG1-CG1 4.37Å; V70-V91 HydrophobicContact CG2-CG1 4.45Å; L72-V91 HydrophobicContact CD1-CG1 4.44Å; L72-V91 HydrophobicContact CD1-CG2 3.85Å; F82-V91 HydrophobicContact CE1-CG1 4.3Å; F82-V91 HydrophobicContact CE2-CG1 4.13Å; F82-V91 HydrophobicContact CZ-CG1 3.55Å
92	P	98.5	Very high	96.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	23%	0.231	C	C	.	.			cis	-84.3	165.3	7	33	-31.7	0	0	0	114.3	L42 Y43 H44 V54 P104 I107	L42-P92 HydrophobicContact CD1-CB 3.89Å; Y43-P92 CarbonylContact O-C 3.56Å; Y43-P92 WeakPolarHBondContact O-CA 3.32Å; H44-P92 HydrophobicContact CB-CB 4.49Å; V54-P92 HydrophobicContact CB-CG 4.08Å; V54-P92 HydrophobicContact CG2-CG 3.66Å; P92-P104 HydrophobicContact CG-CB 4.31Å; P92-I107 HydrophobicContact CB-CD1 4.36Å; P92-I107 HydrophobicContact CG-CD1 4.01Å
93	V	98.7	Very high	96.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.5	165.5	-177.1	0	0	0	0	108.5	Y43 F82 L85 N86 V100 I101 C102	Y43-V93 PolarHBondContact N-O 3.41Å; Y43-V93 PolarHBondContact O-N 2.92Å; F82-V93 HydrophobicContact CE2-CG2 4.22Å; F82-V93 HydrophobicContact CZ-CG2 3.8Å; L85-V93 HydrophobicContact CD1-CG1 4.47Å; L85-V93 HydrophobicContact CD2-CB 4.05Å; L85-V93 HydrophobicContact CD2-CG1 3.72Å; L85-V93 HydrophobicContact CD2-CG2 4.49Å; L85-V93 HydrophobicContact CG-CG1 3.85Å; N86-V93 HydrophobicContact CB-CG2 3.69Å; V93-V100 HydrophobicContact CG1-CG1 3.58Å; V93-I101 WeakPolarHBondContact CA-O 3.44Å; V93-C102 HydrophobicContact CG2-CB 4.5Å
94	L	98.6	Very high	96.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.5	173.4	-168.6	80.7	0	0	0	109.4	L40 L42 I58 V100 I101 I107 Y110 L111	L40-L94 HydrophobicContact CD1-CD1 3.72Å; L40-L94 HydrophobicContact CD1-CD2 3.92Å; L40-L94 HydrophobicContact CD1-CG 3.94Å; L40-L94 HydrophobicContact CG-CD1 4.16Å; L42-L94 HydrophobicContact CB-CD1 4.46Å; L42-L94 HydrophobicContact CD1-CB 4.47Å; L42-L94 HydrophobicContact CD1-CD1 3.99Å; I58-L94 HydrophobicContact CD1-CD1 4.37Å; L94-V100 WeakPolarHBondContact O-CA 3.41Å; L94-I101 HydrophobicContact CB-CB 4.44Å; L94-I101 HydrophobicContact CD2-CD1 4.39Å; L94-I101 PolarHBondContact N-O 3.14Å; L94-I101 PolarHBondContact O-N 3.21Å; L94-I107 HydrophobicContact CB-CB 4.5Å; L94-I107 HydrophobicContact CB-CD1 4.01Å; L94-I107 HydrophobicContact CB-CG1 3.78Å; L94-I107 HydrophobicContact CB-CG2 3.98Å; L94-I107 HydrophobicContact CD1-CG2 4.48Å; L94-I107 HydrophobicContact CD2-CG2 4.14Å; L94-I107 HydrophobicContact CG-CG2 4.43Å; L94-Y110 HydrophobicContact CD2-CD1 3.68Å; L94-Y110 HydrophobicContact CD2-CE1 4.11Å; L94-L111 HydrophobicContact CD2-CD2 4.07Å; L94-L111 HydrophobicContact CD2-CG 4.46Å
95	V	98.1	Very high	96.7	Very high	21 Å²	21	42.8 Å²	42.8	13%	0.127	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.2	169.4	-178	0	0	0	0	107.9	T41 Y43 L85 D97 K99 V100	T41-V95 PolarHBondContact N-O 3.48Å; T41-V95 PolarHBondContact O-N 2.88Å; Y43-V95 HydrophobicContact CD2-CG2 4.09Å; Y43-V95 HydrophobicContact CE2-CB 4.4Å; Y43-V95 HydrophobicContact CE2-CG2 3.69Å; L85-V95 HydrophobicContact CD1-CG2 3.86Å; L85-V95 HydrophobicContact CD2-CG2 4.36Å; V95-D97 WeakPolarHBondContact CG1-O 3.46Å; V95-K99 VanDerWaalsContact CA-O 3.32Å; V95-K99 WeakPolarHBondContact CA-O 3.36Å; V95-V100 HydrophobicContact CG2-CG1 4.47Å; V95-V100 HydrophobicContact CG2-CG2 4.22Å
96	H	96.7	Very high	96.7	Very high	23 Å²	23	46.7 Å²	46.7	11%	0.106	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	105.2	171.4	-174.2	-159.1	0	0	0	107.5	S38 L40 D98 K99 Y110 F115	S38-H96 VanDerWaalsContact CB-NE2 3.26Å; S38-H96 WeakPolarHBondContact CB-NE2 3.45Å; S38-H96 PolarHBondContact OG-NE2 3.22Å; L40-H96 HydrophobicContact CD1-CB 3.9Å; H96-D98 PolarHBondContact O-N 2.98Å; H96-K99 PolarHBondContact N-O 2.99Å; H96-K99 WeakPolarHBondContact O-CB 3.32Å; H96-K99 PolarHBondContact O-N 2.81Å; H96-Y110 HydrophobicContact CB-CE1 3.94Å; H96-Y110 AromaticContact ND1-CE1 3.66Å; H96-Y110 AromaticContact ND1-CZ 3.63Å; H96-Y110 PolarHBondContact ND1-OH 2.91Å; H96-F115 AromaticContact CE1-CZ 3.63Å; H96-F115 AromaticContact ND1-CZ 3.89Å; H96-F115 AromaticContact NE2-CZ 3.94Å
97	D	92.4	Very high	96.8	Very high	83 Å²	83	46.2 Å²	46.2	44%	0.444	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	-114.7	-167	-53.3	-36.9	0	0	0	111.1	S38 K39 V95	S38-D97 WeakPolarHBondContact CA-OD1 3.26Å; S38-D97 VanDerWaalsContact CB-OD2 3.28Å; S38-D97 WeakPolarHBondContact CB-OD2 3.5Å; K39-D97 PolarHBondContact N-OD1 2.97Å; K39-D97 PolarHBondContact O-N 3.47Å; V95-D97 WeakPolarHBondContact CG1-O 3.46Å
98	D	91.6	Very high	96.8	Very high	165 Å²	165	42.9 Å²	42.9	88%	0.882	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.6	179	-63.1	-45.8	0	0	0	113.6	H96	H96-D98 PolarHBondContact O-N 2.98Å
99	K	96.2	Very high	96.8	Very high	105 Å²	105	44 Å²	44	46%	0.457	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.3	-176.1	-170.7	177	-177.9	-178.4	0	111	V95 H96 I101 Y110	V95-K99 VanDerWaalsContact CA-O 3.32Å; V95-K99 WeakPolarHBondContact CA-O 3.36Å; H96-K99 PolarHBondContact N-O 2.99Å; H96-K99 WeakPolarHBondContact O-CB 3.32Å; H96-K99 PolarHBondContact O-N 2.81Å; K99-I101 HydrophobicContact CD-CD1 4.27Å; K99-I101 HydrophobicContact CD-CG1 4.47Å; K99-I101 HydrophobicContact CG-CD1 4.48Å; K99-I101 HydrophobicContact CG-CG1 4.19Å; K99-Y110 HydrophobicContact CD-CD2 4.42Å; K99-Y110 HydrophobicContact CD-CE2 3.71Å; K99-Y110 VanDerWaalsContact NZ-CD2 3.32Å
100	V	97.9	Very high	96.9	Very high	64 Å²	64	45 Å²	45	39%	0.388	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.2	175.9	-174.5	0	0	0	0	110.3	L85 V93 L94 V95	L85-V100 HydrophobicContact CD1-CB 4.34Å; L85-V100 HydrophobicContact CD1-CG1 3.62Å; L85-V100 HydrophobicContact CD1-CG2 3.7Å; L85-V100 HydrophobicContact CG-CG1 4.03Å; V93-V100 HydrophobicContact CG1-CG1 3.58Å; L94-V100 WeakPolarHBondContact O-CA 3.41Å; V95-V100 HydrophobicContact CG2-CG1 4.47Å; V95-V100 HydrophobicContact CG2-CG2 4.22Å
101	I	98.5	Very high	96.9	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.056	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	119.9	179.2	-45.9	178.1	0	0	0	108.4	V93 L94 K99 Q106 I107 Y110	V93-I101 WeakPolarHBondContact CA-O 3.44Å; L94-I101 HydrophobicContact CB-CB 4.44Å; L94-I101 HydrophobicContact CD2-CD1 4.39Å; L94-I101 PolarHBondContact N-O 3.14Å; L94-I101 PolarHBondContact O-N 3.21Å; K99-I101 HydrophobicContact CD-CD1 4.27Å; K99-I101 HydrophobicContact CD-CG1 4.47Å; K99-I101 HydrophobicContact CG-CD1 4.48Å; K99-I101 HydrophobicContact CG-CG1 4.19Å; I101-Q106 HydrophobicContact CG2-CB 3.87Å; I101-I107 HydrophobicContact CB-CG1 3.93Å; I101-I107 HydrophobicContact CG2-CG1 3.68Å; I101-I107 WeakPolarHBondContact O-CD1 3.38Å; I101-Y110 HydrophobicContact CD1-CD1 3.41Å; I101-Y110 VanDerWaalsContact CD1-CD1 3.41Å; I101-Y110 HydrophobicContact CD1-CD2 3.57Å; I101-Y110 HydrophobicContact CD1-CE1 3.95Å; I101-Y110 HydrophobicContact CD1-CE2 4.14Å; I101-Y110 HydrophobicContact CD1-CG 3.17Å
102	C	97.9	Very high	96.7	Very high	41 Å²	41	40.6 Å²	40.6	28%	0.277	21%	0.214	S	C	.	.			trans	-106.7	-20.2	-171.4	-59.4	0	0	0	0	114	N86 V93	N86-C102 HydrophobicContact CB-CB 4.41Å; V93-C102 HydrophobicContact CG2-CB 4.5Å
103	D	96.9	Very high	96.5	Very high	64 Å²	64	46.7 Å²	46.7	34%	0.342	25%	0.246	S	C	.	.			trans	-87	125.6	-179.5	177.8	-91.6	0	0	0	110.3	T105 Q106 I107	D103-T105 VanDerWaalsContact C-N 3.28Å; D103-T105 PolarHBondContact O-N 3.09Å; D103-T105 WeakPolarHBondContact OD1-CA 3.29Å; D103-T105 VanDerWaalsContact OD1-CB 3.25Å; D103-T105 WeakPolarHBondContact OD1-CB 3.25Å; D103-T105 PolarHBondContact OD1-N 3.13Å; D103-Q106 HydrophobicContact CB-CB 4.04Å; D103-Q106 HydrophobicContact CB-CG 3.98Å; D103-Q106 PolarHBondContact O-N 2.74Å; D103-Q106 PolarHBondContact OD1-N 3.4Å; D103-I107 VanDerWaalsContact O-CG1 3.24Å; D103-I107 WeakPolarHBondContact O-CG1 3.41Å; D103-I107 PolarHBondContact O-N 2.75Å
104	P	96.2	Very high	96.2	Very high	19 Å²	19	50.5 Å²	50.5	12%	0.123	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-32.1	-174.7	25.4	-35	0	0	0	113.5	N50 V54 P92 M108	N50-P104 HydrophobicContact CB-CB 3.94Å; N50-P104 HydrophobicContact CB-CG 4.01Å; V54-P104 HydrophobicContact CG2-CB 4.22Å; P92-P104 HydrophobicContact CG-CB 4.31Å; P104-M108 WeakPolarHBondContact O-CG 3.5Å; P104-M108 PolarHBondContact O-N 3.33Å; P104-M108 VanDerWaalsContact O-N 3.15Å
105	T	95.3	Very high	95.9	Very high	49 Å²	49	51.5 Å²	51.5	30%	0.301	27%	0.271	S	S	.	.	H	α-helix	trans	-69.7	-48.5	177.3	-57.9	0	0	0	0	109.6	D103 I107 M108 D109 R139	D103-T105 VanDerWaalsContact C-N 3.28Å; D103-T105 PolarHBondContact O-N 3.09Å; D103-T105 WeakPolarHBondContact OD1-CA 3.29Å; D103-T105 VanDerWaalsContact OD1-CB 3.25Å; D103-T105 WeakPolarHBondContact OD1-CB 3.25Å; D103-T105 PolarHBondContact OD1-N 3.13Å; T105-I107 VanDerWaalsContact C-N 3.28Å; T105-I107 PolarHBondContact O-N 2.89Å; T105-M108 PolarHBondContact O-N 2.72Å; T105-M108 VanDerWaalsContact O-N 3.11Å; T105-D109 PolarHBondContact O-N 3.17Å; T105-R139 PolarHBondContact O-NH2 2.77Å
106	Q	97.7	Very high	95.4	Very high	120 Å²	120	52.1 Å²	52.1	56%	0.561	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-33.4	175	-65.7	179.4	34	0	0	112.9	I101 D103 Y110	I101-Q106 HydrophobicContact CG2-CB 3.87Å; D103-Q106 HydrophobicContact CB-CB 4.04Å; D103-Q106 HydrophobicContact CB-CG 3.98Å; D103-Q106 PolarHBondContact O-N 2.74Å; D103-Q106 PolarHBondContact OD1-N 3.4Å; Q106-Y110 WeakPolarHBondContact O-CB 3.29Å; Q106-Y110 PolarHBondContact O-N 3.1Å
107	I	98.3	Very high	94.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-49.1	173.1	-72.2	167.3	0	0	0	109.6	V54 P92 L94 I101 D103 T105 Y110 L111	V54-I107 HydrophobicContact CB-CG2 4.32Å; V54-I107 HydrophobicContact CG1-CG2 3.5Å; V54-I107 VanDerWaalsContact CG1-CG2 3.5Å; V54-I107 HydrophobicContact CG2-CB 4.19Å; V54-I107 HydrophobicContact CG2-CD1 4.49Å; V54-I107 HydrophobicContact CG2-CG2 3.8Å; P92-I107 HydrophobicContact CB-CD1 4.36Å; P92-I107 HydrophobicContact CG-CD1 4.01Å; L94-I107 HydrophobicContact CB-CB 4.5Å; L94-I107 HydrophobicContact CB-CD1 4.01Å; L94-I107 HydrophobicContact CB-CG1 3.78Å; L94-I107 HydrophobicContact CB-CG2 3.98Å; L94-I107 HydrophobicContact CD1-CG2 4.48Å; L94-I107 HydrophobicContact CD2-CG2 4.14Å; L94-I107 HydrophobicContact CG-CG2 4.43Å; I101-I107 HydrophobicContact CB-CG1 3.93Å; I101-I107 HydrophobicContact CG2-CG1 3.68Å; I101-I107 WeakPolarHBondContact O-CD1 3.38Å; D103-I107 VanDerWaalsContact O-CG1 3.24Å; D103-I107 WeakPolarHBondContact O-CG1 3.41Å; D103-I107 PolarHBondContact O-N 2.75Å; T105-I107 VanDerWaalsContact C-N 3.28Å; T105-I107 PolarHBondContact O-N 2.89Å; I107-Y110 PolarHBondContact O-N 2.88Å; I107-L111 HydrophobicContact CG2-CD1 4.11Å; I107-L111 HydrophobicContact CG2-CG 4.48Å; I107-L111 VanDerWaalsContact O-CG 3.25Å; I107-L111 WeakPolarHBondContact O-CG 3.37Å; I107-L111 PolarHBondContact O-N 2.89Å
108	M	97.1	Very high	94.1	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-41.2	-179.8	-65.4	-177.8	-61.8	0	0	112.1	K53 V54 A57 P104 T105 L111 E112 I260	K53-M108 HydrophobicContact CB-SD 4.4Å; V54-M108 HydrophobicContact CG2-CG 4.26Å; A57-M108 HydrophobicContact CB-CG 4.39Å; P104-M108 WeakPolarHBondContact O-CG 3.5Å; P104-M108 PolarHBondContact O-N 3.33Å; P104-M108 VanDerWaalsContact O-N 3.15Å; T105-M108 PolarHBondContact O-N 2.72Å; T105-M108 VanDerWaalsContact O-N 3.11Å; M108-L111 PolarHBondContact O-N 3.48Å; M108-E112 PolarHBondContact O-N 3.41Å; M108-I260 HydrophobicContact CB-CD1 3.71Å; M108-I260 HydrophobicContact CE-CD1 4.38Å; M108-I260 HydrophobicContact CG-CD1 4.46Å; M108-I260 HydrophobicContact SD-CD1 4.15Å; M108-I260 HydrophobicContact SD-CG1 4.26Å
109	D	96.3	Very high	93.6	Very high	52 Å²	52	57.8 Å²	57.8	28%	0.278	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-46	174.4	-68.1	-36.7	0	0	0	111.4	T105 L111 E112 D113 R139	T105-D109 PolarHBondContact O-N 3.17Å; D109-L111 VanDerWaalsContact C-N 3.28Å; D109-L111 PolarHBondContact O-N 3Å; D109-E112 PolarHBondContact O-N 3.2Å; D109-E112 VanDerWaalsContact O-N 3.09Å; D109-D113 PolarHBondContact O-N 3.16Å; D109-R139 IonicContact OD1-CZ 2.73Å; D109-R139 IonicContact OD1-NH1 3.8Å; D109-R139 PolarHBondContact OD1-NH1 2.82Å; D109-R139 IonicContact OD1-NH2 2.79Å; D109-R139 PolarHBondContact OD1-NH2 3.24Å; D109-R139 IonicContact OD2-CZ 3.62Å; D109-R139 IonicContact OD2-NH2 3.51Å; D109-R139 PolarHBondContact OD2-NH2 3.01Å
110	Y	97.3	Very high	93.2	Very high	22 Å²	22	53.6 Å²	53.6	9%	0.086	30%	0.296	C	S	.	.	H	α-helix	trans	-58.4	-41.1	176.7	-178.3	-101.6	0	0	0	112.3	L94 H96 K99 I101 Q106 I107 D113 N114 F115	L94-Y110 HydrophobicContact CD2-CD1 3.68Å; L94-Y110 HydrophobicContact CD2-CE1 4.11Å; H96-Y110 HydrophobicContact CB-CE1 3.94Å; H96-Y110 AromaticContact ND1-CE1 3.66Å; H96-Y110 AromaticContact ND1-CZ 3.63Å; H96-Y110 PolarHBondContact ND1-OH 2.91Å; K99-Y110 HydrophobicContact CD-CD2 4.42Å; K99-Y110 HydrophobicContact CD-CE2 3.71Å; K99-Y110 VanDerWaalsContact NZ-CD2 3.32Å; I101-Y110 HydrophobicContact CD1-CD1 3.41Å; I101-Y110 VanDerWaalsContact CD1-CD1 3.41Å; I101-Y110 HydrophobicContact CD1-CD2 3.57Å; I101-Y110 HydrophobicContact CD1-CE1 3.95Å; I101-Y110 HydrophobicContact CD1-CE2 4.14Å; I101-Y110 HydrophobicContact CD1-CG 3.17Å; Q106-Y110 WeakPolarHBondContact O-CB 3.29Å; Q106-Y110 PolarHBondContact O-N 3.1Å; I107-Y110 PolarHBondContact O-N 2.88Å; Y110-D113 PolarHBondContact O-N 3.26Å; Y110-N114 WeakPolarHBondContact CD2-ND2 3.47Å; Y110-N114 HydrophobicContact CE1-CB 4.43Å; Y110-N114 HydrophobicContact CE2-CB 4.27Å; Y110-N114 WeakPolarHBondContact CE2-ND2 3.45Å; Y110-N114 WeakPolarHBondContact CE2-OD1 3.37Å; Y110-N114 VanDerWaalsContact O-CB 3.29Å; Y110-N114 WeakPolarHBondContact O-CB 3.31Å; Y110-N114 PolarHBondContact O-N 3.13Å; Y110-N114 PolarHBondContact O-ND2 2.89Å; Y110-F115 HydrophobicContact CE1-CE2 4.25Å
111	L	96.1	Very high	93	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-39.7	176.5	-68.2	172	0	0	0	111.9	L40 I58 K61 L63 L94 I107 M108 D109 F115	L40-L111 HydrophobicContact CD2-CD2 4.15Å; I58-L111 HydrophobicContact CD1-CD1 4.22Å; I58-L111 HydrophobicContact CG1-CD1 3.52Å; I58-L111 HydrophobicContact CG1-CD2 4.42Å; K61-L111 HydrophobicContact CD-CB 4.28Å; K61-L111 WeakPolarHBondContact CE-O 3.49Å; L63-L111 HydrophobicContact CD1-CD2 3.83Å; L94-L111 HydrophobicContact CD2-CD2 4.07Å; L94-L111 HydrophobicContact CD2-CG 4.46Å; I107-L111 HydrophobicContact CG2-CD1 4.11Å; I107-L111 HydrophobicContact CG2-CG 4.48Å; I107-L111 VanDerWaalsContact O-CG 3.25Å; I107-L111 WeakPolarHBondContact O-CG 3.37Å; I107-L111 PolarHBondContact O-N 2.89Å; M108-L111 PolarHBondContact O-N 3.48Å; D109-L111 VanDerWaalsContact C-N 3.28Å; D109-L111 PolarHBondContact O-N 3Å; L111-F115 HydrophobicContact CD2-CD2 4.01Å; L111-F115 HydrophobicContact CD2-CE2 3.95Å; L111-F115 VanDerWaalsContact O-CB 3.31Å; L111-F115 WeakPolarHBondContact O-CB 3.41Å; L111-F115 PolarHBondContact O-N 3.03Å; L111-F115 VanDerWaalsContact O-N 3.09Å
112	E	94	Very high	92.8	Very high	11 Å²	11	59.1 Å²	59.1	5%	0.051	32%	0.317	C	S	.	.	H	α-helix	trans	-67.8	-44.7	176	-70.5	-58.4	119.2	0	0	111.9	K61 M108 D109 N114 S116 L123 V124	K61-E112 WeakPolarHBondContact CD-OE1 3.44Å; K61-E112 WeakPolarHBondContact CE-OE1 2.98Å; K61-E112 IonicContact NZ-OE1 2.82Å; K61-E112 PolarHBondContact NZ-OE1 2.88Å; K61-E112 IonicContact NZ-OE2 2.64Å; M108-E112 PolarHBondContact O-N 3.41Å; D109-E112 PolarHBondContact O-N 3.2Å; D109-E112 VanDerWaalsContact O-N 3.09Å; E112-N114 PolarHBondContact O-N 3.33Å; E112-S116 PolarHBondContact O-OG 2.94Å; E112-L123 WeakPolarHBondContact OE1-CB 3.35Å; E112-L123 PolarHBondContact OE1-N 2.92Å; E112-L123 PolarHBondContact OE2-N 3.11Å; E112-V124 HydrophobicContact CG-CB 4.3Å; E112-V124 HydrophobicContact CG-CG2 3.88Å; E112-V124 PolarHBondContact OE2-N 3.28Å; E112-V124 VanDerWaalsContact OE2-N 3.17Å
113	D	93.9	Very high	92.7	Very high	128 Å²	128	57.3 Å²	57.3	68%	0.684	31%	0.305	S	S	*	.	H	α-helix	trans	-69.2	-36.2	-176.7	-69.5	-17	0	0	0	112.8	D109 Y110	D109-D113 PolarHBondContact O-N 3.16Å; Y110-D113 PolarHBondContact O-N 3.26Å
114	N	93.6	Very high	92.6	Very high	80 Å²	80	55.2 Å²	55.2	43%	0.428	29%	0.294	S	S	.	.	H	α-helix	trans	-102.5	-16.8	-169.8	-64.2	-102.8	0	0	0	113.2	Y110 E112	Y110-N114 WeakPolarHBondContact CD2-ND2 3.47Å; Y110-N114 HydrophobicContact CE1-CB 4.43Å; Y110-N114 HydrophobicContact CE2-CB 4.27Å; Y110-N114 WeakPolarHBondContact CE2-ND2 3.45Å; Y110-N114 WeakPolarHBondContact CE2-OD1 3.37Å; Y110-N114 VanDerWaalsContact O-CB 3.29Å; Y110-N114 WeakPolarHBondContact O-CB 3.31Å; Y110-N114 PolarHBondContact O-N 3.13Å; Y110-N114 PolarHBondContact O-ND2 2.89Å; E112-N114 PolarHBondContact O-N 3.33Å
115	F	92.3	Very high	92.6	Very high	21 Å²	21	55.1 Å²	55.1	9%	0.092	29%	0.294	C	S	.	.			trans	-122.8	65.6	179.8	-55.9	-98.3	0	0	0	110.4	L40 K61 L63 H96 Y110 L111 Y117 T120	L40-F115 HydrophobicContact CD1-CE2 4.35Å; L40-F115 HydrophobicContact CD1-CZ 3.97Å; L40-F115 HydrophobicContact CD2-CE1 4.33Å; L40-F115 HydrophobicContact CD2-CZ 4.02Å; L40-F115 HydrophobicContact CG-CZ 4.49Å; K61-F115 WeakPolarHBondContact CE-O 3.45Å; K61-F115 PolarHBondContact NZ-O 3.34Å; K61-F115 VanDerWaalsContact NZ-O 3.16Å; L63-F115 HydrophobicContact CD1-CB 4.04Å; L63-F115 HydrophobicContact CD1-CD1 4.2Å; L63-F115 HydrophobicContact CD1-CD2 4.28Å; L63-F115 HydrophobicContact CD1-CG 3.92Å; L63-F115 HydrophobicContact CD2-CB 3.79Å; L63-F115 HydrophobicContact CD2-CD1 3.81Å; L63-F115 HydrophobicContact CD2-CG 4.02Å; H96-F115 AromaticContact CE1-CZ 3.63Å; H96-F115 AromaticContact ND1-CZ 3.89Å; H96-F115 AromaticContact NE2-CZ 3.94Å; Y110-F115 HydrophobicContact CE1-CE2 4.25Å; L111-F115 HydrophobicContact CD2-CD2 4.01Å; L111-F115 HydrophobicContact CD2-CE2 3.95Å; L111-F115 VanDerWaalsContact O-CB 3.31Å; L111-F115 WeakPolarHBondContact O-CB 3.41Å; L111-F115 PolarHBondContact O-N 3.03Å; L111-F115 VanDerWaalsContact O-N 3.09Å; F115-Y117 HydrophobicContact CB-CE1 4.32Å; F115-Y117 HydrophobicContact CD1-CE1 4.1Å; F115-T120 VanDerWaalsContact O-CG2 3.28Å; F115-T120 WeakPolarHBondContact O-CG2 3.27Å
116	S	86.6	Confident	92.4	Very high	34 Å²	34	58.7 Å²	58.7	24%	0.238	31%	0.307	C	S	.	.			trans	-119.7	17.9	-176.4	-93.8	0	0	0	0	113.3	E112 R122	E112-S116 PolarHBondContact O-OG 2.94Å; S116-R122 PolarHBondContact O-NH2 2.97Å; S116-R122 VanDerWaalsContact OG-CZ 3.3Å; S116-R122 PolarHBondContact OG-NH1 3.45Å
117	Y	85.1	Confident	92.3	Very high	115 Å²	115	60.2 Å²	60.2	45%	0.451	31%	0.314	S	S	.	.	S	Bend	trans	-75.6	162.3	179.7	56.8	-94.6	0	0	0	112.6	F115 G119 T120	F115-Y117 HydrophobicContact CB-CE1 4.32Å; F115-Y117 HydrophobicContact CD1-CE1 4.1Å; Y117-G119 PolarHBondContact O-N 3.25Å; Y117-T120 WeakPolarHBondContact CD2-OG1 3.31Å; Y117-T120 WeakPolarHBondContact CE2-OG1 3.15Å; Y117-T120 WeakPolarHBondContact O-CB 3.44Å; Y117-T120 PolarHBondContact O-N 3.23Å
118	E	78.2	Confident	92.1	Very high	196 Å²	196	65.1 Å²	65.1	92%	0.916	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	130.5	-176.6	-168.4	175.5	-175.1	0	0	112
119	G	80.2	Confident	92	Very high	79 Å²	79	66.7 Å²	66.7	81%	0.814	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	-9.6	-177.2	0	0	0	0	0	115.6	Y117	Y117-G119 PolarHBondContact O-N 3.25Å
120	T	88.4	Confident	91.9	Very high	18 Å²	18	73.2 Å²	73.2	11%	0.11	38%	0.38	C	S	.	.	S	Bend	trans	-88.6	122.7	172.6	-56.5	0	0	0	0	110.8	K61 L63 F115 Y117 R122	K61-T120 HydrophobicContact CB-CG2 4.21Å; L63-T120 HydrophobicContact CD2-CG2 3.99Å; F115-T120 VanDerWaalsContact O-CG2 3.28Å; F115-T120 WeakPolarHBondContact O-CG2 3.27Å; Y117-T120 WeakPolarHBondContact CD2-OG1 3.31Å; Y117-T120 WeakPolarHBondContact CE2-OG1 3.15Å; Y117-T120 WeakPolarHBondContact O-CB 3.44Å; Y117-T120 PolarHBondContact O-N 3.23Å; T120-R122 PolarHBondContact O-N 3.4Å
121	P	92.6	Very high	91.8	Very high	65 Å²	65	74.7 Å²	74.7	42%	0.422	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-56.7	136	173.1	-26.5	36	0	0	0	112.5	K61	K61-P121 PolarHBondContact NZ-O 3.42Å; K61-P121 WeakPolarHBondContact O-CD 3.48Å
122	R	93.9	Very high	91.8	Very high	125 Å²	125	77 Å²	77	47%	0.472	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-91.9	132.3	169.4	-70.1	-175.9	179.3	-101.7	1.3	109.5	S116 T120	S116-R122 PolarHBondContact O-NH2 2.97Å; S116-R122 VanDerWaalsContact OG-CZ 3.3Å; S116-R122 PolarHBondContact OG-NH1 3.45Å; T120-R122 PolarHBondContact O-N 3.4Å
123	L	96.3	Very high	92	Very high	4 Å²	4	83.2 Å²	83.2	2%	0.021	43%	0.428	C	S	.	.	S	Bend	trans	-98	-21.1	174.9	-58.8	177.9	0	0	0	111.2	A57 E60 K61 E112 S259 I260 V263	A57-L123 HydrophobicContact CB-CD1 3.92Å; E60-L123 HydrophobicContact CB-CD2 4.03Å; K61-L123 HydrophobicContact CD-CD1 4.26Å; K61-L123 HydrophobicContact CG-CD1 3.83Å; K61-L123 HydrophobicContact CG-CG 3.99Å; E112-L123 WeakPolarHBondContact OE1-CB 3.35Å; E112-L123 PolarHBondContact OE1-N 2.92Å; E112-L123 PolarHBondContact OE2-N 3.11Å; L123-S259 CarbonylContact O-C 3.47Å; L123-S259 WeakPolarHBondContact O-CA 2.98Å; L123-S259 WeakPolarHBondContact O-CB 3.32Å; L123-I260 HydrophobicContact CB-CB 4.1Å; L123-I260 PolarHBondContact O-N 3.48Å; L123-V263 HydrophobicContact CD1-CG2 4.2Å
124	V	95.9	Very high	92.1	Very high	20 Å²	20	78.9 Å²	78.9	12%	0.121	40%	0.402	C	S	.	.	S	Bend	trans	-108.2	122.2	171.6	179.7	0	0	0	0	108.4	E112 Y132 I260	E112-V124 HydrophobicContact CG-CB 4.3Å; E112-V124 HydrophobicContact CG-CG2 3.88Å; E112-V124 PolarHBondContact OE2-N 3.28Å; E112-V124 VanDerWaalsContact OE2-N 3.17Å; V124-Y132 HydrophobicContact CG1-CD2 4.21Å; V124-Y132 HydrophobicContact CG1-CE2 3.9Å; V124-I260 HydrophobicContact CG2-CB 4.06Å; V124-I260 HydrophobicContact CG2-CD1 4.27Å; V124-I260 HydrophobicContact CG2-CG2 3.6Å
125	P	94.6	Very high	92.3	Very high	17 Å²	17	75.1 Å²	75.1	11%	0.11	38%	0.382	C	S	.	.			trans	-68.3	161.7	174.7	33.3	-37.7	0	0	0	110.2	Y132 V135 F257	P125-Y132 HydrophobicContact CG-CD2 4.4Å; P125-Y132 WeakPolarHBondContact O-CD2 3.49Å; P125-V135 HydrophobicContact CG-CB 4.41Å; P125-V135 HydrophobicContact CG-CG2 4Å; P125-F257 HydrophobicContact CB-CE2 4.36Å; P125-F257 HydrophobicContact CB-CZ 3.93Å; P125-F257 HydrophobicContact CG-CE2 4.35Å; P125-F257 HydrophobicContact CG-CZ 3.9Å
126	E	93	Very high	92.6	Very high	123 Å²	123	75.7 Å²	75.7	58%	0.575	39%	0.385	S	S	*	.			trans	-58.1	149.6	173.9	-63.7	-177.3	-177.5	0	0	111.7	S128 S129	E126-S128 PolarHBondContact O-N 2.92Å; E126-S128 VanDerWaalsContact O-N 3.13Å; E126-S129 WeakPolarHBondContact O-CA 3.35Å; E126-S129 WeakPolarHBondContact O-CB 3.46Å; E126-S129 PolarHBondContact O-N 2.91Å
127	E	94	Very high	93.1	Very high	152 Å²	152	78.2 Å²	78.2	71%	0.71	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-31.2	-179.4	-62.1	-167.6	177.5	0	0	113.4	S129 Y132	E127-S129 PolarHBondContact O-N 3.37Å; E127-Y132 HydrophobicContact CB-CD1 4.39Å; E127-Y132 HydrophobicContact CB-CE1 4.33Å; E127-Y132 HydrophobicContact CG-CD2 4.43Å; E127-Y132 HydrophobicContact CG-CE1 4.07Å; E127-Y132 HydrophobicContact CG-CE2 3.93Å
128	S	95	Very high	93.8	Very high	104 Å²	104	73.5 Å²	73.5	73%	0.727	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.8	176.7	63.8	0	0	0	0	113.3	E126	E126-S128 PolarHBondContact O-N 2.92Å; E126-S128 VanDerWaalsContact O-N 3.13Å
129	S	95.1	Very high	94.7	Very high	35 Å²	35	64.8 Å²	64.8	25%	0.245	33%	0.333	C	S	.	.	S	Bend	trans	-70.3	138.1	-177.9	-177.5	0	0	0	0	111.4	E126 E127 Y131 Y132	E126-S129 WeakPolarHBondContact O-CA 3.35Å; E126-S129 WeakPolarHBondContact O-CB 3.46Å; E126-S129 PolarHBondContact O-N 2.91Å; E127-S129 PolarHBondContact O-N 3.37Å; S129-Y131 PolarHBondContact O-N 3.01Å; S129-Y131 WeakPolarHBondContact OG-CD2 3.35Å; S129-Y131 PolarHBondContact OG-N 3.08Å; S129-Y132 WeakPolarHBondContact O-CB 3.35Å; S129-Y132 PolarHBondContact O-N 3.29Å
130	R	93.6	Very high	95.5	Very high	188 Å²	188	67.2 Å²	67.2	71%	0.709	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-18.8	171.8	65.8	178.3	-74.1	-169.2	-3.8	113.8
131	Y	94.8	Very high	95.9	Very high	53 Å²	53	67.6 Å²	67.6	21%	0.208	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-16.9	-179.1	-54.5	-68.6	0	0	0	113.3	S129 L133 R134 V135 C254 F257	S129-Y131 PolarHBondContact O-N 3.01Å; S129-Y131 WeakPolarHBondContact OG-CD2 3.35Å; S129-Y131 PolarHBondContact OG-N 3.08Å; Y131-L133 PolarHBondContact O-N 3.49Å; Y131-R134 WeakPolarHBondContact O-CB 3.17Å; Y131-R134 PolarHBondContact O-N 3.36Å; Y131-V135 WeakPolarHBondContact O-CG2 3.2Å; Y131-V135 PolarHBondContact O-N 3.21Å; Y131-C254 WeakPolarHBondContact CD1-O 3.35Å; Y131-F257 HydrophobicContact CD1-CE1 4.39Å; Y131-F257 AromaticContact CD2-CE1 3.65Å; Y131-F257 HydrophobicContact CD2-CE1 3.65Å; Y131-F257 HydrophobicContact CD2-CZ 4.45Å; Y131-F257 HydrophobicContact CE2-CE1 4.3Å; Y131-F257 AromaticContact CG-CE1 3.71Å; Y131-F257 HydrophobicContact CG-CE1 3.71Å; Y131-F257 HydrophobicContact CG-CZ 4.26Å
132	Y	96.6	Very high	96.2	Very high	49 Å²	49	64.6 Å²	64.6	19%	0.192	30%	0.304	C	S	.	.	H	α-helix	trans	-57.2	-55.5	-170.1	-179.6	-105.1	0	0	0	113.4	V124 P125 E127 S129 R134 V135 Q136	V124-Y132 HydrophobicContact CG1-CD2 4.21Å; V124-Y132 HydrophobicContact CG1-CE2 3.9Å; P125-Y132 HydrophobicContact CG-CD2 4.4Å; P125-Y132 WeakPolarHBondContact O-CD2 3.49Å; E127-Y132 HydrophobicContact CB-CD1 4.39Å; E127-Y132 HydrophobicContact CB-CE1 4.33Å; E127-Y132 HydrophobicContact CG-CD2 4.43Å; E127-Y132 HydrophobicContact CG-CE1 4.07Å; E127-Y132 HydrophobicContact CG-CE2 3.93Å; S129-Y132 WeakPolarHBondContact O-CB 3.35Å; S129-Y132 PolarHBondContact O-N 3.29Å; Y132-R134 PolarHBondContact O-N 2.96Å; Y132-V135 PolarHBondContact O-N 3.48Å; Y132-V135 VanDerWaalsContact O-N 3.09Å; Y132-Q136 HydrophobicContact CD1-CG 4.36Å; Y132-Q136 HydrophobicContact CD2-CG 4.47Å; Y132-Q136 HydrophobicContact CE1-CG 3.95Å; Y132-Q136 HydrophobicContact CE2-CG 4.08Å; Y132-Q136 VanDerWaalsContact CE2-NE2 3.32Å; Y132-Q136 PolarHBondContact O-N 3.11Å; Y132-Q136 PolarHBondContact OH-NE2 3.32Å
133	L	97.5	Very high	96.2	Very high	141 Å²	141	60.6 Å²	60.6	74%	0.738	29%	0.292	S	S	*	.	H	α-helix	trans	-60.8	-33.2	-178.7	-65.3	176.9	0	0	0	112.5	Y131 H137	Y131-L133 PolarHBondContact O-N 3.49Å; L133-H137 VanDerWaalsContact O-CB 3.28Å; L133-H137 WeakPolarHBondContact O-CB 3.3Å; L133-H137 PolarHBondContact O-N 3.49Å
134	R	97	Very high	96.2	Very high	38 Å²	38	64.5 Å²	64.5	14%	0.143	32%	0.32	C	S	.	.	H	α-helix	trans	-69.4	-44.1	176.3	-174.3	-169.6	-67.4	158.1	-9	111.3	Y131 Y132 H137 Y138 E236 R240 C254	Y131-R134 WeakPolarHBondContact O-CB 3.17Å; Y131-R134 PolarHBondContact O-N 3.36Å; Y132-R134 PolarHBondContact O-N 2.96Å; R134-H137 PolarHBondContact O-N 3.08Å; R134-Y138 HydrophobicContact CG-CD2 3.94Å; R134-Y138 HydrophobicContact CG-CE2 4.08Å; R134-Y138 WeakPolarHBondContact O-CD2 3.13Å; R134-Y138 PolarHBondContact O-N 3.36Å; R134-E236 WeakPolarHBondContact CD-OE1 3.26Å; R134-E236 IonicContact CZ-OE1 3.14Å; R134-E236 IonicContact NE-OE1 3.77Å; R134-E236 PolarHBondContact NE-OE1 2.92Å; R134-E236 VanDerWaalsContact NE-OE1 3.11Å; R134-R240 VanDerWaalsContact CZ-CZ 3.43Å; R134-C254 WeakPolarHBondContact CD-O 3.34Å; R134-C254 HydrophobicContact CG-CB 4.17Å; R134-C254 PolarHBondContact NH1-O 3.42Å
135	V	98.1	Very high	96.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-46.6	176.1	171.4	0	0	0	0	110.5	P125 Y131 Y132 R139 C254 F257 I260 A261	P125-V135 HydrophobicContact CG-CB 4.41Å; P125-V135 HydrophobicContact CG-CG2 4Å; Y131-V135 WeakPolarHBondContact O-CG2 3.2Å; Y131-V135 PolarHBondContact O-N 3.21Å; Y132-V135 PolarHBondContact O-N 3.48Å; Y132-V135 VanDerWaalsContact O-N 3.09Å; V135-R139 WeakPolarHBondContact O-CB 3.44Å; V135-R139 PolarHBondContact O-N 3Å; V135-C254 HydrophobicContact CB-CB 4.49Å; V135-C254 HydrophobicContact CG2-CB 3.45Å; V135-C254 VanDerWaalsContact CG2-CB 3.45Å; V135-F257 HydrophobicContact CG2-CE2 4.4Å; V135-F257 HydrophobicContact CG2-CZ 4.12Å; V135-I260 HydrophobicContact CG1-CG2 3.57Å; V135-A261 HydrophobicContact CG1-CB 4.43Å
136	Q	97.6	Very high	96.2	Very high	33 Å²	33	64.9 Å²	64.9	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-46.1	177.5	-63.9	-57.7	-17.5	0	0	111.6	Y132 Y138 R139 E140	Y132-Q136 HydrophobicContact CD1-CG 4.36Å; Y132-Q136 HydrophobicContact CD2-CG 4.47Å; Y132-Q136 HydrophobicContact CE1-CG 3.95Å; Y132-Q136 HydrophobicContact CE2-CG 4.08Å; Y132-Q136 VanDerWaalsContact CE2-NE2 3.32Å; Y132-Q136 PolarHBondContact O-N 3.11Å; Y132-Q136 PolarHBondContact OH-NE2 3.32Å; Q136-Y138 PolarHBondContact O-N 2.77Å; Q136-R139 PolarHBondContact O-N 2.95Å; Q136-E140 WeakPolarHBondContact O-CB 3.36Å; Q136-E140 WeakPolarHBondContact O-CG 3.31Å; Q136-E140 PolarHBondContact O-N 2.84Å
137	H	98.1	Very high	96.3	Very high	87 Å²	87	59.4 Å²	59.4	40%	0.403	30%	0.297	S	S	.	.	H	α-helix	trans	-55.9	-52.3	178.5	175.1	63.5	0	0	0	112.8	L133 R134 E140 L141	L133-H137 VanDerWaalsContact O-CB 3.28Å; L133-H137 WeakPolarHBondContact O-CB 3.3Å; L133-H137 PolarHBondContact O-N 3.49Å; R134-H137 PolarHBondContact O-N 3.08Å; H137-E140 PolarHBondContact O-N 3.3Å; H137-L141 VanDerWaalsContact O-CB 3.29Å; H137-L141 WeakPolarHBondContact O-CB 3.35Å; H137-L141 PolarHBondContact O-N 2.84Å
138	Y	98.4	Very high	96.2	Very high	17 Å²	17	54.7 Å²	54.7	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-72	-32.9	-178.6	-81.8	-74.6	0	0	0	112.9	R134 Q136 L141 L142 Q232 V233 E236 L253	R134-Y138 HydrophobicContact CG-CD2 3.94Å; R134-Y138 HydrophobicContact CG-CE2 4.08Å; R134-Y138 WeakPolarHBondContact O-CD2 3.13Å; R134-Y138 PolarHBondContact O-N 3.36Å; Q136-Y138 PolarHBondContact O-N 2.77Å; Y138-L141 HydrophobicContact CD1-CD2 4.08Å; Y138-L141 HydrophobicContact CE1-CD2 4.11Å; Y138-L142 WeakPolarHBondContact O-CB 3.38Å; Y138-L142 VanDerWaalsContact O-CD1 3.3Å; Y138-L142 WeakPolarHBondContact O-CD1 3.47Å; Y138-L142 WeakPolarHBondContact O-CG 3.47Å; Y138-L142 PolarHBondContact O-N 3.27Å; Y138-Q232 PolarHBondContact OH-O 3.14Å; Y138-V233 HydrophobicContact CD1-CG2 4.33Å; Y138-V233 HydrophobicContact CE1-CG2 4.24Å; Y138-E236 HydrophobicContact CE1-CB 4.35Å; Y138-E236 HydrophobicContact CE2-CB 4.16Å; Y138-E236 HydrophobicContact CE2-CG 3.58Å; Y138-E236 WeakPolarHBondContact OH-CB 3.48Å; Y138-E236 WeakPolarHBondContact OH-CG 3.41Å; Y138-L253 HydrophobicContact CD1-CD1 4.32Å; Y138-L253 HydrophobicContact CD1-CD2 3.95Å; Y138-L253 HydrophobicContact CD1-CG 4.38Å; Y138-L253 HydrophobicContact CD2-CG 4.41Å; Y138-L253 HydrophobicContact CE1-CD1 4.43Å; Y138-L253 HydrophobicContact CG-CD2 3.79Å; Y138-L253 HydrophobicContact CG-CG 4.14Å
139	R	96.9	Very high	96.1	Very high	13 Å²	13	49.8 Å²	49.8	5%	0.049	24%	0.242	C	C	.	.	H	α-helix	trans	-58.5	-53.1	171.3	177	-168.7	175.4	177.5	2.4	110.5	T105 D109 V135 Q136 L142 D143 I260 A261	T105-R139 PolarHBondContact O-NH2 2.77Å; D109-R139 IonicContact OD1-CZ 2.73Å; D109-R139 IonicContact OD1-NH1 3.8Å; D109-R139 PolarHBondContact OD1-NH1 2.82Å; D109-R139 IonicContact OD1-NH2 2.79Å; D109-R139 PolarHBondContact OD1-NH2 3.24Å; D109-R139 IonicContact OD2-CZ 3.62Å; D109-R139 IonicContact OD2-NH2 3.51Å; D109-R139 PolarHBondContact OD2-NH2 3.01Å; V135-R139 WeakPolarHBondContact O-CB 3.44Å; V135-R139 PolarHBondContact O-N 3Å; Q136-R139 PolarHBondContact O-N 2.95Å; R139-L142 PolarHBondContact O-N 2.86Å; R139-D143 WeakPolarHBondContact O-CB 3.16Å; R139-D143 PolarHBondContact O-N 2.83Å; R139-I260 HydrophobicContact CB-CG2 4.46Å; R139-I260 HydrophobicContact CG-CG2 4.42Å; R139-A261 HydrophobicContact CB-CB 4.46Å
140	E	97.1	Very high	96	Very high	129 Å²	129	48.1 Å²	48.1	60%	0.603	23%	0.231	S	C	*	.	H	α-helix	trans	-61.3	-45.3	179.7	-72.8	173.9	-174.6	0	0	111.7	Q136 H137 L142 D143 S144	Q136-E140 WeakPolarHBondContact O-CB 3.36Å; Q136-E140 WeakPolarHBondContact O-CG 3.31Å; Q136-E140 PolarHBondContact O-N 2.84Å; H137-E140 PolarHBondContact O-N 3.3Å; E140-L142 PolarHBondContact O-N 3.23Å; E140-D143 PolarHBondContact O-N 2.98Å; E140-S144 WeakPolarHBondContact O-CB 3.33Å; E140-S144 PolarHBondContact O-N 2.96Å
141	L	98.1	Very high	95.9	Very high	27 Å²	27	40.3 Å²	40.3	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-56.6	-49.2	178.1	-175.3	66.7	0	0	0	111.3	H137 Y138 S144 V229 Q232	H137-L141 VanDerWaalsContact O-CB 3.29Å; H137-L141 WeakPolarHBondContact O-CB 3.35Å; H137-L141 PolarHBondContact O-N 2.84Å; Y138-L141 HydrophobicContact CD1-CD2 4.08Å; Y138-L141 HydrophobicContact CE1-CD2 4.11Å; L141-S144 PolarHBondContact O-OG 2.79Å; L141-V229 HydrophobicContact CD1-CG2 3.94Å; L141-V229 HydrophobicContact CD2-CG1 4.09Å; L141-V229 HydrophobicContact CG-CG1 3.96Å; L141-V229 HydrophobicContact CG-CG2 4.23Å; L141-Q232 HydrophobicContact CD2-CB 4.24Å
142	L	97.9	Very high	95.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-73.7	-34.8	-177.9	-67.3	164.1	0	0	0	112.6	Y138 R139 E140 S144 L145 V229 V233 L253 L265	Y138-L142 WeakPolarHBondContact O-CB 3.38Å; Y138-L142 VanDerWaalsContact O-CD1 3.3Å; Y138-L142 WeakPolarHBondContact O-CD1 3.47Å; Y138-L142 WeakPolarHBondContact O-CG 3.47Å; Y138-L142 PolarHBondContact O-N 3.27Å; R139-L142 PolarHBondContact O-N 2.86Å; E140-L142 PolarHBondContact O-N 3.23Å; L142-S144 VanDerWaalsContact C-N 3.29Å; L142-L145 HydrophobicContact CD2-CD1 4.34Å; L142-L145 WeakPolarHBondContact O-CB 3.43Å; L142-L145 WeakPolarHBondContact O-CG 3.44Å; L142-L145 PolarHBondContact O-N 2.82Å; L142-V229 HydrophobicContact CD2-CG1 4.24Å; L142-V233 HydrophobicContact CD2-CG2 4.36Å; L142-L253 HydrophobicContact CD1-CD2 4.26Å; L142-L265 HydrophobicContact CD1-CB 3.66Å; L142-L265 HydrophobicContact CD1-CD1 4.36Å; L142-L265 HydrophobicContact CD2-CD1 3.93Å
143	D	94.5	Very high	95.4	Very high	41 Å²	41	38.5 Å²	38.5	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-76.3	-19.5	-179.8	-71.8	6.3	0	0	0	112.3	K53 R139 E140 L145 S264	K53-D143 IonicContact NZ-OD1 3.54Å; K53-D143 PolarHBondContact NZ-OD1 2.87Å; K53-D143 IonicContact NZ-OD2 3.8Å; K53-D143 PolarHBondContact NZ-OD2 3.39Å; R139-D143 WeakPolarHBondContact O-CB 3.16Å; R139-D143 PolarHBondContact O-N 2.83Å; E140-D143 PolarHBondContact O-N 2.98Å; D143-L145 PolarHBondContact O-N 3.3Å; D143-S264 WeakPolarHBondContact OD1-CB 3.27Å; D143-S264 PolarHBondContact OD1-OG 2.98Å
144	S	95.8	Very high	95.1	Very high	86 Å²	86	31.9 Å²	31.9	60%	0.601	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.1	172.5	77.8	0	0	0	0	113.9	E140 L141 L142	E140-S144 WeakPolarHBondContact O-CB 3.33Å; E140-S144 PolarHBondContact O-N 2.96Å; L141-S144 PolarHBondContact O-OG 2.79Å; L142-S144 VanDerWaalsContact C-N 3.29Å
145	L	96.4	Very high	94.7	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.073	16%	0.164	C	C	.	.	S	Bend	trans	-67.1	125	-178.4	-70.2	175.6	0	0	0	111.1	L142 D143 M147 Y150 L226 V229 T268	L142-L145 HydrophobicContact CD2-CD1 4.34Å; L142-L145 WeakPolarHBondContact O-CB 3.43Å; L142-L145 WeakPolarHBondContact O-CG 3.44Å; L142-L145 PolarHBondContact O-N 2.82Å; D143-L145 PolarHBondContact O-N 3.3Å; L145-M147 VanDerWaalsContact C-N 3.25Å; L145-M147 PolarHBondContact O-N 3.5Å; L145-Y150 HydrophobicContact CB-CE2 4.19Å; L145-Y150 HydrophobicContact CD2-CE2 4.39Å; L145-L226 HydrophobicContact CD1-CD1 3.74Å; L145-L226 HydrophobicContact CD2-CD1 3.81Å; L145-L226 HydrophobicContact CG-CD1 4.44Å; L145-V229 HydrophobicContact CD1-CG1 4.25Å; L145-V229 HydrophobicContact CD2-CB 4.35Å; L145-V229 HydrophobicContact CD2-CG1 4.46Å; L145-V229 HydrophobicContact CD2-CG2 3.98Å; L145-T268 HydrophobicContact CD1-CG2 3.94Å
146	P	95.1	Very high	94.2	Very high	32 Å²	32	32.5 Å²	32.5	21%	0.208	17%	0.17	C	C	.	.			trans	-77.4	74.3	-178.6	32.1	-36.3	0	0	0	111.3	D148 A149 Y150 L222	P146-D148 PolarHBondContact O-N 3.06Å; P146-A149 HydrophobicContact CB-CB 4.04Å; P146-A149 HydrophobicContact CG-CB 4.42Å; P146-A149 WeakPolarHBondContact O-CB 3.43Å; P146-A149 PolarHBondContact O-N 2.94Å; P146-Y150 HydrophobicContact CG-CE2 4.28Å; P146-Y150 WeakPolarHBondContact O-CD2 3.5Å; P146-Y150 PolarHBondContact O-N 3.1Å; P146-L222 HydrophobicContact CB-CD1 4.49Å; P146-L222 HydrophobicContact CG-CD1 3.77Å; P146-L222 HydrophobicContact CG-CD2 3.81Å; P146-L222 HydrophobicContact CG-CG 4.26Å
147	M	94.9	Very high	93.9	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.039	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-26.9	-172.4	-85	-62.3	-13.6	0	0	114.3	F49 L145 Y150 T151 R271 L275	F49-M147 HydrophobicContact CD1-CB 3.76Å; F49-M147 HydrophobicContact CD1-CG 3.9Å; F49-M147 HydrophobicContact CD2-CB 4.35Å; F49-M147 HydrophobicContact CD2-CG 4.02Å; F49-M147 HydrophobicContact CE1-CB 3.98Å; F49-M147 HydrophobicContact CE1-CG 3.65Å; F49-M147 HydrophobicContact CE2-CG 3.77Å; F49-M147 HydrophobicContact CE2-SD 4.26Å; F49-M147 HydrophobicContact CG-CB 3.97Å; F49-M147 HydrophobicContact CG-CG 4.09Å; F49-M147 HydrophobicContact CZ-CB 4.38Å; F49-M147 HydrophobicContact CZ-CG 3.59Å; L145-M147 VanDerWaalsContact C-N 3.25Å; L145-M147 PolarHBondContact O-N 3.5Å; M147-Y150 HydrophobicContact CE-CD2 3.8Å; M147-Y150 HydrophobicContact CE-CG 4.36Å; M147-Y150 HydrophobicContact SD-CD2 3.75Å; M147-Y150 HydrophobicContact SD-CE2 4.4Å; M147-T151 VanDerWaalsContact O-CB 3.31Å; M147-T151 WeakPolarHBondContact O-CB 3.22Å; M147-T151 PolarHBondContact O-N 3.45Å; M147-T151 PolarHBondContact O-OG1 2.97Å; M147-R271 HydrophobicContact CE-CB 4.31Å; M147-R271 HydrophobicContact CE-CG 3.31Å; M147-R271 HydrophobicContact SD-CG 4.18Å; M147-L275 HydrophobicContact CE-CD1 3.99Å
148	D	91.5	Very high	93.5	Very high	53 Å²	53	31.2 Å²	31.2	28%	0.283	17%	0.17	S	C	.	.	H	α-helix	trans	-69.1	-37.6	172.9	63.4	-20.5	0	0	0	111.7	P146 T151 H152 K209 H213	P146-D148 PolarHBondContact O-N 3.06Å; D148-T151 PolarHBondContact O-N 3.02Å; D148-H152 WeakPolarHBondContact O-CB 3.41Å; D148-H152 VanDerWaalsContact O-CG 3.26Å; D148-H152 PolarHBondContact O-N 3.13Å; D148-H152 PolarHBondContact O-ND1 3.33Å; D148-K209 WeakPolarHBondContact OD2-CE 3.48Å; D148-K209 IonicContact OD2-NZ 2.75Å; D148-K209 PolarHBondContact OD2-NZ 3.4Å; D148-H213 IonicContact OD2-CE1 3.68Å
149	A	92.8	Very high	93	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-44.3	174.7	0	0	0	0	0	112	P146 T151 G153 L222	P146-A149 HydrophobicContact CB-CB 4.04Å; P146-A149 HydrophobicContact CG-CB 4.42Å; P146-A149 WeakPolarHBondContact O-CB 3.43Å; P146-A149 PolarHBondContact O-N 2.94Å; A149-T151 PolarHBondContact O-N 3.05Å; A149-G153 WeakPolarHBondContact O-CA 3.34Å; A149-G153 PolarHBondContact O-N 3.41Å; A149-L222 HydrophobicContact CB-CD1 3.5Å; A149-L222 VanDerWaalsContact CB-CD1 3.5Å
150	Y	94.3	Very high	92.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-43.3	174.5	-54.1	-48.5	0	0	0	111.7	L145 P146 M147 C154 L222 L223 L226	L145-Y150 HydrophobicContact CB-CE2 4.19Å; L145-Y150 HydrophobicContact CD2-CE2 4.39Å; P146-Y150 HydrophobicContact CG-CE2 4.28Å; P146-Y150 WeakPolarHBondContact O-CD2 3.5Å; P146-Y150 PolarHBondContact O-N 3.1Å; M147-Y150 HydrophobicContact CE-CD2 3.8Å; M147-Y150 HydrophobicContact CE-CG 4.36Å; M147-Y150 HydrophobicContact SD-CD2 3.75Å; M147-Y150 HydrophobicContact SD-CE2 4.4Å; Y150-C154 WeakPolarHBondContact O-CB 3.37Å; Y150-C154 PolarHBondContact O-N 3.02Å; Y150-C154 PolarHBondContact O-SG 3.44Å; Y150-L222 HydrophobicContact CD1-CB 4.39Å; Y150-L222 HydrophobicContact CE1-CB 3.55Å; Y150-L222 WeakPolarHBondContact CE1-O 3.4Å; Y150-L222 PolarHBondContact OH-O 3.35Å; Y150-L223 HydrophobicContact CD1-CD2 3.91Å; Y150-L223 HydrophobicContact CE1-CD2 4.17Å; Y150-L226 HydrophobicContact CE1-CB 4.47Å; Y150-L226 HydrophobicContact CE1-CD2 4.43Å; Y150-L226 HydrophobicContact CE2-CD2 4.19Å
151	T	91.3	Very high	92.4	Very high	23 Å²	23	33.3 Å²	33.3	14%	0.141	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-50.5	-178	-60.1	0	0	0	0	111.1	M147 D148 A149 I155 L275	M147-T151 VanDerWaalsContact O-CB 3.31Å; M147-T151 WeakPolarHBondContact O-CB 3.22Å; M147-T151 PolarHBondContact O-N 3.45Å; M147-T151 PolarHBondContact O-OG1 2.97Å; D148-T151 PolarHBondContact O-N 3.02Å; A149-T151 PolarHBondContact O-N 3.05Å; T151-I155 HydrophobicContact CG2-CD1 4.2Å; T151-I155 WeakPolarHBondContact O-CD1 3.47Å; T151-I155 VanDerWaalsContact O-CG1 3.26Å; T151-I155 WeakPolarHBondContact O-CG1 3.38Å; T151-I155 PolarHBondContact O-N 3.3Å; T151-L275 HydrophobicContact CG2-CD2 4.23Å
152	H	89.5	Confident	92.1	Very high	65 Å²	65	34 Å²	34	30%	0.301	19%	0.194	S	C	.	.	H	α-helix	trans	-68.7	-41.7	178.6	-62.3	124.8	0	0	0	111.9	D148 C154 I155 L156 H213	D148-H152 WeakPolarHBondContact O-CB 3.41Å; D148-H152 VanDerWaalsContact O-CG 3.26Å; D148-H152 PolarHBondContact O-N 3.13Å; D148-H152 PolarHBondContact O-ND1 3.33Å; H152-C154 VanDerWaalsContact C-N 3.34Å; H152-C154 PolarHBondContact O-N 3.44Å; H152-I155 PolarHBondContact O-N 2.76Å; H152-I155 VanDerWaalsContact O-N 3.12Å; H152-L156 WeakPolarHBondContact O-CB 3.36Å; H152-L156 VanDerWaalsContact O-CG 3.3Å; H152-L156 WeakPolarHBondContact O-CG 3.35Å; H152-L156 PolarHBondContact O-N 3.13Å; H152-H213 HydrophobicContact CB-CB 3.82Å; H152-H213 WeakPolarHBondContact CB-ND1 3.17Å; H152-H213 AromaticContact CE1-ND1 3.99Å; H152-H213 AromaticContact CG-ND1 3.5Å; H152-H213 AromaticContact ND1-CE1 3.36Å; H152-H213 PolarHBondContact ND1-CE1 3.23Å; H152-H213 AromaticContact ND1-ND1 2.91Å; H152-H213 PolarHBondContact ND1-ND1 3.25Å
153	G	91.3	Very high	91.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-44.5	177.6	0	0	0	0	0	112.3	A149 I155 L156 H157	A149-G153 WeakPolarHBondContact O-CA 3.34Å; A149-G153 PolarHBondContact O-N 3.41Å; G153-I155 VanDerWaalsContact C-N 3.33Å; G153-I155 PolarHBondContact O-N 3.18Å; G153-L156 PolarHBondContact O-N 2.64Å; G153-H157 WeakPolarHBondContact O-CB 3.49Å; G153-H157 PolarHBondContact O-CD2 2.91Å; G153-H157 PolarHBondContact O-N 3.25Å
154	C	91.2	Very high	91.5	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-29.9	176.6	-68.4	0	0	0	0	113.5	Y150 H152 T161 I166 L275	Y150-C154 WeakPolarHBondContact O-CB 3.37Å; Y150-C154 PolarHBondContact O-N 3.02Å; Y150-C154 PolarHBondContact O-SG 3.44Å; H152-C154 VanDerWaalsContact C-N 3.34Å; H152-C154 PolarHBondContact O-N 3.44Å; C154-T161 HydrophobicContact CB-CG2 3.71Å; C154-I166 HydrophobicContact CB-CD1 4.16Å; C154-L275 HydrophobicContact CB-CB 4.39Å; C154-L275 HydrophobicContact CB-CD2 4.18Å
155	I	88.8	Confident	91.1	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.138	21%	0.209	C	C	.	.	H	α-helix	trans	-72.6	-40.4	174.3	-64.9	162.9	0	0	0	110.5	T151 H152 G153 I166 A170 A171 I174	T151-I155 HydrophobicContact CG2-CD1 4.2Å; T151-I155 WeakPolarHBondContact O-CD1 3.47Å; T151-I155 VanDerWaalsContact O-CG1 3.26Å; T151-I155 WeakPolarHBondContact O-CG1 3.38Å; T151-I155 PolarHBondContact O-N 3.3Å; H152-I155 PolarHBondContact O-N 2.76Å; H152-I155 VanDerWaalsContact O-N 3.12Å; G153-I155 VanDerWaalsContact C-N 3.33Å; G153-I155 PolarHBondContact O-N 3.18Å; I155-I166 HydrophobicContact CG1-CD1 3.7Å; I155-I166 HydrophobicContact CG1-CG1 4.4Å; I155-I166 HydrophobicContact CG1-CG2 4.03Å; I155-A170 HydrophobicContact CG2-CB 4.4Å; I155-A171 WeakPolarHBondContact O-CB 3.43Å; I155-I174 HydrophobicContact CB-CD1 4.21Å; I155-I174 HydrophobicContact CD1-CD1 4.39Å; I155-I174 HydrophobicContact CG2-CB 4.36Å; I155-I174 HydrophobicContact CG2-CD1 3.68Å; I155-I174 HydrophobicContact CG2-CG2 4.45Å
156	L	87.6	Confident	90.6	Very high	24 Å²	24	38.8 Å²	38.8	13%	0.126	21%	0.212	C	C	.	.	H	α-helix	trans	-76.6	-32.5	-177.1	-69.5	167.8	0	0	0	112.6	H152 G153 P158 I174 L210 D214	H152-L156 WeakPolarHBondContact O-CB 3.36Å; H152-L156 VanDerWaalsContact O-CG 3.3Å; H152-L156 WeakPolarHBondContact O-CG 3.35Å; H152-L156 PolarHBondContact O-N 3.13Å; G153-L156 PolarHBondContact O-N 2.64Å; L156-P158 VanDerWaalsContact C-CD 3.47Å; L156-P158 WeakPolarHBondContact O-CD 3.46Å; L156-I174 HydrophobicContact CD2-CG2 3.55Å; L156-L210 HydrophobicContact CD1-CD1 4.18Å; L156-D214 HydrophobicContact CD1-CB 4.05Å
157	H	89.7	Confident	89.9	Confident	26 Å²	26	38.9 Å²	38.9	12%	0.12	21%	0.213	C	C	.	.			trans	-126.1	65.6	-174.7	-56.4	-70.2	0	0	0	110.9	G153 E159 I160 D214 M216	G153-H157 WeakPolarHBondContact O-CB 3.49Å; G153-H157 PolarHBondContact O-CD2 2.91Å; G153-H157 PolarHBondContact O-N 3.25Å; H157-E159 VanDerWaalsContact CA-OE2 3.27Å; H157-E159 WeakPolarHBondContact CA-OE2 3.13Å; H157-E159 WeakPolarHBondContact CB-OE1 3.09Å; H157-E159 IonicContact ND1-OE1 3.94Å; H157-E159 PolarHBondContact O-N 3.1Å; H157-I160 HydrophobicContact CB-CD1 4.23Å; H157-I160 HydrophobicContact CB-CG2 4.37Å; H157-I160 VanDerWaalsContact O-CG1 3.27Å; H157-I160 WeakPolarHBondContact O-CG1 3.29Å; H157-I160 PolarHBondContact O-N 3.3Å; H157-D214 IonicContact CE1-OD1 2.79Å; H157-D214 PolarHBondContact CE1-OD1 3.49Å; H157-D214 VanDerWaalsContact CE1-OD1 3.23Å; H157-D214 PolarHBondContact NE2-O 2.92Å; H157-D214 IonicContact NE2-OD1 3.74Å; H157-D214 PolarHBondContact NE2-OD1 3.33Å; H157-D214 VanDerWaalsContact NE2-OD1 3.09Å; H157-M216 HydrophobicContact CB-CE 3.5Å; H157-M216 VanDerWaalsContact ND1-CE 3.32Å; H157-M216 WeakPolarHBondContact ND1-CE 3.4Å
158	P	89.8	Confident	89.1	Confident	67 Å²	67	43 Å²	43	44%	0.435	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-60.6	-20.8	-173.6	25.3	-35.1	0	0	0	113.9	L156 I160 T161	L156-P158 VanDerWaalsContact C-CD 3.47Å; L156-P158 WeakPolarHBondContact O-CD 3.46Å; P158-I160 PolarHBondContact O-N 2.76Å; P158-I160 VanDerWaalsContact O-N 3.17Å; P158-T161 PolarHBondContact O-N 3.22Å; P158-T161 VanDerWaalsContact O-N 3.09Å; P158-T161 PolarHBondContact O-OG1 2.87Å
159	E	89.8	Confident	88.4	Confident	131 Å²	131	47 Å²	47	61%	0.612	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-63.1	-16.3	178.1	72	-78.4	-177.1	0	0	114.4	H157 T161	H157-E159 VanDerWaalsContact CA-OE2 3.27Å; H157-E159 WeakPolarHBondContact CA-OE2 3.13Å; H157-E159 WeakPolarHBondContact CB-OE1 3.09Å; H157-E159 IonicContact ND1-OE1 3.94Å; H157-E159 PolarHBondContact O-N 3.1Å; E159-T161 VanDerWaalsContact C-N 3.33Å
160	I	90.3	Very high	87.7	Confident	42 Å²	42	48 Å²	48	22%	0.215	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-88.6	-3.4	177.1	79.7	-168.3	0	0	0	112.9	H157 P158 M216 L219 L223	H157-I160 HydrophobicContact CB-CD1 4.23Å; H157-I160 HydrophobicContact CB-CG2 4.37Å; H157-I160 VanDerWaalsContact O-CG1 3.27Å; H157-I160 WeakPolarHBondContact O-CG1 3.29Å; H157-I160 PolarHBondContact O-N 3.3Å; P158-I160 PolarHBondContact O-N 2.76Å; P158-I160 VanDerWaalsContact O-N 3.17Å; I160-M216 HydrophobicContact CG2-CE 4.15Å; I160-M216 HydrophobicContact CG2-SD 4.37Å; I160-L219 HydrophobicContact CD1-CD2 3.52Å; I160-L219 HydrophobicContact CD1-CG 4.29Å; I160-L223 HydrophobicContact CD1-CD1 4.13Å
161	T	91.3	Very high	86.6	Confident	29 Å²	29	49.8 Å²	49.8	18%	0.178	28%	0.284	C	S	.	.			trans	-111.3	151.9	-174.8	71.6	0	0	0	0	111.6	C154 P158 E159 L275 L277	C154-T161 HydrophobicContact CB-CG2 3.71Å; P158-T161 PolarHBondContact O-N 3.22Å; P158-T161 VanDerWaalsContact O-N 3.09Å; P158-T161 PolarHBondContact O-OG1 2.87Å; E159-T161 VanDerWaalsContact C-N 3.33Å; T161-L275 WeakPolarHBondContact CB-O 3.48Å; T161-L275 WeakPolarHBondContact CG2-O 3.38Å; T161-L277 HydrophobicContact CG2-CD2 4.48Å
162	A	90.7	Very high	85.6	Confident	42 Å²	42	52.5 Å²	52.5	35%	0.347	31%	0.308	S	S	.	.	S	Bend	trans	-130.5	130.6	173.4	0	0	0	0	0	109.9	S164 G276	A162-S164 VanDerWaalsContact C-N 3.29Å; A162-S164 PolarHBondContact O-N 3.22Å; A162-G276 PolarHBondContact N-O 3Å; A162-G276 CarbonylContact O-C 3.22Å; A162-G276 WeakPolarHBondContact O-CA 3.23Å
163	D	88.2	Confident	84.8	Confident	97 Å²	97	51.7 Å²	51.7	52%	0.519	31%	0.31	S	S	.	.	S	Bend	trans	56.6	37.7	-174.6	-47.4	-38.8	0	0	0	114.1	R279	D163-R279 VanDerWaalsContact CG-NH2 3.34Å; D163-R279 IonicContact OD1-CZ 3.11Å; D163-R279 IonicContact OD1-NH2 3.77Å; D163-R279 PolarHBondContact OD1-NH2 3.02Å; D163-R279 IonicContact OD2-CZ 3.54Å; D163-R279 IonicContact OD2-NE 2.63Å; D163-R279 PolarHBondContact OD2-NE 2.91Å; D163-R279 IonicContact OD2-NH2 3.85Å; D163-R279 PolarHBondContact OD2-NH2 3.49Å
164	S	90.8	Very high	84	Confident	37 Å²	37	52.7 Å²	52.7	26%	0.259	32%	0.315	S	S	.	.			trans	-63.2	137.8	177.1	-173.7	0	0	0	0	111.8	A162 I166 L275	A162-S164 VanDerWaalsContact C-N 3.29Å; A162-S164 PolarHBondContact O-N 3.22Å; S164-I166 VanDerWaalsContact C-N 3.26Å; S164-I166 WeakPolarHBondContact OG-CB 3.41Å; S164-I166 WeakPolarHBondContact OG-CG1 3.31Å; S164-I166 PolarHBondContact OG-N 3.32Å; S164-L275 PolarHBondContact OG-O 2.94Å
165	H	88.9	Confident	83	Confident	81 Å²	81	60.7 Å²	60.7	38%	0.375	35%	0.345	S	S	.	.			trans	-85.2	-1.3	172.7	-70	-95	0	0	0	112.4	P167 F274 N311	H165-P167 WeakPolarHBondContact O-CD 3.33Å; H165-F274 HydrophobicContact CB-CD2 3.55Å; H165-F274 HydrophobicContact CB-CE2 3.66Å; H165-F274 HydrophobicContact CB-CG 4.45Å; H165-F274 WeakPolarHBondContact CB-O 3.28Å; H165-F274 PolarHBondContact N-O 2.84Å; H165-N311 PolarHBondContact ND1-O 2.85Å
166	I	85.2	Confident	82.4	Confident	27 Å²	27	63.8 Å²	63.8	14%	0.138	37%	0.365	C	S	.	.	S	Bend	trans	-68.6	125.9	175.3	-63.6	164.9	0	0	0	109	C154 I155 S164 A168 A170 F274 L275	C154-I166 HydrophobicContact CB-CD1 4.16Å; I155-I166 HydrophobicContact CG1-CD1 3.7Å; I155-I166 HydrophobicContact CG1-CG1 4.4Å; I155-I166 HydrophobicContact CG1-CG2 4.03Å; S164-I166 VanDerWaalsContact C-N 3.26Å; S164-I166 WeakPolarHBondContact OG-CB 3.41Å; S164-I166 WeakPolarHBondContact OG-CG1 3.31Å; S164-I166 PolarHBondContact OG-N 3.32Å; I166-A168 PolarHBondContact O-N 3.42Å; I166-A170 HydrophobicContact CG2-CB 3.84Å; I166-F274 HydrophobicContact CG1-CE1 3.74Å; I166-F274 HydrophobicContact CG1-CZ 3.91Å; I166-L275 HydrophobicContact CD1-CD2 3.7Å; I166-L275 HydrophobicContact CG1-CD2 4.46Å
167	P	80.9	Confident	81.9	Confident	34 Å²	34	67 Å²	67	22%	0.221	38%	0.38	C	S	.	.			trans	-63	137.5	175.7	-21.1	32.3	0	0	0	112.2	H165 Y169 A170 I313	H165-P167 WeakPolarHBondContact O-CD 3.33Å; P167-Y169 HydrophobicContact CB-CD1 3.56Å; P167-Y169 HydrophobicContact CB-CE1 3.21Å; P167-Y169 HydrophobicContact CB-CE2 4.4Å; P167-Y169 HydrophobicContact CB-CG 4.3Å; P167-Y169 HydrophobicContact CG-CE1 3.89Å; P167-Y169 PolarHBondContact O-N 2.94Å; P167-Y169 VanDerWaalsContact O-N 3.08Å; P167-A170 WeakPolarHBondContact O-CB 3.15Å; P167-A170 PolarHBondContact O-N 2.97Å; P167-I313 HydrophobicContact CG-CB 4.47Å; P167-I313 HydrophobicContact CG-CG2 3.75Å
168	A	77.9	Confident	81.2	Confident	96 Å²	96	67.1 Å²	67.1	79%	0.793	38%	0.381	S	S	*	.	H	α-helix	trans	-55.9	-31.1	-178.7	0	0	0	0	0	114	I166 A170	I166-A168 PolarHBondContact O-N 3.42Å; A168-A170 PolarHBondContact O-N 3.12Å
169	Y	77.6	Confident	80.6	Confident	136 Å²	136	65.5 Å²	65.5	53%	0.533	38%	0.377	S	S	.	.	H	α-helix	trans	-68.5	-20.3	177.2	70	-103	0	0	0	113.4	P167 A172 S173	P167-Y169 HydrophobicContact CB-CD1 3.56Å; P167-Y169 HydrophobicContact CB-CE1 3.21Å; P167-Y169 HydrophobicContact CB-CE2 4.4Å; P167-Y169 HydrophobicContact CB-CG 4.3Å; P167-Y169 HydrophobicContact CG-CE1 3.89Å; P167-Y169 PolarHBondContact O-N 2.94Å; P167-Y169 VanDerWaalsContact O-N 3.08Å; Y169-A172 PolarHBondContact O-N 3.45Å; Y169-S173 WeakPolarHBondContact O-CB 3.49Å; Y169-S173 PolarHBondContact O-N 3.22Å; Y169-S173 PolarHBondContact O-OG 3.35Å
170	A	77.5	Confident	80.3	Confident	23 Å²	23	64.2 Å²	64.2	19%	0.19	37%	0.374	C	S	.	.	H	α-helix	trans	-64.1	-43	-177.4	0	0	0	0	0	111	I155 I166 P167 A168 A172 S173 I174	I155-A170 HydrophobicContact CG2-CB 4.4Å; I166-A170 HydrophobicContact CG2-CB 3.84Å; P167-A170 WeakPolarHBondContact O-CB 3.15Å; P167-A170 PolarHBondContact O-N 2.97Å; A168-A170 PolarHBondContact O-N 3.12Å; A170-A172 VanDerWaalsContact C-N 3.34Å; A170-A172 PolarHBondContact O-N 3.44Å; A170-S173 PolarHBondContact O-N 2.73Å; A170-I174 PolarHBondContact O-N 2.73Å
171	A	70.7	Confident	80.2	Confident	37 Å²	37	63.3 Å²	63.3	31%	0.306	37%	0.37	S	S	.	.	H	α-helix	trans	-60.1	-42.3	175.1	0	0	0	0	0	112.1	I155 S173 I174	I155-A171 WeakPolarHBondContact O-CB 3.43Å; A171-S173 VanDerWaalsContact C-N 3.29Å; A171-S173 PolarHBondContact O-N 2.77Å; A171-I174 WeakPolarHBondContact O-CG2 3.36Å
172	A	70	Confident	80	Confident	79 Å²	79	66.4 Å²	66.4	65%	0.653	38%	0.383	S	S	*	.	H	α-helix	trans	-68.8	-29.3	179	0	0	0	0	0	112.7	Y169 A170	Y169-A172 PolarHBondContact O-N 3.45Å; A170-A172 VanDerWaalsContact C-N 3.34Å; A170-A172 PolarHBondContact O-N 3.44Å
173	S	73.2	Confident	80	Confident	49 Å²	49	69.2 Å²	69.2	34%	0.343	40%	0.396	S	S	.	.	H	α-helix	trans	-94.1	-21.3	-172.3	-53.8	0	0	0	0	113.5	Y169 A170 A171 R175 T176 Q177	Y169-S173 WeakPolarHBondContact O-CB 3.49Å; Y169-S173 PolarHBondContact O-N 3.22Å; Y169-S173 PolarHBondContact O-OG 3.35Å; A170-S173 PolarHBondContact O-N 2.73Å; A171-S173 VanDerWaalsContact C-N 3.29Å; A171-S173 PolarHBondContact O-N 2.77Å; S173-R175 PolarHBondContact O-N 2.99Å; S173-T176 PolarHBondContact O-N 3.02Å; S173-Q177 WeakPolarHBondContact O-CB 3.21Å; S173-Q177 PolarHBondContact O-N 2.97Å
174	I	74.8	Confident	80.2	Confident	21 Å²	21	68.2 Å²	68.2	11%	0.108	39%	0.388	C	S	.	.	H	α-helix	trans	-60.9	-43.8	-170.2	-162.7	164.8	0	0	0	112.4	I155 L156 A170 A171 T176 Q177 I178	I155-I174 HydrophobicContact CB-CD1 4.21Å; I155-I174 HydrophobicContact CD1-CD1 4.39Å; I155-I174 HydrophobicContact CG2-CB 4.36Å; I155-I174 HydrophobicContact CG2-CD1 3.68Å; I155-I174 HydrophobicContact CG2-CG2 4.45Å; L156-I174 HydrophobicContact CD2-CG2 3.55Å; A170-I174 PolarHBondContact O-N 2.73Å; A171-I174 WeakPolarHBondContact O-CG2 3.36Å; I174-T176 PolarHBondContact O-N 2.7Å; I174-Q177 PolarHBondContact O-N 3.43Å; I174-I178 HydrophobicContact CG1-CD1 3.98Å; I174-I178 VanDerWaalsContact O-CD1 3.28Å; I174-I178 WeakPolarHBondContact O-CD1 3.25Å; I174-I178 WeakPolarHBondContact O-CG1 3.32Å; I174-I178 PolarHBondContact O-N 3.49Å
175	R	69.7	Low	80.4	Confident	170 Å²	170	66.5 Å²	66.5	64%	0.642	38%	0.376	S	S	*	.	H	α-helix	trans	-63	-44	178.8	-69.6	-176.6	179.6	153.2	1.1	111.7	S173 I178 G179	S173-R175 PolarHBondContact O-N 2.99Å; R175-I178 PolarHBondContact O-N 3.12Å; R175-G179 PolarHBondContact O-N 3.03Å
176	T	76.8	Confident	80.7	Confident	91 Å²	91	64.5 Å²	64.5	56%	0.558	37%	0.373	S	S	*	.	H	α-helix	trans	-65.3	-44.7	176.9	-55.9	0	0	0	0	111.4	S173 I174 I178 G179 N180	S173-T176 PolarHBondContact O-N 3.02Å; I174-T176 PolarHBondContact O-N 2.7Å; T176-I178 VanDerWaalsContact C-N 3.26Å; T176-I178 PolarHBondContact O-N 3.36Å; T176-G179 PolarHBondContact O-N 3.09Å; T176-N180 PolarHBondContact O-N 3.31Å; T176-N180 PolarHBondContact O-ND2 2.84Å; T176-N180 PolarHBondContact O-OD1 3.34Å
177	Q	77.1	Confident	81.2	Confident	93 Å²	93	67.9 Å²	67.9	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-37	178.9	-173.6	173.2	-5.2	0	0	111.7	S173 I174 N180 T181	S173-Q177 WeakPolarHBondContact O-CB 3.21Å; S173-Q177 PolarHBondContact O-N 2.97Å; I174-Q177 PolarHBondContact O-N 3.43Å; Q177-N180 PolarHBondContact O-N 3.34Å; Q177-T181 WeakPolarHBondContact O-CB 3.38Å; Q177-T181 PolarHBondContact O-N 2.88Å; Q177-T181 PolarHBondContact O-OG1 3.46Å
178	I	74.2	Confident	81.9	Confident	27 Å²	27	67 Å²	67	14%	0.138	38%	0.381	C	S	.	.	H	α-helix	trans	-65.7	-48.8	177.2	-68.9	159	0	0	0	111.5	I174 R175 T176 N180 T181 Q182 L206 L210	I174-I178 HydrophobicContact CG1-CD1 3.98Å; I174-I178 VanDerWaalsContact O-CD1 3.28Å; I174-I178 WeakPolarHBondContact O-CD1 3.25Å; I174-I178 WeakPolarHBondContact O-CG1 3.32Å; I174-I178 PolarHBondContact O-N 3.49Å; R175-I178 PolarHBondContact O-N 3.12Å; T176-I178 VanDerWaalsContact C-N 3.26Å; T176-I178 PolarHBondContact O-N 3.36Å; I178-N180 VanDerWaalsContact C-N 3.27Å; I178-N180 PolarHBondContact O-N 3.42Å; I178-T181 PolarHBondContact O-N 3.23Å; I178-T181 VanDerWaalsContact O-N 3.12Å; I178-Q182 PolarHBondContact O-N 3.36Å; I178-L206 HydrophobicContact CG2-CD2 4.38Å; I178-L206 HydrophobicContact CG2-CG 4.46Å; I178-L210 HydrophobicContact CD1-CD1 3.45Å; I178-L210 VanDerWaalsContact CD1-CD1 3.45Å; I178-L210 HydrophobicContact CD1-CD2 3.77Å; I178-L210 HydrophobicContact CD1-CG 4.12Å; I178-L210 HydrophobicContact CG2-CD2 4.15Å
179	G	77.1	Confident	82.9	Confident	34 Å²	34	62.8 Å²	62.8	35%	0.351	35%	0.346	S	S	.	.	H	α-helix	trans	-58.9	-41.2	177.6	0	0	0	0	0	112.2	R175 T176 Q182 T183	R175-G179 PolarHBondContact O-N 3.03Å; T176-G179 PolarHBondContact O-N 3.09Å; G179-Q182 PolarHBondContact O-N 3.32Å; G179-T183 PolarHBondContact O-N 3.08Å; G179-T183 PolarHBondContact O-OG1 3.24Å; G179-T183 VanDerWaalsContact O-OG1 3.09Å
180	N	84.8	Confident	83.8	Confident	104 Å²	104	63.8 Å²	63.8	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-43.5	174.9	-66.9	-10.2	0	0	0	111.6	T176 Q177 I178 Q182 T183 E184	T176-N180 PolarHBondContact O-N 3.31Å; T176-N180 PolarHBondContact O-ND2 2.84Å; T176-N180 PolarHBondContact O-OD1 3.34Å; Q177-N180 PolarHBondContact O-N 3.34Å; I178-N180 VanDerWaalsContact C-N 3.27Å; I178-N180 PolarHBondContact O-N 3.42Å; N180-Q182 VanDerWaalsContact C-N 3.35Å; N180-Q182 PolarHBondContact O-N 2.88Å; N180-T183 PolarHBondContact O-N 2.76Å; N180-E184 WeakPolarHBondContact O-CB 3.25Å; N180-E184 PolarHBondContact O-N 3.42Å
181	T	86.8	Confident	84.7	Confident	22 Å²	22	68.2 Å²	68.2	14%	0.135	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-40.8	178.8	-57.2	0	0	0	0	111.5	Q177 I178 T183 E184 L185 L206	Q177-T181 WeakPolarHBondContact O-CB 3.38Å; Q177-T181 PolarHBondContact O-N 2.88Å; Q177-T181 PolarHBondContact O-OG1 3.46Å; I178-T181 PolarHBondContact O-N 3.23Å; I178-T181 VanDerWaalsContact O-N 3.12Å; T181-T183 PolarHBondContact O-N 3.02Å; T181-E184 PolarHBondContact O-N 3.28Å; T181-L185 HydrophobicContact CG2-CD1 3.94Å; T181-L185 HydrophobicContact CG2-CG 4.27Å; T181-L185 WeakPolarHBondContact O-CB 3.29Å; T181-L185 WeakPolarHBondContact O-CG 3.47Å; T181-L185 PolarHBondContact O-N 2.9Å; T181-L206 HydrophobicContact CG2-CD2 3.82Å
182	Q	87.3	Confident	86	Confident	95 Å²	95	67.6 Å²	67.6	44%	0.444	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-45.4	177.8	-172	176	1.1	0	0	111.7	I178 G179 N180 L185 A186 Q203	I178-Q182 PolarHBondContact O-N 3.36Å; G179-Q182 PolarHBondContact O-N 3.32Å; N180-Q182 VanDerWaalsContact C-N 3.35Å; N180-Q182 PolarHBondContact O-N 2.88Å; Q182-L185 PolarHBondContact O-N 3.04Å; Q182-A186 PolarHBondContact O-N 3.49Å; Q182-A186 VanDerWaalsContact O-N 3.13Å; Q182-Q203 PolarHBondContact O-NE2 3.25Å
183	T	90.5	Very high	87.2	Confident	100 Å²	100	68.4 Å²	68.4	61%	0.613	36%	0.362	S	S	*	.	H	α-helix	trans	-61.5	-45.9	176.6	-54.7	0	0	0	0	111.3	G179 N180 T181 L185 A186 K187	G179-T183 PolarHBondContact O-N 3.08Å; G179-T183 PolarHBondContact O-OG1 3.24Å; G179-T183 VanDerWaalsContact O-OG1 3.09Å; N180-T183 PolarHBondContact O-N 2.76Å; T181-T183 PolarHBondContact O-N 3.02Å; T183-L185 PolarHBondContact O-N 3.37Å; T183-A186 WeakPolarHBondContact O-CB 3.24Å; T183-A186 PolarHBondContact O-N 2.99Å; T183-A186 VanDerWaalsContact O-N 3.16Å; T183-K187 PolarHBondContact O-N 3.45Å; T183-K187 VanDerWaalsContact O-N 3.11Å
184	E	93.1	Very high	88.4	Confident	76 Å²	76	72.2 Å²	72.2	36%	0.355	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-42.4	179.5	-172.5	63.8	-172.6	0	0	111.9	N180 T181 A186 K187 L188	N180-E184 WeakPolarHBondContact O-CB 3.25Å; N180-E184 PolarHBondContact O-N 3.42Å; T181-E184 PolarHBondContact O-N 3.28Å; E184-A186 VanDerWaalsContact C-N 3.26Å; E184-A186 PolarHBondContact O-N 2.86Å; E184-K187 PolarHBondContact O-N 3.16Å; E184-L188 HydrophobicContact CG-CD1 4.16Å; E184-L188 WeakPolarHBondContact O-CG 3.43Å; E184-L188 PolarHBondContact O-N 3.09Å
185	L	94.6	Very high	89.5	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-34.3	175.3	-71.9	170.1	0	0	0	112.2	N78 T181 Q182 T183 A189 Y199 K202 Q203	N78-L185 HydrophobicContact CB-CD2 4.18Å; T181-L185 HydrophobicContact CG2-CD1 3.94Å; T181-L185 HydrophobicContact CG2-CG 4.27Å; T181-L185 WeakPolarHBondContact O-CB 3.29Å; T181-L185 WeakPolarHBondContact O-CG 3.47Å; T181-L185 PolarHBondContact O-N 2.9Å; Q182-L185 PolarHBondContact O-N 3.04Å; T183-L185 PolarHBondContact O-N 3.37Å; L185-A189 WeakPolarHBondContact O-CB 3.47Å; L185-A189 PolarHBondContact O-N 3.45Å; L185-Y199 HydrophobicContact CD2-CD1 3.65Å; L185-Y199 HydrophobicContact CD2-CE1 4.22Å; L185-K202 HydrophobicContact CD1-CG 4.39Å; L185-K202 HydrophobicContact CD2-CD 4.12Å; L185-Q203 HydrophobicContact CB-CG 3.57Å; L185-Q203 HydrophobicContact CD1-CG 3.69Å; L185-Q203 HydrophobicContact CG-CG 4.28Å
186	A	94.4	Very high	90.8	Very high	39 Å²	39	69 Å²	69	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-68.1	-45.7	178.5	0	0	0	0	0	110.3	Q182 T183 E184 L188 A189 E190 Q203	Q182-A186 PolarHBondContact O-N 3.49Å; Q182-A186 VanDerWaalsContact O-N 3.13Å; T183-A186 WeakPolarHBondContact O-CB 3.24Å; T183-A186 PolarHBondContact O-N 2.99Å; T183-A186 VanDerWaalsContact O-N 3.16Å; E184-A186 VanDerWaalsContact C-N 3.26Å; E184-A186 PolarHBondContact O-N 2.86Å; A186-L188 PolarHBondContact O-N 2.75Å; A186-A189 WeakPolarHBondContact O-CB 3.28Å; A186-A189 PolarHBondContact O-N 3.04Å; A186-E190 PolarHBondContact O-N 3.27Å; A186-E190 VanDerWaalsContact O-N 3.09Å; A186-Q203 VanDerWaalsContact CA-NE2 3.33Å
187	K	96.3	Very high	91.8	Very high	99 Å²	99	71 Å²	71	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-44.8	174.8	-179.8	-175.9	171	-165.8	0	111.8	T183 E184 A189 E190 Q191	T183-K187 PolarHBondContact O-N 3.45Å; T183-K187 VanDerWaalsContact O-N 3.11Å; E184-K187 PolarHBondContact O-N 3.16Å; K187-A189 VanDerWaalsContact C-N 3.29Å; K187-A189 PolarHBondContact O-N 3.31Å; K187-E190 PolarHBondContact O-N 2.97Å; K187-Q191 HydrophobicContact CG-CG 4.45Å; K187-Q191 WeakPolarHBondContact O-CB 3.46Å; K187-Q191 VanDerWaalsContact O-CG 3.27Å; K187-Q191 WeakPolarHBondContact O-CG 3.32Å; K187-Q191 PolarHBondContact O-N 3.48Å
188	L	96.8	Very high	92.8	Very high	16 Å²	16	67.3 Å²	67.3	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-62.9	-36.2	177.1	-74.1	168.2	0	0	0	112.3	N78 E184 A186 E190 Q191 N192 Y199	N78-L188 HydrophobicContact CB-CD1 3.95Å; N78-L188 WeakPolarHBondContact O-CD1 3.13Å; E184-L188 HydrophobicContact CG-CD1 4.16Å; E184-L188 WeakPolarHBondContact O-CG 3.43Å; E184-L188 PolarHBondContact O-N 3.09Å; A186-L188 PolarHBondContact O-N 2.75Å; L188-E190 VanDerWaalsContact C-N 3.34Å; L188-Q191 PolarHBondContact O-N 2.98Å; L188-N192 WeakPolarHBondContact O-CB 3.31Å; L188-N192 PolarHBondContact O-N 3Å; L188-N192 PolarHBondContact O-ND2 2.73Å; L188-Y199 HydrophobicContact CB-CD1 4.23Å; L188-Y199 HydrophobicContact CB-CD2 4.25Å; L188-Y199 HydrophobicContact CB-CE1 3.86Å; L188-Y199 HydrophobicContact CB-CE2 3.87Å; L188-Y199 HydrophobicContact CB-CG 4.41Å; L188-Y199 HydrophobicContact CD1-CE1 4Å
189	A	96.8	Very high	93.9	Very high	7 Å²	7	66 Å²	66	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-66.8	-33	175.6	0	0	0	0	0	113.2	L185 A186 K187 K196 Y199	L185-A189 WeakPolarHBondContact O-CB 3.47Å; L185-A189 PolarHBondContact O-N 3.45Å; A186-A189 WeakPolarHBondContact O-CB 3.28Å; A186-A189 PolarHBondContact O-N 3.04Å; K187-A189 VanDerWaalsContact C-N 3.29Å; K187-A189 PolarHBondContact O-N 3.31Å; A189-K196 HydrophobicContact CB-CG 4.24Å; A189-Y199 HydrophobicContact CB-CD2 4.1Å; A189-Y199 HydrophobicContact CB-CG 4.27Å
190	E	96.8	Very high	94.8	Very high	156 Å²	156	66.6 Å²	66.6	73%	0.729	35%	0.345	S	S	*	.	H	α-helix	trans	-73.5	-39.9	172.9	-69.4	174.6	-178.4	0	0	111.8	A186 K187 L188	A186-E190 PolarHBondContact O-N 3.27Å; A186-E190 VanDerWaalsContact O-N 3.09Å; K187-E190 PolarHBondContact O-N 2.97Å; L188-E190 VanDerWaalsContact C-N 3.34Å
191	Q	97.4	Very high	95.3	Very high	116 Å²	116	63.2 Å²	63.2	54%	0.542	33%	0.332	S	S	.	.	H	α-helix	trans	-75.9	-23.1	-177.4	-71	179.2	-16.5	0	0	114	K187 L188	K187-Q191 HydrophobicContact CG-CG 4.45Å; K187-Q191 WeakPolarHBondContact O-CB 3.46Å; K187-Q191 VanDerWaalsContact O-CG 3.27Å; K187-Q191 WeakPolarHBondContact O-CG 3.32Å; K187-Q191 PolarHBondContact O-N 3.48Å; L188-Q191 PolarHBondContact O-N 2.98Å
192	N	97.3	Very high	95.7	Very high	25 Å²	25	63.2 Å²	63.2	13%	0.134	33%	0.33	C	S	.	.			trans	-130.4	77.5	-177.1	-52.7	-93.3	0	0	0	109.2	P80 L188 E194 L195 K196 Y199	P80-N192 WeakPolarHBondContact CG-OD1 3.35Å; L188-N192 WeakPolarHBondContact O-CB 3.31Å; L188-N192 PolarHBondContact O-N 3Å; L188-N192 PolarHBondContact O-ND2 2.73Å; N192-E194 WeakPolarHBondContact CA-OE2 3.5Å; N192-E194 PolarHBondContact O-N 3.29Å; N192-E194 VanDerWaalsContact O-N 3.14Å; N192-L195 HydrophobicContact CB-CB 4.25Å; N192-L195 HydrophobicContact CB-CD1 4.3Å; N192-L195 PolarHBondContact O-N 2.87Å; N192-K196 PolarHBondContact O-N 3.25Å; N192-Y199 HydrophobicContact CB-CE2 4.21Å
193	P	96.6	Very high	95.9	Very high	95 Å²	95	60.4 Å²	60.4	62%	0.617	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-56.1	-30.5	-175	-26.4	35.7	0	0	0	114	L195 K196	P193-L195 VanDerWaalsContact C-N 3.26Å; P193-L195 PolarHBondContact O-N 2.94Å; P193-K196 VanDerWaalsContact O-CB 3.26Å; P193-K196 WeakPolarHBondContact O-CB 3.37Å; P193-K196 PolarHBondContact O-N 2.93Å
194	E	97.4	Very high	95.9	Very high	129 Å²	129	64.5 Å²	64.5	60%	0.603	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-69.3	-21.2	177.8	78.1	-67	170.9	0	0	113.7	N192	N192-E194 WeakPolarHBondContact CA-OE2 3.5Å; N192-E194 PolarHBondContact O-N 3.29Å; N192-E194 VanDerWaalsContact O-N 3.14Å
195	L	97.7	Very high	95.8	Very high	15 Å²	15	64.9 Å²	64.9	8%	0.079	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-107.1	3.4	177.2	-66.4	175	0	0	0	112.8	P80 M83 R84 N192 P193 D197 A198 Y199	P80-L195 HydrophobicContact CB-CD1 3.8Å; M83-L195 HydrophobicContact CB-CD1 3.91Å; M83-L195 HydrophobicContact CB-CD2 4.39Å; R84-L195 HydrophobicContact CG-CD1 4.27Å; R84-L195 HydrophobicContact CG-CD2 3.97Å; R84-L195 HydrophobicContact CG-CG 4.5Å; N192-L195 HydrophobicContact CB-CB 4.25Å; N192-L195 HydrophobicContact CB-CD1 4.3Å; N192-L195 PolarHBondContact O-N 2.87Å; P193-L195 VanDerWaalsContact C-N 3.26Å; P193-L195 PolarHBondContact O-N 2.94Å; L195-D197 VanDerWaalsContact C-N 3.32Å; L195-D197 PolarHBondContact O-N 3.43Å; L195-A198 WeakPolarHBondContact O-CB 3.4Å; L195-A198 PolarHBondContact O-N 2.92Å; L195-Y199 HydrophobicContact CB-CD2 3.84Å; L195-Y199 HydrophobicContact CB-CE2 3.5Å; L195-Y199 VanDerWaalsContact CB-CE2 3.5Å; L195-Y199 HydrophobicContact CD1-CE2 4.09Å; L195-Y199 HydrophobicContact CG-CE2 4.48Å; L195-Y199 VanDerWaalsContact O-CD2 3.25Å; L195-Y199 WeakPolarHBondContact O-CD2 3.17Å; L195-Y199 PolarHBondContact O-N 3.21Å
196	K	97.3	Very high	95.4	Very high	108 Å²	108	67.5 Å²	67.5	47%	0.47	33%	0.333	S	S	.	.	H	α-helix	trans	-52.9	-47	-172.3	-177.7	175.4	-177.6	176.5	0	112.7	A189 N192 P193 A198 Y199 I200	A189-K196 HydrophobicContact CB-CG 4.24Å; N192-K196 PolarHBondContact O-N 3.25Å; P193-K196 VanDerWaalsContact O-CB 3.26Å; P193-K196 WeakPolarHBondContact O-CB 3.37Å; P193-K196 PolarHBondContact O-N 2.93Å; K196-A198 VanDerWaalsContact C-N 3.32Å; K196-A198 PolarHBondContact O-N 3.43Å; K196-Y199 PolarHBondContact O-N 2.98Å; K196-I200 HydrophobicContact CG-CD1 3.83Å; K196-I200 VanDerWaalsContact O-CG1 3.31Å; K196-I200 WeakPolarHBondContact O-CG1 3.43Å; K196-I200 PolarHBondContact O-N 2.88Å
197	D	97.6	Very high	94.8	Very high	133 Å²	133	72.9 Å²	72.9	71%	0.711	35%	0.349	S	S	*	.	H	α-helix	trans	-65.6	-36.6	-179.5	-69.8	-21.7	0	0	0	112.2	L195 I200 A201	L195-D197 VanDerWaalsContact C-N 3.32Å; L195-D197 PolarHBondContact O-N 3.43Å; D197-I200 PolarHBondContact O-N 3.46Å; D197-A201 VanDerWaalsContact O-CB 3.28Å; D197-A201 WeakPolarHBondContact O-CB 3.22Å; D197-A201 PolarHBondContact O-N 3.2Å
198	A	97.4	Very high	94.2	Very high	16 Å²	16	71.3 Å²	71.3	13%	0.132	35%	0.351	C	S	.	.	H	α-helix	trans	-64.2	-45	176.5	0	0	0	0	0	111.4	M83 P87 L195 K196 A201 K202	M83-A198 HydrophobicContact CE-CB 3.75Å; P87-A198 HydrophobicContact CB-CB 3.9Å; L195-A198 WeakPolarHBondContact O-CB 3.4Å; L195-A198 PolarHBondContact O-N 2.92Å; K196-A198 VanDerWaalsContact C-N 3.32Å; K196-A198 PolarHBondContact O-N 3.43Å; A198-A201 PolarHBondContact O-N 3.43Å; A198-K202 WeakPolarHBondContact O-CB 3.45Å; A198-K202 PolarHBondContact O-N 3.2Å
199	Y	97.8	Very high	93.5	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.7	-43.9	176	-70.8	-58.1	0	0	0	112.6	N78 M83 L185 L188 A189 N192 L195 K196 A201 K202 Q203	N78-Y199 VanDerWaalsContact O-CE1 3.29Å; N78-Y199 WeakPolarHBondContact O-CE1 3.49Å; N78-Y199 PolarHBondContact O-OH 3.2Å; M83-Y199 HydrophobicContact CB-CE1 4.48Å; M83-Y199 HydrophobicContact CE-CD1 3.86Å; M83-Y199 HydrophobicContact CE-CE1 3.92Å; M83-Y199 HydrophobicContact CE-CG 4.48Å; M83-Y199 HydrophobicContact CG-CD1 4.49Å; M83-Y199 HydrophobicContact CG-CE1 3.61Å; M83-Y199 HydrophobicContact SD-CE1 4.13Å; L185-Y199 HydrophobicContact CD2-CD1 3.65Å; L185-Y199 HydrophobicContact CD2-CE1 4.22Å; L188-Y199 HydrophobicContact CB-CD1 4.23Å; L188-Y199 HydrophobicContact CB-CD2 4.25Å; L188-Y199 HydrophobicContact CB-CE1 3.86Å; L188-Y199 HydrophobicContact CB-CE2 3.87Å; L188-Y199 HydrophobicContact CB-CG 4.41Å; L188-Y199 HydrophobicContact CD1-CE1 4Å; A189-Y199 HydrophobicContact CB-CD2 4.1Å; A189-Y199 HydrophobicContact CB-CG 4.27Å; N192-Y199 HydrophobicContact CB-CE2 4.21Å; L195-Y199 HydrophobicContact CB-CD2 3.84Å; L195-Y199 HydrophobicContact CB-CE2 3.5Å; L195-Y199 VanDerWaalsContact CB-CE2 3.5Å; L195-Y199 HydrophobicContact CD1-CE2 4.09Å; L195-Y199 HydrophobicContact CG-CE2 4.48Å; L195-Y199 VanDerWaalsContact O-CD2 3.25Å; L195-Y199 WeakPolarHBondContact O-CD2 3.17Å; L195-Y199 PolarHBondContact O-N 3.21Å; K196-Y199 PolarHBondContact O-N 2.98Å; Y199-A201 VanDerWaalsContact C-N 3.33Å; Y199-A201 PolarHBondContact O-N 3.34Å; Y199-K202 PolarHBondContact O-N 2.95Å; Y199-Q203 WeakPolarHBondContact O-CG 3.28Å; Y199-Q203 PolarHBondContact O-N 3.45Å
200	I	95.2	Very high	92.4	Very high	46 Å²	46	76.1 Å²	76.1	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-43.8	176.4	-69.8	170	0	0	0	110.4	K196 D197 K202 Q203 R204	K196-I200 HydrophobicContact CG-CD1 3.83Å; K196-I200 VanDerWaalsContact O-CG1 3.31Å; K196-I200 WeakPolarHBondContact O-CG1 3.43Å; K196-I200 PolarHBondContact O-N 2.88Å; D197-I200 PolarHBondContact O-N 3.46Å; I200-K202 VanDerWaalsContact C-N 3.32Å; I200-K202 PolarHBondContact O-N 3.47Å; I200-Q203 PolarHBondContact O-N 3.15Å; I200-R204 WeakPolarHBondContact O-CG 3.38Å; I200-R204 PolarHBondContact O-N 3.47Å; I200-R204 VanDerWaalsContact O-N 3.08Å
201	A	95.9	Very high	91.6	Very high	34 Å²	34	76.1 Å²	76.1	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-61.5	-41.8	176.3	0	0	0	0	0	111.4	D197 A198 Y199 R204 R205	D197-A201 VanDerWaalsContact O-CB 3.28Å; D197-A201 WeakPolarHBondContact O-CB 3.22Å; D197-A201 PolarHBondContact O-N 3.2Å; A198-A201 PolarHBondContact O-N 3.43Å; Y199-A201 VanDerWaalsContact C-N 3.33Å; Y199-A201 PolarHBondContact O-N 3.34Å; A201-R204 PolarHBondContact O-N 3.45Å; A201-R205 WeakPolarHBondContact O-CG 3.43Å; A201-R205 PolarHBondContact O-N 2.79Å
202	K	94.9	Very high	90.8	Very high	21 Å²	21	73.6 Å²	73.6	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-42.9	176.6	-166.6	171.2	-166	176.4	0	112.6	H77 N78 M83 A88 G89 L185 A198 Y199 I200 R204 R205 L206	H77-K202 PolarHBondContact CD2-NZ 3.13Å; H77-K202 PolarHBondContact O-NZ 3.43Å; H77-K202 VanDerWaalsContact O-NZ 3.13Å; N78-K202 VanDerWaalsContact OD1-CE 3.27Å; N78-K202 WeakPolarHBondContact OD1-CE 3.39Å; N78-K202 PolarHBondContact OD1-NZ 2.91Å; M83-K202 HydrophobicContact CE-CD 4.45Å; M83-K202 HydrophobicContact SD-CD 4.26Å; A88-K202 WeakPolarHBondContact O-CE 3.19Å; G89-K202 VanDerWaalsContact CA-NZ 3.32Å; G89-K202 PolarHBondContact O-NZ 3.26Å; L185-K202 HydrophobicContact CD1-CG 4.39Å; L185-K202 HydrophobicContact CD2-CD 4.12Å; A198-K202 WeakPolarHBondContact O-CB 3.45Å; A198-K202 PolarHBondContact O-N 3.2Å; Y199-K202 PolarHBondContact O-N 2.95Å; I200-K202 VanDerWaalsContact C-N 3.32Å; I200-K202 PolarHBondContact O-N 3.47Å; K202-R204 VanDerWaalsContact C-N 3.34Å; K202-R204 PolarHBondContact O-N 3.44Å; K202-R205 VanDerWaalsContact CA-NH2 3.35Å; K202-R205 PolarHBondContact O-N 3.43Å; K202-L206 PolarHBondContact O-N 3.12Å
203	Q	92	Very high	90.3	Very high	37 Å²	37	73 Å²	73	17%	0.173	36%	0.356	C	S	.	.	H	α-helix	trans	-58.6	-44.3	174.4	-74.6	179.4	-21.1	0	0	112.2	Q182 L185 A186 Y199 I200 L206 K207	Q182-Q203 PolarHBondContact O-NE2 3.25Å; L185-Q203 HydrophobicContact CB-CG 3.57Å; L185-Q203 HydrophobicContact CD1-CG 3.69Å; L185-Q203 HydrophobicContact CG-CG 4.28Å; A186-Q203 VanDerWaalsContact CA-NE2 3.33Å; Y199-Q203 WeakPolarHBondContact O-CG 3.28Å; Y199-Q203 PolarHBondContact O-N 3.45Å; I200-Q203 PolarHBondContact O-N 3.15Å; Q203-L206 PolarHBondContact O-N 3.42Å; Q203-K207 PolarHBondContact O-N 3.32Å; Q203-K207 VanDerWaalsContact O-N 3.11Å
204	R	91.2	Very high	89.7	Confident	186 Å²	186	71.2 Å²	71.2	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-61.2	-45.5	177.6	-69.7	175	-174.3	175.9	3.9	111.5	I200 A201 K202 K207 S208	I200-R204 WeakPolarHBondContact O-CG 3.38Å; I200-R204 PolarHBondContact O-N 3.47Å; I200-R204 VanDerWaalsContact O-N 3.08Å; A201-R204 PolarHBondContact O-N 3.45Å; K202-R204 VanDerWaalsContact C-N 3.34Å; K202-R204 PolarHBondContact O-N 3.44Å; R204-K207 PolarHBondContact O-N 3.32Å; R204-S208 PolarHBondContact O-N 3.08Å; R204-S208 VanDerWaalsContact O-N 3.16Å
205	R	90.4	Very high	89.4	Confident	84 Å²	84	68.4 Å²	68.4	32%	0.317	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-47.2	176.5	-71.4	-170.6	-60.7	-86.5	0.1	112	A88 A201 K202 K207 S208 K209	A88-R205 PolarHBondContact O-NH2 2.95Å; A201-R205 WeakPolarHBondContact O-CG 3.43Å; A201-R205 PolarHBondContact O-N 2.79Å; K202-R205 VanDerWaalsContact CA-NH2 3.35Å; K202-R205 PolarHBondContact O-N 3.43Å; R205-K207 VanDerWaalsContact C-N 3.31Å; R205-K207 PolarHBondContact O-N 3.35Å; R205-S208 PolarHBondContact O-N 3.3Å; R205-K209 PolarHBondContact O-N 2.9Å
206	L	85.6	Confident	89.1	Confident	55 Å²	55	70 Å²	70	29%	0.288	34%	0.338	S	S	.	.	H	α-helix	trans	-58.3	-43.4	180	-179.5	62	0	0	0	111.7	I178 T181 K202 Q203 L210	I178-L206 HydrophobicContact CG2-CD2 4.38Å; I178-L206 HydrophobicContact CG2-CG 4.46Å; T181-L206 HydrophobicContact CG2-CD2 3.82Å; K202-L206 PolarHBondContact O-N 3.12Å; Q203-L206 PolarHBondContact O-N 3.42Å; L206-L210 PolarHBondContact O-N 2.57Å
207	K	82.6	Confident	88.9	Confident	152 Å²	152	73.3 Å²	73.3	66%	0.661	35%	0.353	S	S	*	.	H	α-helix	trans	-64.9	-41.9	178.8	-172.2	177.5	178.9	-178.2	0	112.4	Q203 R204 R205 F211	Q203-K207 PolarHBondContact O-N 3.32Å; Q203-K207 VanDerWaalsContact O-N 3.11Å; R204-K207 PolarHBondContact O-N 3.32Å; R205-K207 VanDerWaalsContact C-N 3.31Å; R205-K207 PolarHBondContact O-N 3.35Å; K207-F211 PolarHBondContact O-N 3.07Å
208	S	83.8	Confident	88.6	Confident	66 Å²	66	71.2 Å²	71.2	46%	0.462	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-53.3	178.2	-164.2	0	0	0	0	111.3	R204 R205 L210 F211 D212	R204-S208 PolarHBondContact O-N 3.08Å; R204-S208 VanDerWaalsContact O-N 3.16Å; R205-S208 PolarHBondContact O-N 3.3Å; S208-L210 VanDerWaalsContact C-N 3.27Å; S208-L210 PolarHBondContact O-N 2.72Å; S208-F211 PolarHBondContact O-N 3.34Å; S208-F211 VanDerWaalsContact O-N 3.09Å; S208-D212 PolarHBondContact O-N 3.07Å; S208-D212 VanDerWaalsContact O-N 3.14Å
209	K	82.4	Confident	88.5	Confident	70 Å²	70	70.5 Å²	70.5	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-55.2	-42.5	-177.2	-74.4	-169.1	177.1	-161.7	0	112	E90 D148 R205 F211 D212 H213	E90-K209 IonicContact OE1-NZ 2.88Å; D148-K209 WeakPolarHBondContact OD2-CE 3.48Å; D148-K209 IonicContact OD2-NZ 2.75Å; D148-K209 PolarHBondContact OD2-NZ 3.4Å; R205-K209 PolarHBondContact O-N 2.9Å; K209-F211 PolarHBondContact O-N 3.48Å; K209-D212 PolarHBondContact O-N 2.72Å; K209-H213 VanDerWaalsContact O-CB 3.27Å; K209-H213 WeakPolarHBondContact O-CB 3.16Å; K209-H213 PolarHBondContact O-CD2 2.97Å; K209-H213 PolarHBondContact O-N 3.27Å; K209-H213 PolarHBondContact O-ND1 3.11Å
210	L	73.3	Confident	88.3	Confident	54 Å²	54	76.3 Å²	76.3	28%	0.283	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-47.5	179.2	-179.1	65.3	0	0	0	112.6	L156 I178 L206 S208 D212 H213 D214	L156-L210 HydrophobicContact CD1-CD1 4.18Å; I178-L210 HydrophobicContact CD1-CD1 3.45Å; I178-L210 VanDerWaalsContact CD1-CD1 3.45Å; I178-L210 HydrophobicContact CD1-CD2 3.77Å; I178-L210 HydrophobicContact CD1-CG 4.12Å; I178-L210 HydrophobicContact CG2-CD2 4.15Å; L206-L210 PolarHBondContact O-N 2.57Å; S208-L210 VanDerWaalsContact C-N 3.27Å; S208-L210 PolarHBondContact O-N 2.72Å; L210-D212 VanDerWaalsContact C-N 3.27Å; L210-D212 PolarHBondContact O-N 3.25Å; L210-H213 PolarHBondContact O-N 3.43Å; L210-D214 PolarHBondContact O-N 3.44Å
211	F	79	Confident	88.3	Confident	157 Å²	157	79.9 Å²	79.9	69%	0.689	37%	0.369	S	S	*	.	H	α-helix	trans	-61	-42.6	-177.6	-178.2	-94.5	0	0	0	110.9	K207 S208 K209	K207-F211 PolarHBondContact O-N 3.07Å; S208-F211 PolarHBondContact O-N 3.34Å; S208-F211 VanDerWaalsContact O-N 3.09Å; K209-F211 PolarHBondContact O-N 3.48Å
212	D	82.1	Confident	88.3	Confident	62 Å²	62	78.7 Å²	78.7	33%	0.332	36%	0.358	S	S	.	.	H	α-helix	trans	-68.1	-42.5	178.6	-61	-33.9	0	0	0	110.9	S208 K209 L210 D214 N215 Y218	S208-D212 PolarHBondContact O-N 3.07Å; S208-D212 VanDerWaalsContact O-N 3.14Å; K209-D212 PolarHBondContact O-N 2.72Å; L210-D212 VanDerWaalsContact C-N 3.27Å; L210-D212 PolarHBondContact O-N 3.25Å; D212-D214 PolarHBondContact O-N 3.2Å; D212-N215 WeakPolarHBondContact O-CB 3.44Å; D212-N215 PolarHBondContact O-N 3.19Å; D212-Y218 HydrophobicContact CB-CD1 4.47Å; D212-Y218 HydrophobicContact CB-CE1 4.28Å; D212-Y218 VanDerWaalsContact O-CD1 3.25Å; D212-Y218 WeakPolarHBondContact O-CD1 3.41Å
213	H	85.7	Confident	88.3	Confident	12 Å²	12	77.8 Å²	77.8	6%	0.056	35%	0.354	C	S	.	.	H	α-helix	trans	-75.8	-22.6	-175.2	-59.2	171.9	0	0	0	114.2	D148 H152 K209 L210 N215	D148-H213 IonicContact OD2-CE1 3.68Å; H152-H213 HydrophobicContact CB-CB 3.82Å; H152-H213 WeakPolarHBondContact CB-ND1 3.17Å; H152-H213 AromaticContact CE1-ND1 3.99Å; H152-H213 AromaticContact CG-ND1 3.5Å; H152-H213 AromaticContact ND1-CE1 3.36Å; H152-H213 PolarHBondContact ND1-CE1 3.23Å; H152-H213 AromaticContact ND1-ND1 2.91Å; H152-H213 PolarHBondContact ND1-ND1 3.25Å; K209-H213 VanDerWaalsContact O-CB 3.27Å; K209-H213 WeakPolarHBondContact O-CB 3.16Å; K209-H213 PolarHBondContact O-CD2 2.97Å; K209-H213 PolarHBondContact O-N 3.27Å; K209-H213 PolarHBondContact O-ND1 3.11Å; L210-H213 PolarHBondContact O-N 3.43Å; H213-N215 VanDerWaalsContact C-N 3.27Å
214	D	85.1	Confident	88.4	Confident	59 Å²	59	80.3 Å²	80.3	32%	0.316	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-11.2	172.9	-160	22.4	0	0	0	112.4	L156 H157 L210 D212 M216	L156-D214 HydrophobicContact CD1-CB 4.05Å; H157-D214 IonicContact CE1-OD1 2.79Å; H157-D214 PolarHBondContact CE1-OD1 3.49Å; H157-D214 VanDerWaalsContact CE1-OD1 3.23Å; H157-D214 PolarHBondContact NE2-O 2.92Å; H157-D214 IonicContact NE2-OD1 3.74Å; H157-D214 PolarHBondContact NE2-OD1 3.33Å; H157-D214 VanDerWaalsContact NE2-OD1 3.09Å; L210-D214 PolarHBondContact O-N 3.44Å; D212-D214 PolarHBondContact O-N 3.2Å; D214-M216 PolarHBondContact O-N 2.99Å; D214-M216 VanDerWaalsContact O-N 3.15Å
215	N	90.4	Very high	88.7	Confident	69 Å²	69	75.6 Å²	75.6	37%	0.369	35%	0.354	S	S	.	.			trans	-79	101.8	-178.3	-176.2	-22.1	0	0	0	111.6	D212 H213 K217 Y218 L219	D212-N215 WeakPolarHBondContact O-CB 3.44Å; D212-N215 PolarHBondContact O-N 3.19Å; H213-N215 VanDerWaalsContact C-N 3.27Å; N215-K217 VanDerWaalsContact C-N 3.26Å; N215-K217 PolarHBondContact O-N 3.04Å; N215-K217 WeakPolarHBondContact OD1-CB 3.45Å; N215-K217 PolarHBondContact OD1-N 2.64Å; N215-Y218 WeakPolarHBondContact O-CB 3.25Å; N215-Y218 PolarHBondContact O-N 2.88Å; N215-Y218 VanDerWaalsContact O-N 3.07Å; N215-Y218 PolarHBondContact OD1-N 3.17Å; N215-L219 PolarHBondContact O-N 3.35Å
216	M	91.6	Very high	89	Confident	48 Å²	48	71.6 Å²	71.6	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-56.7	-33.4	179.9	-175.8	56.4	65.4	0	0	114.2	H157 I160 D214 K220	H157-M216 HydrophobicContact CB-CE 3.5Å; H157-M216 VanDerWaalsContact ND1-CE 3.32Å; H157-M216 WeakPolarHBondContact ND1-CE 3.4Å; I160-M216 HydrophobicContact CG2-CE 4.15Å; I160-M216 HydrophobicContact CG2-SD 4.37Å; D214-M216 PolarHBondContact O-N 2.99Å; D214-M216 VanDerWaalsContact O-N 3.15Å; M216-K220 HydrophobicContact CG-CD 4.35Å; M216-K220 WeakPolarHBondContact O-CB 3.17Å; M216-K220 VanDerWaalsContact O-CG 3.26Å; M216-K220 WeakPolarHBondContact O-CG 3.4Å; M216-K220 PolarHBondContact O-N 2.97Å; M216-K220 HydrophobicContact SD-CD 4.47Å; M216-K220 HydrophobicContact SD-CG 4.17Å
217	K	93.1	Very high	89.5	Confident	178 Å²	178	71.9 Å²	71.9	77%	0.774	34%	0.339	S	S	*	.	H	α-helix	trans	-69.1	-42	177.8	-177.1	180	177.5	-178.4	0	110.9	N215 K221	N215-K217 VanDerWaalsContact C-N 3.26Å; N215-K217 PolarHBondContact O-N 3.04Å; N215-K217 WeakPolarHBondContact OD1-CB 3.45Å; N215-K217 PolarHBondContact OD1-N 2.64Å; K217-K221 PolarHBondContact O-N 3.11Å
218	Y	92.3	Very high	90.2	Very high	89 Å²	89	67.7 Å²	67.7	35%	0.349	33%	0.329	S	S	.	.	H	α-helix	trans	-65.7	-47.5	174.8	177.1	-114.3	0	0	0	111.1	D212 N215 K220 K221 L222	D212-Y218 HydrophobicContact CB-CD1 4.47Å; D212-Y218 HydrophobicContact CB-CE1 4.28Å; D212-Y218 VanDerWaalsContact O-CD1 3.25Å; D212-Y218 WeakPolarHBondContact O-CD1 3.41Å; N215-Y218 WeakPolarHBondContact O-CB 3.25Å; N215-Y218 PolarHBondContact O-N 2.88Å; N215-Y218 VanDerWaalsContact O-N 3.07Å; N215-Y218 PolarHBondContact OD1-N 3.17Å; Y218-K220 PolarHBondContact O-N 2.9Å; Y218-K221 WeakPolarHBondContact O-CB 3.42Å; Y218-K221 PolarHBondContact O-N 3.06Å; Y218-K221 VanDerWaalsContact O-N 3.14Å; Y218-L222 HydrophobicContact CD1-CD1 4.02Å; Y218-L222 HydrophobicContact CD1-CG 4.48Å; Y218-L222 HydrophobicContact CD2-CG 4.49Å; Y218-L222 HydrophobicContact CE1-CD1 3.47Å; Y218-L222 VanDerWaalsContact CE1-CD1 3.47Å; Y218-L222 HydrophobicContact CE1-CG 4.16Å; Y218-L222 HydrophobicContact CE2-CD1 4.29Å; Y218-L222 HydrophobicContact CE2-CD2 4.02Å; Y218-L222 HydrophobicContact CE2-CG 4.13Å; Y218-L222 WeakPolarHBondContact O-CG 3.32Å; Y218-L222 PolarHBondContact O-N 3.09Å
219	L	93.4	Very high	90.9	Very high	2 Å²	2	65 Å²	65	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-58.4	-44.4	178.3	-177.1	59.3	0	0	0	112.2	I160 N215 K221 L222 L223	I160-L219 HydrophobicContact CD1-CD2 3.52Å; I160-L219 HydrophobicContact CD1-CG 4.29Å; N215-L219 PolarHBondContact O-N 3.35Å; L219-K221 PolarHBondContact O-N 2.85Å; L219-L222 PolarHBondContact O-N 3.48Å; L219-L223 HydrophobicContact CD1-CD1 4.46Å; L219-L223 HydrophobicContact CD1-CG 4.42Å; L219-L223 HydrophobicContact CG-CD1 4.13Å; L219-L223 VanDerWaalsContact O-CG 3.3Å; L219-L223 WeakPolarHBondContact O-CG 3.38Å; L219-L223 PolarHBondContact O-N 2.83Å
220	K	93.8	Very high	91.6	Very high	122 Å²	122	61.7 Å²	61.7	53%	0.53	30%	0.296	S	S	.	.	H	α-helix	trans	-57.4	-47.6	174.5	-78	177.6	179.3	-174.7	0	112.1	M216 Y218 L222 L223 D224	M216-K220 HydrophobicContact CG-CD 4.35Å; M216-K220 WeakPolarHBondContact O-CB 3.17Å; M216-K220 VanDerWaalsContact O-CG 3.26Å; M216-K220 WeakPolarHBondContact O-CG 3.4Å; M216-K220 PolarHBondContact O-N 2.97Å; M216-K220 HydrophobicContact SD-CD 4.47Å; M216-K220 HydrophobicContact SD-CG 4.17Å; Y218-K220 PolarHBondContact O-N 2.9Å; K220-L222 VanDerWaalsContact C-N 3.3Å; K220-L222 PolarHBondContact O-N 3.15Å; K220-L223 PolarHBondContact O-N 3.25Å; K220-L223 VanDerWaalsContact O-N 3.09Å; K220-D224 PolarHBondContact O-N 3.49Å
221	K	95.6	Very high	92.8	Very high	121 Å²	121	62.8 Å²	62.8	53%	0.526	30%	0.302	S	S	.	.	H	α-helix	trans	-55.5	-46.3	176.3	-178.4	-172.7	168.9	-164.1	0	111.5	K217 Y218 L219 L223 D224 E225	K217-K221 PolarHBondContact O-N 3.11Å; Y218-K221 WeakPolarHBondContact O-CB 3.42Å; Y218-K221 PolarHBondContact O-N 3.06Å; Y218-K221 VanDerWaalsContact O-N 3.14Å; L219-K221 PolarHBondContact O-N 2.85Å; K221-L223 VanDerWaalsContact C-N 3.32Å; K221-L223 PolarHBondContact O-N 2.89Å; K221-D224 PolarHBondContact O-N 3.28Å; K221-E225 WeakPolarHBondContact CE-OE1 3.25Å; K221-E225 IonicContact NZ-OE1 3.16Å; K221-E225 WeakPolarHBondContact O-CG 3.04Å; K221-E225 PolarHBondContact O-N 3Å
222	L	95.5	Very high	93.7	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-35.7	178.4	-63.8	-177.4	0	0	0	112.8	P146 A149 Y150 Y218 L219 K220 L226	P146-L222 HydrophobicContact CB-CD1 4.49Å; P146-L222 HydrophobicContact CG-CD1 3.77Å; P146-L222 HydrophobicContact CG-CD2 3.81Å; P146-L222 HydrophobicContact CG-CG 4.26Å; A149-L222 HydrophobicContact CB-CD1 3.5Å; A149-L222 VanDerWaalsContact CB-CD1 3.5Å; Y150-L222 HydrophobicContact CD1-CB 4.39Å; Y150-L222 HydrophobicContact CE1-CB 3.55Å; Y150-L222 WeakPolarHBondContact CE1-O 3.4Å; Y150-L222 PolarHBondContact OH-O 3.35Å; Y218-L222 HydrophobicContact CD1-CD1 4.02Å; Y218-L222 HydrophobicContact CD1-CG 4.48Å; Y218-L222 HydrophobicContact CD2-CG 4.49Å; Y218-L222 HydrophobicContact CE1-CD1 3.47Å; Y218-L222 VanDerWaalsContact CE1-CD1 3.47Å; Y218-L222 HydrophobicContact CE1-CG 4.16Å; Y218-L222 HydrophobicContact CE2-CD1 4.29Å; Y218-L222 HydrophobicContact CE2-CD2 4.02Å; Y218-L222 HydrophobicContact CE2-CG 4.13Å; Y218-L222 WeakPolarHBondContact O-CG 3.32Å; Y218-L222 PolarHBondContact O-N 3.09Å; L219-L222 PolarHBondContact O-N 3.48Å; K220-L222 VanDerWaalsContact C-N 3.3Å; K220-L222 PolarHBondContact O-N 3.15Å; L222-L226 PolarHBondContact O-N 3.35Å
223	L	95.2	Very high	94.5	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-36.1	177.1	-69.6	170.8	0	0	0	111.4	Y150 I160 L219 K220 K221 L226 E227 L277 Y281	Y150-L223 HydrophobicContact CD1-CD2 3.91Å; Y150-L223 HydrophobicContact CE1-CD2 4.17Å; I160-L223 HydrophobicContact CD1-CD1 4.13Å; L219-L223 HydrophobicContact CD1-CD1 4.46Å; L219-L223 HydrophobicContact CD1-CG 4.42Å; L219-L223 HydrophobicContact CG-CD1 4.13Å; L219-L223 VanDerWaalsContact O-CG 3.3Å; L219-L223 WeakPolarHBondContact O-CG 3.38Å; L219-L223 PolarHBondContact O-N 2.83Å; K220-L223 PolarHBondContact O-N 3.25Å; K220-L223 VanDerWaalsContact O-N 3.09Å; K221-L223 VanDerWaalsContact C-N 3.32Å; K221-L223 PolarHBondContact O-N 2.89Å; L223-L226 WeakPolarHBondContact O-CB 3.37Å; L223-L226 PolarHBondContact O-N 3.43Å; L223-E227 WeakPolarHBondContact O-CG 3.29Å; L223-E227 PolarHBondContact O-N 2.81Å; L223-E227 VanDerWaalsContact O-N 3.08Å; L223-L277 HydrophobicContact CD2-CD1 4.27Å; L223-Y281 WeakPolarHBondContact CA-OH 3.35Å; L223-Y281 WeakPolarHBondContact CB-OH 3.25Å; L223-Y281 HydrophobicContact CD2-CE2 4.49Å; L223-Y281 VanDerWaalsContact CD2-OH 3.3Å; L223-Y281 WeakPolarHBondContact CD2-OH 3.33Å; L223-Y281 PolarHBondContact O-OH 3.44Å
224	D	94.9	Very high	95.1	Very high	90 Å²	90	56.1 Å²	56.1	48%	0.481	27%	0.271	S	S	.	.	H	α-helix	trans	-69	-39.2	174.5	-58.7	-17.9	0	0	0	110.9	K220 K221 L226 E227 S228 R280	K220-D224 PolarHBondContact O-N 3.49Å; K221-D224 PolarHBondContact O-N 3.28Å; D224-L226 VanDerWaalsContact C-N 3.31Å; D224-L226 PolarHBondContact O-N 2.61Å; D224-E227 WeakPolarHBondContact O-CB 3.47Å; D224-E227 PolarHBondContact O-N 3.16Å; D224-E227 VanDerWaalsContact O-N 3.14Å; D224-S228 PolarHBondContact O-N 3.41Å; D224-R280 IonicContact OD1-NH2 2.64Å
225	E	96.4	Very high	95.7	Very high	86 Å²	86	57.5 Å²	57.5	40%	0.402	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-40.2	171.7	-74	172.3	178.3	0	0	111.6	K221 E227 S228 V229	K221-E225 WeakPolarHBondContact CE-OE1 3.25Å; K221-E225 IonicContact NZ-OE1 3.16Å; K221-E225 WeakPolarHBondContact O-CG 3.04Å; K221-E225 PolarHBondContact O-N 3Å; E225-E227 VanDerWaalsContact C-N 3.29Å; E225-E227 PolarHBondContact O-N 3.39Å; E225-S228 WeakPolarHBondContact O-CB 3.36Å; E225-S228 PolarHBondContact O-N 2.83Å; E225-V229 PolarHBondContact O-N 3.34Å; E225-V229 VanDerWaalsContact O-N 3.11Å
226	L	97.3	Very high	96.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-35.8	173.6	179.4	58.9	0	0	0	111.8	L145 Y150 L222 L223 D224 S228 V229 M230 L272 Y281	L145-L226 HydrophobicContact CD1-CD1 3.74Å; L145-L226 HydrophobicContact CD2-CD1 3.81Å; L145-L226 HydrophobicContact CG-CD1 4.44Å; Y150-L226 HydrophobicContact CE1-CB 4.47Å; Y150-L226 HydrophobicContact CE1-CD2 4.43Å; Y150-L226 HydrophobicContact CE2-CD2 4.19Å; L222-L226 PolarHBondContact O-N 3.35Å; L223-L226 WeakPolarHBondContact O-CB 3.37Å; L223-L226 PolarHBondContact O-N 3.43Å; D224-L226 VanDerWaalsContact C-N 3.31Å; D224-L226 PolarHBondContact O-N 2.61Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 3.14Å; L226-V229 PolarHBondContact O-N 3.17Å; L226-M230 HydrophobicContact CD1-CG 4.12Å; L226-M230 HydrophobicContact CD1-SD 4.44Å; L226-M230 HydrophobicContact CG-CG 4.34Å; L226-M230 VanDerWaalsContact O-CG 3.23Å; L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 2.94Å; L226-L272 HydrophobicContact CD1-CD1 4.3Å; L226-L272 HydrophobicContact CD2-CD1 3.97Å; L226-L272 HydrophobicContact CD2-CD2 3.64Å; L226-L272 HydrophobicContact CD2-CG 4.47Å; L226-Y281 HydrophobicContact CB-CE1 3.91Å; L226-Y281 HydrophobicContact CD2-CD1 4.42Å; L226-Y281 HydrophobicContact CD2-CD2 4.23Å; L226-Y281 HydrophobicContact CD2-CE1 3.82Å; L226-Y281 HydrophobicContact CD2-CE2 3.64Å; L226-Y281 VanDerWaalsContact CD2-CZ 3.41Å; L226-Y281 HydrophobicContact CG-CD1 4.08Å; L226-Y281 HydrophobicContact CG-CE1 3.51Å; L226-Y281 HydrophobicContact CG-CE2 4.28Å
227	E	96.5	Very high	96.3	Very high	61 Å²	61	53 Å²	53	29%	0.285	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-44.5	175.8	-70.6	179.8	-176.6	0	0	110.8	L223 D224 E225 V229 M230 D231 R280 Y281	L223-E227 WeakPolarHBondContact O-CG 3.29Å; L223-E227 PolarHBondContact O-N 2.81Å; L223-E227 VanDerWaalsContact O-N 3.08Å; D224-E227 WeakPolarHBondContact O-CB 3.47Å; D224-E227 PolarHBondContact O-N 3.16Å; D224-E227 VanDerWaalsContact O-N 3.14Å; E225-E227 VanDerWaalsContact C-N 3.29Å; E225-E227 PolarHBondContact O-N 3.39Å; E227-V229 PolarHBondContact O-N 3.04Å; E227-M230 PolarHBondContact O-N 3.14Å; E227-D231 PolarHBondContact O-N 3.37Å; E227-R280 IonicContact OE1-CZ 3.35Å; E227-R280 VanDerWaalsContact OE1-CZ 3.22Å; E227-R280 IonicContact OE1-NE 3.55Å; E227-R280 PolarHBondContact OE1-NE 2.86Å; E227-R280 IonicContact OE1-NH2 2.99Å; E227-R280 PolarHBondContact OE1-NH2 3.09Å; E227-Y281 HydrophobicContact CB-CE1 4.23Å; E227-Y281 HydrophobicContact CG-CD1 4.08Å; E227-Y281 HydrophobicContact CG-CE1 3.4Å; E227-Y281 VanDerWaalsContact CG-CE1 3.4Å
228	S	97.2	Very high	96.4	Very high	64 Å²	64	48.8 Å²	48.8	45%	0.448	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-39.8	175.9	178.4	0	0	0	0	113.1	D224 E225 L226 M230 D231 Q232	D224-S228 PolarHBondContact O-N 3.41Å; E225-S228 WeakPolarHBondContact O-CB 3.36Å; E225-S228 PolarHBondContact O-N 2.83Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 3.14Å; S228-M230 VanDerWaalsContact C-N 3.35Å; S228-D231 PolarHBondContact O-N 3.01Å; S228-Q232 WeakPolarHBondContact O-CG 3.32Å; S228-Q232 PolarHBondContact O-N 2.86Å; S228-Q232 VanDerWaalsContact O-N 3.15Å; S228-Q232 PolarHBondContact O-NE2 3.19Å
229	V	98.3	Very high	96.5	Very high	11 Å²	11	49.3 Å²	49.3	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-42.2	174.8	172.9	0	0	0	0	110.7	L141 L142 L145 E225 L226 E227 D231 Q232 V233	L141-V229 HydrophobicContact CD1-CG2 3.94Å; L141-V229 HydrophobicContact CD2-CG1 4.09Å; L141-V229 HydrophobicContact CG-CG1 3.96Å; L141-V229 HydrophobicContact CG-CG2 4.23Å; L142-V229 HydrophobicContact CD2-CG1 4.24Å; L145-V229 HydrophobicContact CD1-CG1 4.25Å; L145-V229 HydrophobicContact CD2-CB 4.35Å; L145-V229 HydrophobicContact CD2-CG1 4.46Å; L145-V229 HydrophobicContact CD2-CG2 3.98Å; E225-V229 PolarHBondContact O-N 3.34Å; E225-V229 VanDerWaalsContact O-N 3.11Å; L226-V229 PolarHBondContact O-N 3.17Å; E227-V229 PolarHBondContact O-N 3.04Å; V229-D231 VanDerWaalsContact C-N 3.33Å; V229-D231 PolarHBondContact O-N 3.23Å; V229-Q232 WeakPolarHBondContact O-CB 3.31Å; V229-Q232 PolarHBondContact O-N 3.39Å; V229-V233 WeakPolarHBondContact O-CG2 3.2Å; V229-V233 PolarHBondContact O-N 2.74Å
230	M	98.1	Very high	96.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-34	178.6	-67.9	-57.4	-51.7	0	0	112.6	L226 E227 S228 V233 E234 L269 L272 Y281 W282 V290	L226-M230 HydrophobicContact CD1-CG 4.12Å; L226-M230 HydrophobicContact CD1-SD 4.44Å; L226-M230 HydrophobicContact CG-CG 4.34Å; L226-M230 VanDerWaalsContact O-CG 3.23Å; L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 2.94Å; E227-M230 PolarHBondContact O-N 3.14Å; S228-M230 VanDerWaalsContact C-N 3.35Å; M230-V233 PolarHBondContact O-N 3.01Å; M230-E234 WeakPolarHBondContact O-CB 3.29Å; M230-E234 PolarHBondContact O-N 3.36Å; M230-L269 HydrophobicContact CE-CD2 3.71Å; M230-L269 HydrophobicContact SD-CD2 4.22Å; M230-L272 HydrophobicContact SD-CD1 4.46Å; M230-Y281 HydrophobicContact CB-CD1 4.28Å; M230-Y281 HydrophobicContact CG-CD1 3.69Å; M230-Y281 HydrophobicContact CG-CE1 4.48Å; M230-Y281 HydrophobicContact CG-CG 4.23Å; M230-W282 HydrophobicContact CE-CE3 4.39Å; M230-V290 HydrophobicContact CE-CB 4.39Å; M230-V290 HydrophobicContact CE-CG1 3.63Å; M230-V290 HydrophobicContact CE-CG2 3.94Å
231	D	97.9	Very high	96.3	Very high	76 Å²	76	46.4 Å²	46.4	41%	0.406	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-40.7	172.3	-71.2	-22.1	0	0	0	112.3	E227 S228 V229 E234 T235 R287	E227-D231 PolarHBondContact O-N 3.37Å; S228-D231 PolarHBondContact O-N 3.01Å; V229-D231 VanDerWaalsContact C-N 3.33Å; V229-D231 PolarHBondContact O-N 3.23Å; D231-E234 PolarHBondContact O-N 3.25Å; D231-T235 WeakPolarHBondContact O-CB 3.26Å; D231-T235 PolarHBondContact O-N 3.21Å; D231-T235 PolarHBondContact O-OG1 3.25Å; D231-R287 IonicContact OD1-CZ 2.81Å; D231-R287 IonicContact OD1-NE 2.61Å; D231-R287 PolarHBondContact OD1-NE 3.32Å; D231-R287 IonicContact OD1-NH2 2.69Å; D231-R287 PolarHBondContact OD1-NH2 2.86Å; D231-R287 IonicContact OD2-NH2 3.78Å
232	Q	98.4	Very high	96	Very high	66 Å²	66	47 Å²	47	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-39.1	175.7	-71.8	172.5	72	0	0	112.1	Y138 L141 S228 V229 E236	Y138-Q232 PolarHBondContact OH-O 3.14Å; L141-Q232 HydrophobicContact CD2-CB 4.24Å; S228-Q232 WeakPolarHBondContact O-CG 3.32Å; S228-Q232 PolarHBondContact O-N 2.86Å; S228-Q232 VanDerWaalsContact O-N 3.15Å; S228-Q232 PolarHBondContact O-NE2 3.19Å; V229-Q232 WeakPolarHBondContact O-CB 3.31Å; V229-Q232 PolarHBondContact O-N 3.39Å; Q232-E236 WeakPolarHBondContact O-CB 3.29Å; Q232-E236 PolarHBondContact O-N 3.38Å
233	V	98.5	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.2	-46.4	175.4	173.2	0	0	0	0	111	Y138 L142 V229 M230 T235 E236 L237 L253 L265 V290	Y138-V233 HydrophobicContact CD1-CG2 4.33Å; Y138-V233 HydrophobicContact CE1-CG2 4.24Å; L142-V233 HydrophobicContact CD2-CG2 4.36Å; V229-V233 WeakPolarHBondContact O-CG2 3.2Å; V229-V233 PolarHBondContact O-N 2.74Å; M230-V233 PolarHBondContact O-N 3.01Å; V233-T235 PolarHBondContact O-N 2.99Å; V233-E236 PolarHBondContact O-N 3.48Å; V233-L237 HydrophobicContact CG1-CD1 3.79Å; V233-L237 HydrophobicContact CG1-CG 4.27Å; V233-L237 WeakPolarHBondContact O-CG 3.44Å; V233-L237 PolarHBondContact O-N 2.92Å; V233-L253 HydrophobicContact CG1-CD1 4.11Å; V233-L265 HydrophobicContact CG1-CD1 3.96Å; V233-L265 HydrophobicContact CG1-CD2 3.63Å; V233-L265 HydrophobicContact CG1-CG 4.48Å; V233-L265 HydrophobicContact CG2-CD1 4.32Å; V233-V290 HydrophobicContact CG1-CG2 3.91Å
234	E	98	Very high	95	Very high	25 Å²	25	52.4 Å²	52.4	12%	0.117	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-47.7	178	177.7	65.8	-173.3	0	0	111.6	M230 D231 E236 L237 Q238 R287 V288 N289 V290	M230-E234 WeakPolarHBondContact O-CB 3.29Å; M230-E234 PolarHBondContact O-N 3.36Å; D231-E234 PolarHBondContact O-N 3.25Å; E234-E236 VanDerWaalsContact C-N 3.26Å; E234-E236 PolarHBondContact O-N 3.35Å; E234-L237 PolarHBondContact O-N 3.42Å; E234-Q238 WeakPolarHBondContact O-CB 3.49Å; E234-Q238 PolarHBondContact O-N 2.99Å; E234-R287 HydrophobicContact CB-CB 4.22Å; E234-R287 HydrophobicContact CB-CG 4.15Å; E234-R287 HydrophobicContact CG-CB 3.96Å; E234-R287 HydrophobicContact CG-CG 4.03Å; E234-R287 WeakPolarHBondContact OE2-CB 3.37Å; E234-V288 PolarHBondContact OE1-N 3.48Å; E234-N289 WeakPolarHBondContact OE1-CB 3.27Å; E234-N289 PolarHBondContact OE1-N 3.2Å; E234-N289 PolarHBondContact OE1-ND2 2.97Å; E234-N289 WeakPolarHBondContact OE2-CA 3.27Å; E234-N289 WeakPolarHBondContact OE2-CB 3.49Å; E234-N289 PolarHBondContact OE2-N 3.47Å; E234-V290 HydrophobicContact CB-CG2 4.11Å; E234-V290 VanDerWaalsContact OE2-CG2 3.3Å; E234-V290 WeakPolarHBondContact OE2-CG2 3.32Å; E234-V290 PolarHBondContact OE2-N 2.95Å
235	T	97.8	Very high	94.2	Very high	89 Å²	89	52.5 Å²	52.5	55%	0.546	28%	0.277	S	S	.	.	H	α-helix	trans	-57.8	-41.1	178	-58.2	0	0	0	0	111.3	D231 V233 R239	D231-T235 WeakPolarHBondContact O-CB 3.26Å; D231-T235 PolarHBondContact O-N 3.21Å; D231-T235 PolarHBondContact O-OG1 3.25Å; V233-T235 PolarHBondContact O-N 2.99Å; T235-R239 WeakPolarHBondContact O-CB 2.99Å; T235-R239 PolarHBondContact O-N 2.92Å
236	E	97.6	Very high	92.9	Very high	12 Å²	12	58.4 Å²	58.4	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-73	-40.1	179.6	-174.9	71.7	163.4	0	0	112.9	R134 Y138 Q232 V233 E234 Q238 R239 R240 L253	R134-E236 WeakPolarHBondContact CD-OE1 3.26Å; R134-E236 IonicContact CZ-OE1 3.14Å; R134-E236 IonicContact NE-OE1 3.77Å; R134-E236 PolarHBondContact NE-OE1 2.92Å; R134-E236 VanDerWaalsContact NE-OE1 3.11Å; Y138-E236 HydrophobicContact CE1-CB 4.35Å; Y138-E236 HydrophobicContact CE2-CB 4.16Å; Y138-E236 HydrophobicContact CE2-CG 3.58Å; Y138-E236 WeakPolarHBondContact OH-CB 3.48Å; Y138-E236 WeakPolarHBondContact OH-CG 3.41Å; Q232-E236 WeakPolarHBondContact O-CB 3.29Å; Q232-E236 PolarHBondContact O-N 3.38Å; V233-E236 PolarHBondContact O-N 3.48Å; E234-E236 VanDerWaalsContact C-N 3.26Å; E234-E236 PolarHBondContact O-N 3.35Å; E236-Q238 VanDerWaalsContact C-N 3.31Å; E236-Q238 PolarHBondContact O-N 3.36Å; E236-R239 VanDerWaalsContact CD-NH2 3.25Å; E236-R239 PolarHBondContact O-N 3.46Å; E236-R239 IonicContact OE1-CZ 2.64Å; E236-R239 IonicContact OE1-NE 3.67Å; E236-R239 IonicContact OE1-NH2 2.72Å; E236-R239 PolarHBondContact OE1-NH2 3.33Å; E236-R239 IonicContact OE2-CZ 3.95Å; E236-R239 IonicContact OE2-NE 3.9Å; E236-R239 PolarHBondContact OE2-NE 3.11Å; E236-R239 IonicContact OE2-NH2 3.29Å; E236-R239 PolarHBondContact OE2-NH2 3.39Å; E236-R240 WeakPolarHBondContact O-CG 3.33Å; E236-R240 PolarHBondContact O-N 3.48Å; E236-R240 IonicContact OE1-CZ 2.57Å; E236-R240 IonicContact OE1-NH1 3.39Å; E236-R240 PolarHBondContact OE1-NH1 3.34Å; E236-R240 IonicContact OE2-NH1 2.83Å; E236-L253 HydrophobicContact CB-CD1 4.45Å; E236-L253 HydrophobicContact CG-CD1 4.24Å
237	L	97.1	Very high	91.8	Very high	11 Å²	11	68 Å²	68	6%	0.058	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-38.1	174.8	-70.7	172.7	0	0	0	111.4	V233 E234 R240 A241 L253 N289 V290 Y293	V233-L237 HydrophobicContact CG1-CD1 3.79Å; V233-L237 HydrophobicContact CG1-CG 4.27Å; V233-L237 WeakPolarHBondContact O-CG 3.44Å; V233-L237 PolarHBondContact O-N 2.92Å; E234-L237 PolarHBondContact O-N 3.42Å; L237-R240 WeakPolarHBondContact O-CB 3.21Å; L237-R240 PolarHBondContact O-N 2.79Å; L237-A241 PolarHBondContact O-N 3.28Å; L237-L253 HydrophobicContact CD2-CB 4.46Å; L237-L253 HydrophobicContact CD2-CD1 4Å; L237-L253 HydrophobicContact CG-CD1 4.07Å; L237-N289 HydrophobicContact CB-CB 3.69Å; L237-V290 HydrophobicContact CD1-CB 4.42Å; L237-V290 HydrophobicContact CD1-CG2 3.88Å; L237-Y293 HydrophobicContact CD1-CD2 4.34Å; L237-Y293 HydrophobicContact CD1-CG 4.01Å; L237-Y293 HydrophobicContact CD2-CD2 3.6Å; L237-Y293 HydrophobicContact CD2-CE2 4.2Å; L237-Y293 HydrophobicContact CD2-CG 4.11Å
238	Q	95.5	Very high	90.6	Very high	88 Å²	88	66.6 Å²	66.6	41%	0.411	35%	0.352	S	S	.	.	H	α-helix	trans	-60.6	-50.5	171.7	-177.3	-177.3	-10.2	0	0	110.9	E234 E236 R240 A241 E242	E234-Q238 WeakPolarHBondContact O-CB 3.49Å; E234-Q238 PolarHBondContact O-N 2.99Å; E236-Q238 VanDerWaalsContact C-N 3.31Å; E236-Q238 PolarHBondContact O-N 3.36Å; Q238-R240 PolarHBondContact O-N 2.91Å; Q238-A241 WeakPolarHBondContact O-CB 3.3Å; Q238-A241 PolarHBondContact O-N 3.37Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.46Å; Q238-E242 PolarHBondContact NE2-OE1 2.94Å; Q238-E242 WeakPolarHBondContact O-CG 3.49Å; Q238-E242 PolarHBondContact O-N 3.37Å
239	R	94.4	Very high	89.8	Confident	101 Å²	101	72.8 Å²	72.8	38%	0.381	37%	0.371	S	S	.	.	H	α-helix	trans	-56.5	-38.4	176.7	-174.9	173.3	72.4	134.1	-9	111.9	T235 E236 E242 E243	T235-R239 WeakPolarHBondContact O-CB 2.99Å; T235-R239 PolarHBondContact O-N 2.92Å; E236-R239 VanDerWaalsContact CD-NH2 3.25Å; E236-R239 PolarHBondContact O-N 3.46Å; E236-R239 IonicContact OE1-CZ 2.64Å; E236-R239 IonicContact OE1-NE 3.67Å; E236-R239 IonicContact OE1-NH2 2.72Å; E236-R239 PolarHBondContact OE1-NH2 3.33Å; E236-R239 IonicContact OE2-CZ 3.95Å; E236-R239 IonicContact OE2-NE 3.9Å; E236-R239 PolarHBondContact OE2-NE 3.11Å; E236-R239 IonicContact OE2-NH2 3.29Å; E236-R239 PolarHBondContact OE2-NH2 3.39Å; R239-E242 PolarHBondContact O-N 3.26Å; R239-E243 WeakPolarHBondContact CG-OE1 3.39Å; R239-E243 IonicContact NH1-OE1 2.8Å; R239-E243 WeakPolarHBondContact O-CB 3.41Å; R239-E243 VanDerWaalsContact O-CG 3.28Å; R239-E243 WeakPolarHBondContact O-CG 3.33Å; R239-E243 PolarHBondContact O-N 3.44Å
240	R	91.8	Very high	89	Confident	6 Å²	6	76 Å²	76	2%	0.023	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-40.1	175.1	-75.3	-59.1	91.5	67.2	6.6	113	R134 E236 L237 Q238 E242 E243 T244	R134-R240 VanDerWaalsContact CZ-CZ 3.43Å; E236-R240 WeakPolarHBondContact O-CG 3.33Å; E236-R240 PolarHBondContact O-N 3.48Å; E236-R240 IonicContact OE1-CZ 2.57Å; E236-R240 IonicContact OE1-NH1 3.39Å; E236-R240 PolarHBondContact OE1-NH1 3.34Å; E236-R240 IonicContact OE2-NH1 2.83Å; L237-R240 WeakPolarHBondContact O-CB 3.21Å; L237-R240 PolarHBondContact O-N 2.79Å; Q238-R240 PolarHBondContact O-N 2.91Å; R240-E242 VanDerWaalsContact C-N 3.34Å; R240-E243 IonicContact CZ-OE1 2.72Å; R240-E243 IonicContact CZ-OE2 3.64Å; R240-E243 IonicContact NE-OE2 2.74Å; R240-E243 PolarHBondContact NE-OE2 2.91Å; R240-E243 IonicContact NH2-OE1 3.84Å; R240-E243 PolarHBondContact NH2-OE1 3.31Å; R240-E243 IonicContact NH2-OE2 2.85Å; R240-E243 PolarHBondContact NH2-OE2 3.31Å; R240-E243 PolarHBondContact O-N 3.09Å; R240-T244 PolarHBondContact O-N 3.41Å; R240-T244 VanDerWaalsContact O-N 3.09Å; R240-T244 PolarHBondContact O-OG1 2.64Å
241	A	89.4	Confident	88.6	Confident	57 Å²	57	77 Å²	77	47%	0.471	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-43.8	176.3	0	0	0	0	0	110.9	L237 Q238 E243 T244	L237-A241 PolarHBondContact O-N 3.28Å; Q238-A241 WeakPolarHBondContact O-CB 3.3Å; Q238-A241 PolarHBondContact O-N 3.37Å; A241-E243 VanDerWaalsContact C-N 3.35Å; A241-E243 PolarHBondContact O-N 3.12Å; A241-T244 PolarHBondContact O-N 2.69Å
242	E	90.3	Very high	88.5	Confident	134 Å²	134	74.9 Å²	74.9	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-66.7	-32.7	178.1	-66.9	169.2	-174.8	0	0	113.2	Q238 R239 R240	Q238-E242 WeakPolarHBondContact CG-OE1 3.46Å; Q238-E242 PolarHBondContact NE2-OE1 2.94Å; Q238-E242 WeakPolarHBondContact O-CG 3.49Å; Q238-E242 PolarHBondContact O-N 3.37Å; R239-E242 PolarHBondContact O-N 3.26Å; R240-E242 VanDerWaalsContact C-N 3.34Å
243	E	87	Confident	88.5	Confident	96 Å²	96	71.8 Å²	71.8	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-80.6	-15.9	176.4	-73.6	172.3	-171.4	0	0	113.6	R239 R240 A241	R239-E243 WeakPolarHBondContact CG-OE1 3.39Å; R239-E243 IonicContact NH1-OE1 2.8Å; R239-E243 WeakPolarHBondContact O-CB 3.41Å; R239-E243 VanDerWaalsContact O-CG 3.28Å; R239-E243 WeakPolarHBondContact O-CG 3.33Å; R239-E243 PolarHBondContact O-N 3.44Å; R240-E243 IonicContact CZ-OE1 2.72Å; R240-E243 IonicContact CZ-OE2 3.64Å; R240-E243 IonicContact NE-OE2 2.74Å; R240-E243 PolarHBondContact NE-OE2 2.91Å; R240-E243 IonicContact NH2-OE1 3.84Å; R240-E243 PolarHBondContact NH2-OE1 3.31Å; R240-E243 IonicContact NH2-OE2 2.85Å; R240-E243 PolarHBondContact NH2-OE2 3.31Å; R240-E243 PolarHBondContact O-N 3.09Å; A241-E243 VanDerWaalsContact C-N 3.35Å; A241-E243 PolarHBondContact O-N 3.12Å
244	T	82.6	Confident	88.3	Confident	27 Å²	27	71.8 Å²	71.8	17%	0.166	37%	0.371	C	S	.	.	S	Bend	trans	-81.6	124.7	-178.4	-57.8	0	0	0	0	109.4	R240 A241 K249 S251	R240-T244 PolarHBondContact O-N 3.41Å; R240-T244 VanDerWaalsContact O-N 3.09Å; R240-T244 PolarHBondContact O-OG1 2.64Å; A241-T244 PolarHBondContact O-N 2.69Å; T244-K249 WeakPolarHBondContact CG2-O 3.4Å; T244-S251 PolarHBondContact OG1-OG 3Å
245	P	77.3	Confident	88.1	Confident	93 Å²	93	70.7 Å²	70.7	60%	0.604	37%	0.366	S	S	*	.			trans	-57.8	151	176	-23.2	33.4	0	0	0	112.3	E247 G248	P245-E247 PolarHBondContact O-N 3.4Å; P245-E247 VanDerWaalsContact O-N 3.11Å; P245-G248 WeakPolarHBondContact O-CA 3.19Å; P245-G248 PolarHBondContact O-N 2.81Å
246	E	70.7	Confident	87.7	Confident	209 Å²	209	72 Å²	72	98%	0.977	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-31.1	-177.4	-71.3	-170.5	162.5	0	0	114
247	E	73.2	Confident	87.5	Confident	201 Å²	201	73.9 Å²	73.9	94%	0.939	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	1.8	176.5	-61.7	-179.2	173.1	0	0	113.1	P245	P245-E247 PolarHBondContact O-N 3.4Å; P245-E247 VanDerWaalsContact O-N 3.11Å
248	G	71.4	Confident	87.5	Confident	33 Å²	33	74.1 Å²	74.1	34%	0.34	38%	0.379	S	S	.	.	S	Bend	trans	-79.2	150.9	-177.1	0	0	0	0	0	113	P245	P245-G248 WeakPolarHBondContact O-CA 3.19Å; P245-G248 PolarHBondContact O-N 2.81Å
249	K	79.6	Confident	87.6	Confident	193 Å²	193	69.9 Å²	69.9	84%	0.839	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-64	135.7	166.4	-72.6	-178.6	-178.4	174.2	0	108.5	T244 S251	T244-K249 WeakPolarHBondContact CG2-O 3.4Å; K249-S251 PolarHBondContact O-N 3.29Å
250	P	82.9	Confident	87.8	Confident	78 Å²	78	65.1 Å²	65.1	51%	0.506	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-59.2	131.4	-179.7	-22.5	32.3	0	0	0	111	R296	P250-R296 PolarHBondContact O-NH2 2.82Å
251	S	89.8	Confident	88.1	Confident	23 Å²	23	64.9 Å²	64.9	16%	0.161	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-64	156.3	178.6	-64.1	0	0	0	0	112.1	T244 K249 R296	T244-S251 PolarHBondContact OG1-OG 3Å; K249-S251 PolarHBondContact O-N 3.29Å; S251-R296 PolarHBondContact O-NH1 2.71Å
252	W	95.9	Very high	88.5	Confident	31 Å²	31	62.1 Å²	62.1	12%	0.117	32%	0.318	C	S	.	.			trans	-88.1	-177.1	166	-60.7	104.7	0	0	0	110.2	C254 G255 F257 F258 D262 Y293 R296 V297 R300	W252-C254 PolarHBondContact O-N 2.7Å; W252-G255 WeakPolarHBondContact CA-O 3.38Å; W252-G255 PolarHBondContact N-O 2.68Å; W252-F257 WeakPolarHBondContact CB-O 3.19Å; W252-F258 HydrophobicContact CD2-CB 4.47Å; W252-F258 AromaticContact CD2-CD2 3.73Å; W252-F258 HydrophobicContact CD2-CD2 3.73Å; W252-F258 AromaticContact CE3-CD2 3.7Å; W252-F258 HydrophobicContact CE3-CD2 3.7Å; W252-F258 HydrophobicContact CE3-CE2 4.12Å; W252-F258 HydrophobicContact CG-CB 4.42Å; W252-F258 HydrophobicContact CG-CD2 4.29Å; W252-F258 HydrophobicContact CH2-CD2 4.32Å; W252-F258 HydrophobicContact CZ2-CD2 4.34Å; W252-F258 HydrophobicContact CZ3-CD2 4.01Å; W252-F258 HydrophobicContact CZ3-CE2 4.19Å; W252-D262 WeakPolarHBondContact CB-OD1 3.45Å; W252-Y293 HydrophobicContact CE3-CD2 4.32Å; W252-Y293 AromaticContact CE3-CE2 3.77Å; W252-Y293 HydrophobicContact CE3-CE2 3.77Å; W252-Y293 HydrophobicContact CZ3-CE2 4.4Å; W252-R296 HydrophobicContact CH2-CB 4.38Å; W252-R296 HydrophobicContact CZ3-CB 4.36Å; W252-V297 HydrophobicContact CE3-CG2 4.5Å; W252-V297 HydrophobicContact CZ3-CG2 3.86Å; W252-R300 HydrophobicContact CH2-CG 4.19Å
253	L	97.4	Very high	88.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	-54.4	-43.9	-172.6	-178.4	62.8	0	0	0	112	Y138 L142 V233 E236 L237 A261 D262 L265 Y293	Y138-L253 HydrophobicContact CD1-CD1 4.32Å; Y138-L253 HydrophobicContact CD1-CD2 3.95Å; Y138-L253 HydrophobicContact CD1-CG 4.38Å; Y138-L253 HydrophobicContact CD2-CG 4.41Å; Y138-L253 HydrophobicContact CE1-CD1 4.43Å; Y138-L253 HydrophobicContact CG-CD2 3.79Å; Y138-L253 HydrophobicContact CG-CG 4.14Å; L142-L253 HydrophobicContact CD1-CD2 4.26Å; V233-L253 HydrophobicContact CG1-CD1 4.11Å; E236-L253 HydrophobicContact CB-CD1 4.45Å; E236-L253 HydrophobicContact CG-CD1 4.24Å; L237-L253 HydrophobicContact CD2-CB 4.46Å; L237-L253 HydrophobicContact CD2-CD1 4Å; L237-L253 HydrophobicContact CG-CD1 4.07Å; L253-A261 HydrophobicContact CD2-CB 4.19Å; L253-D262 VanDerWaalsContact CB-OD1 3.22Å; L253-D262 WeakPolarHBondContact CB-OD1 3.25Å; L253-D262 PolarHBondContact N-OD1 2.65Å; L253-L265 HydrophobicContact CB-CD2 4.45Å; L253-L265 HydrophobicContact CD1-CD2 4.14Å; L253-L265 HydrophobicContact CD2-CB 4.36Å; L253-L265 HydrophobicContact CD2-CD2 3.86Å; L253-L265 HydrophobicContact CG-CD2 4.38Å; L253-Y293 HydrophobicContact CB-CE2 4.45Å
254	C	95.8	Very high	89.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-108.6	-10.5	-172.4	-60.7	0	0	0	0	115.3	Y131 R134 V135 W252	Y131-C254 WeakPolarHBondContact CD1-O 3.35Å; R134-C254 WeakPolarHBondContact CD-O 3.34Å; R134-C254 HydrophobicContact CG-CB 4.17Å; R134-C254 PolarHBondContact NH1-O 3.42Å; V135-C254 HydrophobicContact CB-CB 4.49Å; V135-C254 HydrophobicContact CG2-CB 3.45Å; V135-C254 VanDerWaalsContact CG2-CB 3.45Å; W252-C254 PolarHBondContact O-N 2.7Å
255	G	91.9	Very high	90.2	Very high	2 Å²	2	49.9 Å²	49.9	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	175.9	-163.7	-176.9	0	0	0	0	0	112.9	W252 F257	W252-G255 WeakPolarHBondContact CA-O 3.38Å; W252-G255 PolarHBondContact N-O 2.68Å; G255-F257 PolarHBondContact O-N 2.86Å
256	D	91.1	Very high	91.3	Very high	116 Å²	116	45.5 Å²	45.5	62%	0.62	23%	0.23	S	C	*	.	S	Bend	trans	-79.8	-1.1	175.9	60.3	-14.7	0	0	0	113.5
257	F	93.4	Very high	92.6	Very high	52 Å²	52	35.5 Å²	35.5	23%	0.228	18%	0.183	C	C	.	.	S	Bend	trans	-116.2	153.7	177.2	66.2	-82.8	0	0	0	111.6	P125 Y131 V135 W252 G255	P125-F257 HydrophobicContact CB-CE2 4.36Å; P125-F257 HydrophobicContact CB-CZ 3.93Å; P125-F257 HydrophobicContact CG-CE2 4.35Å; P125-F257 HydrophobicContact CG-CZ 3.9Å; Y131-F257 HydrophobicContact CD1-CE1 4.39Å; Y131-F257 AromaticContact CD2-CE1 3.65Å; Y131-F257 HydrophobicContact CD2-CE1 3.65Å; Y131-F257 HydrophobicContact CD2-CZ 4.45Å; Y131-F257 HydrophobicContact CE2-CE1 4.3Å; Y131-F257 AromaticContact CG-CE1 3.71Å; Y131-F257 HydrophobicContact CG-CE1 3.71Å; Y131-F257 HydrophobicContact CG-CZ 4.26Å; V135-F257 HydrophobicContact CG2-CE2 4.4Å; V135-F257 HydrophobicContact CG2-CZ 4.12Å; W252-F257 WeakPolarHBondContact CB-O 3.19Å; G255-F257 PolarHBondContact O-N 2.86Å
258	F	96.8	Very high	93.8	Very high	16 Å²	16	26 Å²	26	7%	0.07	14%	0.138	C	C	.	.			trans	-84	116.8	176.7	-168.7	-92	0	0	0	109.2	E60 W252 D262 V263 A266 V297 R300	E60-F258 HydrophobicContact CG-CD1 4.19Å; E60-F258 HydrophobicContact CG-CE1 3.95Å; W252-F258 HydrophobicContact CD2-CB 4.47Å; W252-F258 AromaticContact CD2-CD2 3.73Å; W252-F258 HydrophobicContact CD2-CD2 3.73Å; W252-F258 AromaticContact CE3-CD2 3.7Å; W252-F258 HydrophobicContact CE3-CD2 3.7Å; W252-F258 HydrophobicContact CE3-CE2 4.12Å; W252-F258 HydrophobicContact CG-CB 4.42Å; W252-F258 HydrophobicContact CG-CD2 4.29Å; W252-F258 HydrophobicContact CH2-CD2 4.32Å; W252-F258 HydrophobicContact CZ2-CD2 4.34Å; W252-F258 HydrophobicContact CZ3-CD2 4.01Å; W252-F258 HydrophobicContact CZ3-CE2 4.19Å; F258-D262 HydrophobicContact CD1-CB 4.11Å; F258-D262 HydrophobicContact CD2-CB 3.63Å; F258-D262 HydrophobicContact CE1-CB 3.93Å; F258-D262 HydrophobicContact CE2-CB 3.43Å; F258-D262 VanDerWaalsContact CE2-CB 3.43Å; F258-D262 HydrophobicContact CG-CB 3.97Å; F258-D262 HydrophobicContact CZ-CB 3.59Å; F258-V263 HydrophobicContact CE1-CG2 3.76Å; F258-A266 HydrophobicContact CZ-CB 4.47Å; F258-V297 HydrophobicContact CE2-CG2 4.25Å; F258-R300 VanDerWaalsContact CE2-CD 3.5Å; F258-R300 VanDerWaalsContact CG-CZ 3.49Å
259	S	97.8	Very high	95.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.			trans	-105.6	176.5	-170.5	71.6	0	0	0	0	113.3	L123 A261 D262 V263	L123-S259 CarbonylContact O-C 3.47Å; L123-S259 WeakPolarHBondContact O-CA 2.98Å; L123-S259 WeakPolarHBondContact O-CB 3.32Å; S259-A261 PolarHBondContact O-N 3.06Å; S259-A261 PolarHBondContact OG-N 3.31Å; S259-D262 WeakPolarHBondContact CB-OD2 3.36Å; S259-D262 PolarHBondContact N-OD2 2.76Å; S259-D262 WeakPolarHBondContact O-CB 3.47Å; S259-D262 PolarHBondContact O-N 3.22Å; S259-D262 VanDerWaalsContact O-N 3.08Å; S259-D262 PolarHBondContact OG-N 3.48Å; S259-D262 PolarHBondContact OG-OD2 2.68Å; S259-V263 PolarHBondContact O-N 3.39Å
260	I	97.9	Very high	95.9	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-30.3	171.7	-166.2	166.4	0	0	0	112	M108 L123 V124 V135 R139 D262 V263 S264	M108-I260 HydrophobicContact CB-CD1 3.71Å; M108-I260 HydrophobicContact CE-CD1 4.38Å; M108-I260 HydrophobicContact CG-CD1 4.46Å; M108-I260 HydrophobicContact SD-CD1 4.15Å; M108-I260 HydrophobicContact SD-CG1 4.26Å; L123-I260 HydrophobicContact CB-CB 4.1Å; L123-I260 PolarHBondContact O-N 3.48Å; V124-I260 HydrophobicContact CG2-CB 4.06Å; V124-I260 HydrophobicContact CG2-CD1 4.27Å; V124-I260 HydrophobicContact CG2-CG2 3.6Å; V135-I260 HydrophobicContact CG1-CG2 3.57Å; R139-I260 HydrophobicContact CB-CG2 4.46Å; R139-I260 HydrophobicContact CG-CG2 4.42Å; I260-D262 VanDerWaalsContact C-N 3.28Å; I260-D262 PolarHBondContact O-N 3.07Å; I260-V263 WeakPolarHBondContact O-CB 3.33Å; I260-V263 PolarHBondContact O-N 3.08Å; I260-S264 PolarHBondContact O-N 3.36Å
261	A	98.4	Very high	96.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.6	-35.3	174.2	0	0	0	0	0	110.9	V135 R139 L253 S259 S264 L265	V135-A261 HydrophobicContact CG1-CB 4.43Å; R139-A261 HydrophobicContact CB-CB 4.46Å; L253-A261 HydrophobicContact CD2-CB 4.19Å; S259-A261 PolarHBondContact O-N 3.06Å; S259-A261 PolarHBondContact OG-N 3.31Å; A261-S264 PolarHBondContact O-N 2.81Å; A261-L265 WeakPolarHBondContact O-CB 3.35Å; A261-L265 PolarHBondContact O-N 2.96Å
262	D	98.6	Very high	97	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-68.6	-34.7	172.9	-62.8	-80	0	0	0	112.3	W252 L253 F258 S259 I260 L265 A266 Y293	W252-D262 WeakPolarHBondContact CB-OD1 3.45Å; L253-D262 VanDerWaalsContact CB-OD1 3.22Å; L253-D262 WeakPolarHBondContact CB-OD1 3.25Å; L253-D262 PolarHBondContact N-OD1 2.65Å; F258-D262 HydrophobicContact CD1-CB 4.11Å; F258-D262 HydrophobicContact CD2-CB 3.63Å; F258-D262 HydrophobicContact CE1-CB 3.93Å; F258-D262 HydrophobicContact CE2-CB 3.43Å; F258-D262 VanDerWaalsContact CE2-CB 3.43Å; F258-D262 HydrophobicContact CG-CB 3.97Å; F258-D262 HydrophobicContact CZ-CB 3.59Å; S259-D262 WeakPolarHBondContact CB-OD2 3.36Å; S259-D262 PolarHBondContact N-OD2 2.76Å; S259-D262 WeakPolarHBondContact O-CB 3.47Å; S259-D262 PolarHBondContact O-N 3.22Å; S259-D262 VanDerWaalsContact O-N 3.08Å; S259-D262 PolarHBondContact OG-N 3.48Å; S259-D262 PolarHBondContact OG-OD2 2.68Å; I260-D262 VanDerWaalsContact C-N 3.28Å; I260-D262 PolarHBondContact O-N 3.07Å; D262-L265 PolarHBondContact O-N 3.45Å; D262-A266 WeakPolarHBondContact O-CB 3.49Å; D262-A266 PolarHBondContact O-N 3.36Å; D262-Y293 WeakPolarHBondContact CA-OH 3.38Å; D262-Y293 VanDerWaalsContact CB-OH 3.25Å; D262-Y293 WeakPolarHBondContact CB-OH 3.16Å; D262-Y293 WeakPolarHBondContact OD1-CE2 3.5Å; D262-Y293 PolarHBondContact OD1-OH 3.43Å
263	V	98.5	Very high	97	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.9	-49.8	170.4	170.4	0	0	0	0	110.3	K53 L56 A57 L123 F258 S259 I260 V267	K53-V263 WeakPolarHBondContact O-CG1 3.4Å; L56-V263 HydrophobicContact CB-CG1 4.22Å; L56-V263 HydrophobicContact CD2-CG1 4.23Å; L56-V263 HydrophobicContact CG-CG1 4.31Å; L56-V263 HydrophobicContact CG-CG2 4.38Å; A57-V263 HydrophobicContact CB-CG1 4.38Å; L123-V263 HydrophobicContact CD1-CG2 4.2Å; F258-V263 HydrophobicContact CE1-CG2 3.76Å; S259-V263 PolarHBondContact O-N 3.39Å; I260-V263 WeakPolarHBondContact O-CB 3.33Å; I260-V263 PolarHBondContact O-N 3.08Å; V263-V267 VanDerWaalsContact O-CG2 3.25Å; V263-V267 WeakPolarHBondContact O-CG2 3.22Å; V263-V267 PolarHBondContact O-N 2.96Å; V263-V267 VanDerWaalsContact O-N 3.14Å
264	S	98.4	Very high	96.9	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.2	-46.9	177.6	-71.9	0	0	0	0	111.6	K53 D143 I260 A261 V267 T268	K53-S264 WeakPolarHBondContact CE-OG 3.42Å; K53-S264 PolarHBondContact NZ-OG 2.93Å; D143-S264 WeakPolarHBondContact OD1-CB 3.27Å; D143-S264 PolarHBondContact OD1-OG 2.98Å; I260-S264 PolarHBondContact O-N 3.36Å; A261-S264 PolarHBondContact O-N 2.81Å; S264-V267 PolarHBondContact O-N 3.44Å; S264-T268 WeakPolarHBondContact O-CB 3.45Å; S264-T268 PolarHBondContact O-N 2.87Å; S264-T268 PolarHBondContact O-OG1 3.35Å
265	L	98.8	Very high	96.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.1	-46.5	-179.4	-176.9	56.5	0	0	0	111.3	L142 V233 L253 A261 D262 V267 T268 L269 Y293	L142-L265 HydrophobicContact CD1-CB 3.66Å; L142-L265 HydrophobicContact CD1-CD1 4.36Å; L142-L265 HydrophobicContact CD2-CD1 3.93Å; V233-L265 HydrophobicContact CG1-CD1 3.96Å; V233-L265 HydrophobicContact CG1-CD2 3.63Å; V233-L265 HydrophobicContact CG1-CG 4.48Å; V233-L265 HydrophobicContact CG2-CD1 4.32Å; L253-L265 HydrophobicContact CB-CD2 4.45Å; L253-L265 HydrophobicContact CD1-CD2 4.14Å; L253-L265 HydrophobicContact CD2-CB 4.36Å; L253-L265 HydrophobicContact CD2-CD2 3.86Å; L253-L265 HydrophobicContact CG-CD2 4.38Å; A261-L265 WeakPolarHBondContact O-CB 3.35Å; A261-L265 PolarHBondContact O-N 2.96Å; D262-L265 PolarHBondContact O-N 3.45Å; L265-V267 VanDerWaalsContact C-N 3.34Å; L265-V267 PolarHBondContact O-N 3.46Å; L265-T268 PolarHBondContact O-N 2.83Å; L265-L269 HydrophobicContact CD1-CD1 3.9Å; L265-L269 HydrophobicContact CD1-CD2 4.12Å; L265-L269 HydrophobicContact CD1-CG 3.8Å; L265-L269 HydrophobicContact CD2-CD1 4.49Å; L265-L269 HydrophobicContact CG-CD1 3.86Å; L265-L269 HydrophobicContact CG-CG 4.18Å; L265-L269 VanDerWaalsContact O-CG 3.29Å; L265-L269 WeakPolarHBondContact O-CG 3.46Å; L265-L269 PolarHBondContact O-N 3.42Å; L265-Y293 HydrophobicContact CB-CE1 4.35Å; L265-Y293 HydrophobicContact CD2-CD1 3.96Å; L265-Y293 HydrophobicContact CD2-CE1 3.44Å; L265-Y293 VanDerWaalsContact CD2-CE1 3.44Å; L265-Y293 HydrophobicContact CD2-CE2 4.35Å; L265-Y293 HydrophobicContact CG-CD1 4.42Å; L265-Y293 HydrophobicContact CG-CE1 3.71Å
266	A	98.5	Very high	97	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-54.5	-48.8	178.7	0	0	0	0	0	112.1	L56 F258 D262 H270 V297 F303	L56-A266 HydrophobicContact CD2-CB 3.94Å; F258-A266 HydrophobicContact CZ-CB 4.47Å; D262-A266 WeakPolarHBondContact O-CB 3.49Å; D262-A266 PolarHBondContact O-N 3.36Å; A266-H270 VanDerWaalsContact O-CB 3.29Å; A266-H270 WeakPolarHBondContact O-CB 3.42Å; A266-H270 PolarHBondContact O-N 2.8Å; A266-V297 HydrophobicContact CB-CG1 3.42Å; A266-V297 VanDerWaalsContact CB-CG1 3.42Å; A266-F303 HydrophobicContact CB-CD2 4.28Å; A266-F303 HydrophobicContact CB-CE2 4.13Å
267	V	98.3	Very high	97.2	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-71.3	-38.1	-178.9	-175.7	0	0	0	0	110.8	F49 Q52 K53 L56 V263 S264 L265 H270 R271 L307	F49-V267 HydrophobicContact CD2-CG1 3.67Å; F49-V267 HydrophobicContact CE2-CB 4.16Å; F49-V267 HydrophobicContact CE2-CG1 3.59Å; F49-V267 HydrophobicContact CZ-CG1 4.42Å; Q52-V267 HydrophobicContact CB-CG1 3.58Å; Q52-V267 HydrophobicContact CB-CG2 4.48Å; K53-V267 HydrophobicContact CB-CG2 4.46Å; K53-V267 HydrophobicContact CG-CB 3.86Å; K53-V267 HydrophobicContact CG-CG1 3.96Å; K53-V267 HydrophobicContact CG-CG2 3.94Å; L56-V267 HydrophobicContact CB-CG2 4.41Å; L56-V267 HydrophobicContact CD2-CG2 3.83Å; V263-V267 VanDerWaalsContact O-CG2 3.25Å; V263-V267 WeakPolarHBondContact O-CG2 3.22Å; V263-V267 PolarHBondContact O-N 2.96Å; V263-V267 VanDerWaalsContact O-N 3.14Å; S264-V267 PolarHBondContact O-N 3.44Å; L265-V267 VanDerWaalsContact C-N 3.34Å; L265-V267 PolarHBondContact O-N 3.46Å; V267-H270 PolarHBondContact O-N 3.16Å; V267-R271 VanDerWaalsContact O-CB 3.29Å; V267-R271 WeakPolarHBondContact O-CB 3.29Å; V267-R271 PolarHBondContact O-N 2.87Å; V267-L307 HydrophobicContact CG2-CD1 3.95Å
268	T	98.4	Very high	97.3	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.6	-53.2	174.7	-66.6	0	0	0	0	111.3	L145 S264 L265 H270 R271 L272	L145-T268 HydrophobicContact CD1-CG2 3.94Å; S264-T268 WeakPolarHBondContact O-CB 3.45Å; S264-T268 PolarHBondContact O-N 2.87Å; S264-T268 PolarHBondContact O-OG1 3.35Å; L265-T268 PolarHBondContact O-N 2.83Å; T268-H270 VanDerWaalsContact C-N 3.31Å; T268-H270 PolarHBondContact O-N 3.15Å; T268-R271 WeakPolarHBondContact O-CB 3.33Å; T268-R271 PolarHBondContact O-N 3.36Å; T268-R271 VanDerWaalsContact O-N 3.15Å; T268-L272 HydrophobicContact CG2-CD1 4.05Å; T268-L272 HydrophobicContact CG2-CG 4.36Å; T268-L272 WeakPolarHBondContact O-CG 3.34Å; T268-L272 PolarHBondContact O-N 2.98Å
269	L	98.3	Very high	97.1	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60.8	-41.5	178.3	-63.1	177	0	0	0	111.5	M230 L265 R271 L272 K273 W282 V290 Y293 Y294	M230-L269 HydrophobicContact CE-CD2 3.71Å; M230-L269 HydrophobicContact SD-CD2 4.22Å; L265-L269 HydrophobicContact CD1-CD1 3.9Å; L265-L269 HydrophobicContact CD1-CD2 4.12Å; L265-L269 HydrophobicContact CD1-CG 3.8Å; L265-L269 HydrophobicContact CD2-CD1 4.49Å; L265-L269 HydrophobicContact CG-CD1 3.86Å; L265-L269 HydrophobicContact CG-CG 4.18Å; L265-L269 VanDerWaalsContact O-CG 3.29Å; L265-L269 WeakPolarHBondContact O-CG 3.46Å; L265-L269 PolarHBondContact O-N 3.42Å; L269-R271 VanDerWaalsContact C-N 3.32Å; L269-R271 PolarHBondContact O-N 3.49Å; L269-L272 PolarHBondContact O-N 3.17Å; L269-K273 WeakPolarHBondContact O-CB 3.36Å; L269-K273 PolarHBondContact O-N 2.96Å; L269-W282 HydrophobicContact CB-CH2 4.43Å; L269-W282 HydrophobicContact CD2-CD2 4.44Å; L269-W282 HydrophobicContact CD2-CE3 3.96Å; L269-W282 HydrophobicContact CD2-CH2 4.42Å; L269-W282 HydrophobicContact CD2-CZ3 3.96Å; L269-W282 VanDerWaalsContact O-CH2 3.23Å; L269-W282 WeakPolarHBondContact O-CH2 3.48Å; L269-V290 HydrophobicContact CD1-CG1 4.08Å; L269-V290 HydrophobicContact CD2-CG1 3.76Å; L269-Y293 HydrophobicContact CD1-CD1 3.84Å; L269-Y293 HydrophobicContact CD1-CE1 4.06Å; L269-Y294 HydrophobicContact CB-CD2 3.47Å; L269-Y294 VanDerWaalsContact CB-CD2 3.47Å; L269-Y294 HydrophobicContact CB-CE2 3.78Å; L269-Y294 HydrophobicContact CB-CG 4.32Å; L269-Y294 HydrophobicContact CD1-CD2 3.99Å; L269-Y294 HydrophobicContact CD1-CG 4.42Å; L269-Y294 HydrophobicContact CG-CD2 4.38Å
270	H	97.8	Very high	96.9	Very high	10 Å²	10	17.2 Å²	17.2	5%	0.046	7%	0.072	C	C	.	.	H	α-helix	trans	-63.8	-39	177.6	-166.4	72.5	0	0	0	112.4	A266 V267 T268 K273 F274 Y294 F303 L307 N311	A266-H270 VanDerWaalsContact O-CB 3.29Å; A266-H270 WeakPolarHBondContact O-CB 3.42Å; A266-H270 PolarHBondContact O-N 2.8Å; V267-H270 PolarHBondContact O-N 3.16Å; T268-H270 VanDerWaalsContact C-N 3.31Å; T268-H270 PolarHBondContact O-N 3.15Å; H270-K273 PolarHBondContact O-N 3.12Å; H270-F274 PolarHBondContact O-N 3.21Å; H270-Y294 HydrophobicContact CB-CE2 4.15Å; H270-Y294 PolarHBondContact ND1-OH 3.15Å; H270-F303 HydrophobicContact CB-CE2 4.34Å; H270-F303 HydrophobicContact CB-CZ 3.87Å; H270-F303 AromaticContact CG-CZ 3.66Å; H270-F303 AromaticContact ND1-CE1 3.91Å; H270-F303 AromaticContact ND1-CZ 3.47Å; H270-F303 WeakPolarHBondContact ND1-CZ 3.48Å; H270-L307 PolarHBondContact NE2-O 3.23Å; H270-N311 PolarHBondContact CE1-ND2 2.91Å; H270-N311 PolarHBondContact NE2-OD1 3.43Å
271	R	97.4	Very high	96.7	Very high	10 Å²	10	17.1 Å²	17.1	4%	0.038	7%	0.072	C	C	.	.	H	α-helix	trans	-67.5	-44.2	174.1	-179.1	56.4	57.6	153.2	5.2	112.1	Q47 F49 M147 V267 T268 L269 K273 F274 L275	Q47-R271 PolarHBondContact O-NH1 3.03Å; Q47-R271 PolarHBondContact O-NH2 3.09Å; F49-R271 HydrophobicContact CD2-CB 3.98Å; F49-R271 HydrophobicContact CD2-CG 4.1Å; F49-R271 HydrophobicContact CE2-CB 4.33Å; M147-R271 HydrophobicContact CE-CB 4.31Å; M147-R271 HydrophobicContact CE-CG 3.31Å; M147-R271 HydrophobicContact SD-CG 4.18Å; V267-R271 VanDerWaalsContact O-CB 3.29Å; V267-R271 WeakPolarHBondContact O-CB 3.29Å; V267-R271 PolarHBondContact O-N 2.87Å; T268-R271 WeakPolarHBondContact O-CB 3.33Å; T268-R271 PolarHBondContact O-N 3.36Å; T268-R271 VanDerWaalsContact O-N 3.15Å; L269-R271 VanDerWaalsContact C-N 3.32Å; L269-R271 PolarHBondContact O-N 3.49Å; R271-K273 VanDerWaalsContact C-N 3.25Å; R271-K273 PolarHBondContact O-N 2.86Å; R271-F274 WeakPolarHBondContact O-CA 3.5Å; R271-F274 VanDerWaalsContact O-CB 3.26Å; R271-F274 WeakPolarHBondContact O-CB 3.42Å; R271-F274 PolarHBondContact O-N 3.27Å; R271-F274 VanDerWaalsContact O-N 3.11Å; R271-L275 HydrophobicContact CG-CD1 4.19Å; R271-L275 HydrophobicContact CG-CG 4.42Å; R271-L275 VanDerWaalsContact O-CG 3.29Å; R271-L275 WeakPolarHBondContact O-CG 3.39Å; R271-L275 PolarHBondContact O-N 3.14Å
272	L	97	Very high	96.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.1	-35.2	176.9	-66.7	178.2	0	0	0	111.5	L226 M230 T268 L269 L275 G276 L277 Y281 W282	L226-L272 HydrophobicContact CD1-CD1 4.3Å; L226-L272 HydrophobicContact CD2-CD1 3.97Å; L226-L272 HydrophobicContact CD2-CD2 3.64Å; L226-L272 HydrophobicContact CD2-CG 4.47Å; M230-L272 HydrophobicContact SD-CD1 4.46Å; T268-L272 HydrophobicContact CG2-CD1 4.05Å; T268-L272 HydrophobicContact CG2-CG 4.36Å; T268-L272 WeakPolarHBondContact O-CG 3.34Å; T268-L272 PolarHBondContact O-N 2.98Å; L269-L272 PolarHBondContact O-N 3.17Å; L272-L275 PolarHBondContact O-N 3.12Å; L272-G276 PolarHBondContact O-N 2.82Å; L272-L277 HydrophobicContact CB-CB 4.32Å; L272-L277 HydrophobicContact CD2-CB 4.39Å; L272-L277 HydrophobicContact CD2-CD1 3.78Å; L272-L277 WeakPolarHBondContact O-CB 3.27Å; L272-L277 PolarHBondContact O-N 3.28Å; L272-Y281 HydrophobicContact CD1-CD2 4.47Å; L272-W282 HydrophobicContact CB-CH2 3.73Å; L272-W282 HydrophobicContact CB-CZ3 3.6Å; L272-W282 HydrophobicContact CD1-CZ3 4.01Å; L272-W282 HydrophobicContact CG-CZ3 4.48Å
273	K	96.3	Very high	96	Very high	83 Å²	83	17.9 Å²	17.9	36%	0.361	8%	0.077	S	C	.	.	H	α-helix	trans	-63.7	-46.1	171.1	-173.6	171.5	-176.2	170.8	0	111.3	L269 H270 R271 L275 G276 W282 Y294	L269-K273 WeakPolarHBondContact O-CB 3.36Å; L269-K273 PolarHBondContact O-N 2.96Å; H270-K273 PolarHBondContact O-N 3.12Å; R271-K273 VanDerWaalsContact C-N 3.25Å; R271-K273 PolarHBondContact O-N 2.86Å; K273-L275 VanDerWaalsContact C-N 3.27Å; K273-L275 PolarHBondContact O-N 3.39Å; K273-G276 PolarHBondContact O-N 3.37Å; K273-G276 VanDerWaalsContact O-N 3.09Å; K273-W282 HydrophobicContact CB-CH2 4.18Å; K273-W282 HydrophobicContact CB-CZ2 4.13Å; K273-Y294 HydrophobicContact CD-CE1 3.65Å; K273-Y294 WeakPolarHBondContact CD-OH 3.45Å
274	F	95	Very high	95.4	Very high	13 Å²	13	24.4 Å²	24.4	6%	0.057	11%	0.112	C	C	.	.	H	α-helix	trans	-54.9	-42.9	174.8	175.6	-102.8	0	0	0	112.6	H165 I166 H270 R271 G276 N311 I313	H165-F274 HydrophobicContact CB-CD2 3.55Å; H165-F274 HydrophobicContact CB-CE2 3.66Å; H165-F274 HydrophobicContact CB-CG 4.45Å; H165-F274 WeakPolarHBondContact CB-O 3.28Å; H165-F274 PolarHBondContact N-O 2.84Å; I166-F274 HydrophobicContact CG1-CE1 3.74Å; I166-F274 HydrophobicContact CG1-CZ 3.91Å; H270-F274 PolarHBondContact O-N 3.21Å; R271-F274 WeakPolarHBondContact O-CA 3.5Å; R271-F274 VanDerWaalsContact O-CB 3.26Å; R271-F274 WeakPolarHBondContact O-CB 3.42Å; R271-F274 PolarHBondContact O-N 3.27Å; R271-F274 VanDerWaalsContact O-N 3.11Å; F274-G276 PolarHBondContact O-N 3.48Å; F274-N311 WeakPolarHBondContact CB-OD1 3.3Å; F274-N311 HydrophobicContact CD2-CB 4.5Å; F274-I313 HydrophobicContact CD2-CD1 4.43Å; F274-I313 HydrophobicContact CE2-CD1 3.31Å; F274-I313 HydrophobicContact CE2-CG1 3.5Å; F274-I313 VanDerWaalsContact CE2-CG1 3.5Å; F274-I313 HydrophobicContact CZ-CD1 3.54Å; F274-I313 HydrophobicContact CZ-CG1 3.98Å
275	L	94.9	Very high	94.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.6	-179.2	-62.9	178.4	0	0	0	113.9	M147 T151 C154 T161 S164 I166 R271 L272 K273 L277	M147-L275 HydrophobicContact CE-CD1 3.99Å; T151-L275 HydrophobicContact CG2-CD2 4.23Å; C154-L275 HydrophobicContact CB-CB 4.39Å; C154-L275 HydrophobicContact CB-CD2 4.18Å; T161-L275 WeakPolarHBondContact CB-O 3.48Å; T161-L275 WeakPolarHBondContact CG2-O 3.38Å; S164-L275 PolarHBondContact OG-O 2.94Å; I166-L275 HydrophobicContact CD1-CD2 3.7Å; I166-L275 HydrophobicContact CG1-CD2 4.46Å; R271-L275 HydrophobicContact CG-CD1 4.19Å; R271-L275 HydrophobicContact CG-CG 4.42Å; R271-L275 VanDerWaalsContact O-CG 3.29Å; R271-L275 WeakPolarHBondContact O-CG 3.39Å; R271-L275 PolarHBondContact O-N 3.14Å; L272-L275 PolarHBondContact O-N 3.12Å; K273-L275 VanDerWaalsContact C-N 3.27Å; K273-L275 PolarHBondContact O-N 3.39Å; L275-L277 HydrophobicContact CB-CD1 4.08Å; L275-L277 HydrophobicContact CB-CG 4.1Å; L275-L277 HydrophobicContact CD1-CD1 4.27Å
276	G	95.4	Very high	94.4	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.031	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	30	-175.6	0	0	0	0	0	113.5	A162 L272 K273 F274	A162-G276 PolarHBondContact N-O 3Å; A162-G276 CarbonylContact O-C 3.22Å; A162-G276 WeakPolarHBondContact O-CA 3.23Å; L272-G276 PolarHBondContact O-N 2.82Å; K273-G276 PolarHBondContact O-N 3.37Å; K273-G276 VanDerWaalsContact O-N 3.09Å; F274-G276 PolarHBondContact O-N 3.48Å
277	L	95.9	Very high	94.3	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	17%	0.166	C	C	.	.			trans	-105.7	-4.9	-179.8	-63.2	176.1	0	0	0	112.7	T161 L223 L272 L275 R279 R280 Y281	T161-L277 HydrophobicContact CG2-CD2 4.48Å; L223-L277 HydrophobicContact CD2-CD1 4.27Å; L272-L277 HydrophobicContact CB-CB 4.32Å; L272-L277 HydrophobicContact CD2-CB 4.39Å; L272-L277 HydrophobicContact CD2-CD1 3.78Å; L272-L277 WeakPolarHBondContact O-CB 3.27Å; L272-L277 PolarHBondContact O-N 3.28Å; L275-L277 HydrophobicContact CB-CD1 4.08Å; L275-L277 HydrophobicContact CB-CG 4.1Å; L275-L277 HydrophobicContact CD1-CD1 4.27Å; L277-R279 PolarHBondContact O-N 3.05Å; L277-R280 WeakPolarHBondContact O-CB 3.49Å; L277-R280 PolarHBondContact O-N 3.23Å; L277-Y281 HydrophobicContact CB-CD2 3.8Å; L277-Y281 HydrophobicContact CB-CE2 3.93Å; L277-Y281 HydrophobicContact CD1-CE2 4.22Å; L277-Y281 HydrophobicContact CD2-CE2 4.45Å; L277-Y281 HydrophobicContact CG-CE2 4.44Å; L277-Y281 WeakPolarHBondContact O-CD2 3.32Å; L277-Y281 PolarHBondContact O-N 3.41Å; L277-Y281 VanDerWaalsContact O-N 3.14Å
278	S	95	Very high	94.2	Very high	22 Å²	22	35.2 Å²	35.2	15%	0.154	19%	0.189	C	C	.	.	H	α-helix	trans	-54.9	-46.7	-178.3	57.6	0	0	0	0	113.6	R280 Y281 W282 G283	S278-R280 PolarHBondContact O-N 3.34Å; S278-Y281 PolarHBondContact O-N 3.14Å; S278-W282 PolarHBondContact O-N 2.85Å; S278-G283 PolarHBondContact O-N 2.88Å
279	R	92.1	Very high	94.1	Very high	124 Å²	124	37.1 Å²	37.1	47%	0.468	20%	0.199	S	C	.	.	H	α-helix	trans	-60.2	-29.1	177.7	-68	-169	-171.3	-163.8	5.1	113.9	D163 L277	D163-R279 VanDerWaalsContact CG-NH2 3.34Å; D163-R279 IonicContact OD1-CZ 3.11Å; D163-R279 IonicContact OD1-NH2 3.77Å; D163-R279 PolarHBondContact OD1-NH2 3.02Å; D163-R279 IonicContact OD2-CZ 3.54Å; D163-R279 IonicContact OD2-NE 2.63Å; D163-R279 PolarHBondContact OD2-NE 2.91Å; D163-R279 IonicContact OD2-NH2 3.85Å; D163-R279 PolarHBondContact OD2-NH2 3.49Å; L277-R279 PolarHBondContact O-N 3.05Å
280	R	93	Very high	94.1	Very high	93 Å²	93	37.1 Å²	37.1	35%	0.351	20%	0.199	S	C	.	.	H	α-helix	trans	-79	-40.9	179.1	179.6	175.3	179.5	170.9	-3.5	111.5	D224 E227 L277 S278	D224-R280 IonicContact OD1-NH2 2.64Å; E227-R280 IonicContact OE1-CZ 3.35Å; E227-R280 VanDerWaalsContact OE1-CZ 3.22Å; E227-R280 IonicContact OE1-NE 3.55Å; E227-R280 PolarHBondContact OE1-NE 2.86Å; E227-R280 IonicContact OE1-NH2 2.99Å; E227-R280 PolarHBondContact OE1-NH2 3.09Å; L277-R280 WeakPolarHBondContact O-CB 3.49Å; L277-R280 PolarHBondContact O-N 3.23Å; S278-R280 PolarHBondContact O-N 3.34Å
281	Y	95.1	Very high	94.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-98.1	-27.6	-168.7	-72.3	-72.3	0	0	0	115	L223 L226 E227 M230 L272 L277 S278 R287	L223-Y281 WeakPolarHBondContact CA-OH 3.35Å; L223-Y281 WeakPolarHBondContact CB-OH 3.25Å; L223-Y281 HydrophobicContact CD2-CE2 4.49Å; L223-Y281 VanDerWaalsContact CD2-OH 3.3Å; L223-Y281 WeakPolarHBondContact CD2-OH 3.33Å; L223-Y281 PolarHBondContact O-OH 3.44Å; L226-Y281 HydrophobicContact CB-CE1 3.91Å; L226-Y281 HydrophobicContact CD2-CD1 4.42Å; L226-Y281 HydrophobicContact CD2-CD2 4.23Å; L226-Y281 HydrophobicContact CD2-CE1 3.82Å; L226-Y281 HydrophobicContact CD2-CE2 3.64Å; L226-Y281 VanDerWaalsContact CD2-CZ 3.41Å; L226-Y281 HydrophobicContact CG-CD1 4.08Å; L226-Y281 HydrophobicContact CG-CE1 3.51Å; L226-Y281 HydrophobicContact CG-CE2 4.28Å; E227-Y281 HydrophobicContact CB-CE1 4.23Å; E227-Y281 HydrophobicContact CG-CD1 4.08Å; E227-Y281 HydrophobicContact CG-CE1 3.4Å; E227-Y281 VanDerWaalsContact CG-CE1 3.4Å; M230-Y281 HydrophobicContact CB-CD1 4.28Å; M230-Y281 HydrophobicContact CG-CD1 3.69Å; M230-Y281 HydrophobicContact CG-CE1 4.48Å; M230-Y281 HydrophobicContact CG-CG 4.23Å; L272-Y281 HydrophobicContact CD1-CD2 4.47Å; L277-Y281 HydrophobicContact CB-CD2 3.8Å; L277-Y281 HydrophobicContact CB-CE2 3.93Å; L277-Y281 HydrophobicContact CD1-CE2 4.22Å; L277-Y281 HydrophobicContact CD2-CE2 4.45Å; L277-Y281 HydrophobicContact CG-CE2 4.44Å; L277-Y281 WeakPolarHBondContact O-CD2 3.32Å; L277-Y281 PolarHBondContact O-N 3.41Å; L277-Y281 VanDerWaalsContact O-N 3.14Å; S278-Y281 PolarHBondContact O-N 3.14Å; Y281-R287 WeakPolarHBondContact O-CD 3.42Å; Y281-R287 PolarHBondContact O-NH1 3.05Å
282	W	94.8	Very high	94	Very high	8 Å²	8	42 Å²	42	3%	0.03	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-149.9	-17.5	175.5	67.7	90.3	0	0	0	115.8	M230 L269 L272 K273 S278 S286 R287 V290	M230-W282 HydrophobicContact CE-CE3 4.39Å; L269-W282 HydrophobicContact CB-CH2 4.43Å; L269-W282 HydrophobicContact CD2-CD2 4.44Å; L269-W282 HydrophobicContact CD2-CE3 3.96Å; L269-W282 HydrophobicContact CD2-CH2 4.42Å; L269-W282 HydrophobicContact CD2-CZ3 3.96Å; L269-W282 VanDerWaalsContact O-CH2 3.23Å; L269-W282 WeakPolarHBondContact O-CH2 3.48Å; L272-W282 HydrophobicContact CB-CH2 3.73Å; L272-W282 HydrophobicContact CB-CZ3 3.6Å; L272-W282 HydrophobicContact CD1-CZ3 4.01Å; L272-W282 HydrophobicContact CG-CZ3 4.48Å; K273-W282 HydrophobicContact CB-CH2 4.18Å; K273-W282 HydrophobicContact CB-CZ2 4.13Å; S278-W282 PolarHBondContact O-N 2.85Å; W282-S286 VanDerWaalsContact C-OG 3.29Å; W282-S286 WeakPolarHBondContact CA-OG 3.48Å; W282-S286 PolarHBondContact O-OG 3.23Å; W282-R287 HydrophobicContact CB-CB 4Å; W282-R287 PolarHBondContact O-N 3.15Å; W282-V290 HydrophobicContact CB-CB 3.92Å; W282-V290 HydrophobicContact CB-CG1 3.49Å; W282-V290 VanDerWaalsContact CB-CG1 3.49Å; W282-V290 HydrophobicContact CD2-CG1 4.16Å; W282-V290 HydrophobicContact CG-CG1 3.72Å
283	G	87.5	Confident	94.1	Very high	7 Å²	7	42.2 Å²	42.2	7%	0.072	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	175.9	177.8	0	0	0	0	0	113.5	S278 G285 S286	S278-G283 PolarHBondContact O-N 2.88Å; G283-G285 PolarHBondContact O-N 3.09Å; G283-S286 WeakPolarHBondContact O-CB 3.37Å; G283-S286 PolarHBondContact O-N 3.17Å; G283-S286 PolarHBondContact O-OG 3.07Å
284	N	84.9	Confident	94.1	Very high	137 Å²	137	38.7 Å²	38.7	73%	0.733	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	27.1	-178.6	-55.5	-39.3	0	0	0	113.9	S286	N284-S286 VanDerWaalsContact C-N 3.3Å; N284-S286 PolarHBondContact O-N 3.21Å
285	G	87	Confident	94.2	Very high	58 Å²	58	43.5 Å²	43.5	60%	0.598	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	15.5	-179.3	0	0	0	0	0	114.9	G283	G283-G285 PolarHBondContact O-N 3.09Å
286	S	90.4	Very high	94.2	Very high	63 Å²	63	46.6 Å²	46.6	44%	0.441	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-36.4	-179.4	57.2	0	0	0	0	113.7	W282 G283 N284	W282-S286 VanDerWaalsContact C-OG 3.29Å; W282-S286 WeakPolarHBondContact CA-OG 3.48Å; W282-S286 PolarHBondContact O-OG 3.23Å; G283-S286 WeakPolarHBondContact O-CB 3.37Å; G283-S286 PolarHBondContact O-N 3.17Å; G283-S286 PolarHBondContact O-OG 3.07Å; N284-S286 VanDerWaalsContact C-N 3.3Å; N284-S286 PolarHBondContact O-N 3.21Å
287	R	96.5	Very high	94.3	Very high	27 Å²	27	46.5 Å²	46.5	10%	0.102	25%	0.245	C	C	.	.	S	Bend	trans	-141.6	80.8	176.8	-63.7	-171.7	-174.4	70.7	1.1	109.4	D231 E234 Y281 W282 N289 V290 E291	D231-R287 IonicContact OD1-CZ 2.81Å; D231-R287 IonicContact OD1-NE 2.61Å; D231-R287 PolarHBondContact OD1-NE 3.32Å; D231-R287 IonicContact OD1-NH2 2.69Å; D231-R287 PolarHBondContact OD1-NH2 2.86Å; D231-R287 IonicContact OD2-NH2 3.78Å; E234-R287 HydrophobicContact CB-CB 4.22Å; E234-R287 HydrophobicContact CB-CG 4.15Å; E234-R287 HydrophobicContact CG-CB 3.96Å; E234-R287 HydrophobicContact CG-CG 4.03Å; E234-R287 WeakPolarHBondContact OE2-CB 3.37Å; Y281-R287 WeakPolarHBondContact O-CD 3.42Å; Y281-R287 PolarHBondContact O-NH1 3.05Å; W282-R287 HydrophobicContact CB-CB 4Å; W282-R287 PolarHBondContact O-N 3.15Å; R287-N289 VanDerWaalsContact C-N 3.3Å; R287-N289 PolarHBondContact O-N 3.13Å; R287-V290 HydrophobicContact CB-CB 4.1Å; R287-V290 HydrophobicContact CB-CG2 4.24Å; R287-V290 PolarHBondContact O-N 3.09Å; R287-E291 PolarHBondContact O-N 3.21Å
288	V	96.2	Very high	94.4	Very high	80 Å²	80	48.2 Å²	48.2	49%	0.485	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-31.8	-170	65.8	0	0	0	0	112.6	E234 E291 T292	E234-V288 PolarHBondContact OE1-N 3.48Å; V288-E291 PolarHBondContact O-N 2.9Å; V288-T292 WeakPolarHBondContact O-CB 3.34Å; V288-T292 PolarHBondContact O-N 3.32Å; V288-T292 PolarHBondContact O-OG1 3.43Å
289	N	96.6	Very high	94.5	Very high	39 Å²	39	52.1 Å²	52.1	21%	0.209	27%	0.272	C	S	.	.	H	α-helix	trans	-73.6	-39.1	-179.7	-60.2	-79.8	0	0	0	110.8	E234 L237 R287 Y293	E234-N289 WeakPolarHBondContact OE1-CB 3.27Å; E234-N289 PolarHBondContact OE1-N 3.2Å; E234-N289 PolarHBondContact OE1-ND2 2.97Å; E234-N289 WeakPolarHBondContact OE2-CA 3.27Å; E234-N289 WeakPolarHBondContact OE2-CB 3.49Å; E234-N289 PolarHBondContact OE2-N 3.47Å; L237-N289 HydrophobicContact CB-CB 3.69Å; R287-N289 VanDerWaalsContact C-N 3.3Å; R287-N289 PolarHBondContact O-N 3.13Å; N289-Y293 WeakPolarHBondContact O-CB 3.03Å; N289-Y293 PolarHBondContact O-N 2.75Å
290	V	98.1	Very high	94.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.7	-45.7	169.6	170.5	0	0	0	0	111.1	M230 V233 E234 L237 L269 W282 R287 Y293 Y294	M230-V290 HydrophobicContact CE-CB 4.39Å; M230-V290 HydrophobicContact CE-CG1 3.63Å; M230-V290 HydrophobicContact CE-CG2 3.94Å; V233-V290 HydrophobicContact CG1-CG2 3.91Å; E234-V290 HydrophobicContact CB-CG2 4.11Å; E234-V290 VanDerWaalsContact OE2-CG2 3.3Å; E234-V290 WeakPolarHBondContact OE2-CG2 3.32Å; E234-V290 PolarHBondContact OE2-N 2.95Å; L237-V290 HydrophobicContact CD1-CB 4.42Å; L237-V290 HydrophobicContact CD1-CG2 3.88Å; L269-V290 HydrophobicContact CD1-CG1 4.08Å; L269-V290 HydrophobicContact CD2-CG1 3.76Å; W282-V290 HydrophobicContact CB-CB 3.92Å; W282-V290 HydrophobicContact CB-CG1 3.49Å; W282-V290 VanDerWaalsContact CB-CG1 3.49Å; W282-V290 HydrophobicContact CD2-CG1 4.16Å; W282-V290 HydrophobicContact CG-CG1 3.72Å; R287-V290 HydrophobicContact CB-CB 4.1Å; R287-V290 HydrophobicContact CB-CG2 4.24Å; R287-V290 PolarHBondContact O-N 3.09Å; V290-Y293 PolarHBondContact O-N 2.84Å; V290-Y294 WeakPolarHBondContact O-CB 3.48Å; V290-Y294 PolarHBondContact O-N 3.39Å
291	E	97.1	Very high	94.9	Very high	59 Å²	59	49 Å²	49	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-51.3	178.7	-170.7	160.5	-140.1	0	0	111.1	R287 V288 Y293 Y294 E295	R287-E291 PolarHBondContact O-N 3.21Å; V288-E291 PolarHBondContact O-N 2.9Å; E291-Y293 VanDerWaalsContact C-N 3.33Å; E291-Y293 PolarHBondContact O-N 3.19Å; E291-Y294 WeakPolarHBondContact O-CB 3.43Å; E291-Y294 PolarHBondContact O-N 2.88Å; E291-Y294 VanDerWaalsContact O-N 3.12Å; E291-E295 WeakPolarHBondContact O-CG 3.46Å; E291-E295 PolarHBondContact O-N 3.05Å
292	T	95.6	Very high	95.1	Very high	65 Å²	65	49.3 Å²	49.3	40%	0.399	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-41.3	177.5	-55.5	0	0	0	0	111.8	V288 R296	V288-T292 WeakPolarHBondContact O-CB 3.34Å; V288-T292 PolarHBondContact O-N 3.32Å; V288-T292 PolarHBondContact O-OG1 3.43Å; T292-R296 WeakPolarHBondContact O-CG 3.18Å; T292-R296 PolarHBondContact O-N 2.95Å
293	Y	97.7	Very high	95.2	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-47.5	174.3	171.9	-87.1	0	0	0	111.1	L237 W252 L253 D262 L265 L269 N289 V290 E291 E295 R296 V297	L237-Y293 HydrophobicContact CD1-CD2 4.34Å; L237-Y293 HydrophobicContact CD1-CG 4.01Å; L237-Y293 HydrophobicContact CD2-CD2 3.6Å; L237-Y293 HydrophobicContact CD2-CE2 4.2Å; L237-Y293 HydrophobicContact CD2-CG 4.11Å; W252-Y293 HydrophobicContact CE3-CD2 4.32Å; W252-Y293 AromaticContact CE3-CE2 3.77Å; W252-Y293 HydrophobicContact CE3-CE2 3.77Å; W252-Y293 HydrophobicContact CZ3-CE2 4.4Å; L253-Y293 HydrophobicContact CB-CE2 4.45Å; D262-Y293 WeakPolarHBondContact CA-OH 3.38Å; D262-Y293 VanDerWaalsContact CB-OH 3.25Å; D262-Y293 WeakPolarHBondContact CB-OH 3.16Å; D262-Y293 WeakPolarHBondContact OD1-CE2 3.5Å; D262-Y293 PolarHBondContact OD1-OH 3.43Å; L265-Y293 HydrophobicContact CB-CE1 4.35Å; L265-Y293 HydrophobicContact CD2-CD1 3.96Å; L265-Y293 HydrophobicContact CD2-CE1 3.44Å; L265-Y293 VanDerWaalsContact CD2-CE1 3.44Å; L265-Y293 HydrophobicContact CD2-CE2 4.35Å; L265-Y293 HydrophobicContact CG-CD1 4.42Å; L265-Y293 HydrophobicContact CG-CE1 3.71Å; L269-Y293 HydrophobicContact CD1-CD1 3.84Å; L269-Y293 HydrophobicContact CD1-CE1 4.06Å; N289-Y293 WeakPolarHBondContact O-CB 3.03Å; N289-Y293 PolarHBondContact O-N 2.75Å; V290-Y293 PolarHBondContact O-N 2.84Å; E291-Y293 VanDerWaalsContact C-N 3.33Å; E291-Y293 PolarHBondContact O-N 3.19Å; Y293-E295 PolarHBondContact O-N 2.96Å; Y293-R296 WeakPolarHBondContact O-CB 3.45Å; Y293-R296 PolarHBondContact O-N 2.93Å; Y293-R296 VanDerWaalsContact O-N 3.16Å; Y293-V297 HydrophobicContact CD1-CG2 3.91Å; Y293-V297 HydrophobicContact CE1-CG2 3.4Å; Y293-V297 HydrophobicContact CE2-CG2 4.21Å; Y293-V297 HydrophobicContact CG-CG2 4.48Å; Y293-V297 WeakPolarHBondContact O-CG2 3.3Å; Y293-V297 PolarHBondContact O-N 3.37Å
294	Y	97.6	Very high	95.7	Very high	10 Å²	10	54.6 Å²	54.6	4%	0.039	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-42.8	-178.9	-176.9	-111.7	0	0	0	112	L269 H270 K273 V290 E291 R296 V297 V298	L269-Y294 HydrophobicContact CB-CD2 3.47Å; L269-Y294 VanDerWaalsContact CB-CD2 3.47Å; L269-Y294 HydrophobicContact CB-CE2 3.78Å; L269-Y294 HydrophobicContact CB-CG 4.32Å; L269-Y294 HydrophobicContact CD1-CD2 3.99Å; L269-Y294 HydrophobicContact CD1-CG 4.42Å; L269-Y294 HydrophobicContact CG-CD2 4.38Å; H270-Y294 HydrophobicContact CB-CE2 4.15Å; H270-Y294 PolarHBondContact ND1-OH 3.15Å; K273-Y294 HydrophobicContact CD-CE1 3.65Å; K273-Y294 WeakPolarHBondContact CD-OH 3.45Å; V290-Y294 WeakPolarHBondContact O-CB 3.48Å; V290-Y294 PolarHBondContact O-N 3.39Å; E291-Y294 WeakPolarHBondContact O-CB 3.43Å; E291-Y294 PolarHBondContact O-N 2.88Å; E291-Y294 VanDerWaalsContact O-N 3.12Å; Y294-R296 VanDerWaalsContact C-N 3.26Å; Y294-R296 PolarHBondContact O-N 2.99Å; Y294-V297 PolarHBondContact O-N 3.42Å; Y294-V297 VanDerWaalsContact O-N 3.14Å; Y294-V298 HydrophobicContact CD1-CG1 4.35Å; Y294-V298 HydrophobicContact CD2-CG1 4.31Å; Y294-V298 HydrophobicContact CE1-CG1 3.85Å; Y294-V298 HydrophobicContact CE2-CG1 3.83Å; Y294-V298 WeakPolarHBondContact O-CG1 3.18Å; Y294-V298 PolarHBondContact O-N 2.81Å
295	E	96	Very high	96.2	Very high	113 Å²	113	55.5 Å²	55.5	53%	0.528	29%	0.287	S	S	.	.	H	α-helix	trans	-57.3	-39.6	174.4	-71.9	179.6	164.8	0	0	112	E291 Y293 V298 E299	E291-E295 WeakPolarHBondContact O-CG 3.46Å; E291-E295 PolarHBondContact O-N 3.05Å; Y293-E295 PolarHBondContact O-N 2.96Å; E295-V298 WeakPolarHBondContact O-CG2 3.35Å; E295-E299 VanDerWaalsContact O-CG 3.32Å; E295-E299 WeakPolarHBondContact O-CG 3.32Å
296	R	96.6	Very high	96.7	Very high	66 Å²	66	53.2 Å²	53.2	25%	0.249	26%	0.261	C	S	.	.	H	α-helix	trans	-70.2	-39.1	174.9	-68.3	169.2	55.6	-150.2	-4.6	112.8	P250 S251 W252 T292 Y293 Y294 E299	P250-R296 PolarHBondContact O-NH2 2.82Å; S251-R296 PolarHBondContact O-NH1 2.71Å; W252-R296 HydrophobicContact CH2-CB 4.38Å; W252-R296 HydrophobicContact CZ3-CB 4.36Å; T292-R296 WeakPolarHBondContact O-CG 3.18Å; T292-R296 PolarHBondContact O-N 2.95Å; Y293-R296 WeakPolarHBondContact O-CB 3.45Å; Y293-R296 PolarHBondContact O-N 2.93Å; Y293-R296 VanDerWaalsContact O-N 3.16Å; Y294-R296 VanDerWaalsContact C-N 3.26Å; Y294-R296 PolarHBondContact O-N 2.99Å; R296-E299 PolarHBondContact O-N 3.31Å
297	V	97.4	Very high	97	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-43.6	-179.5	163	0	0	0	0	111.5	W252 F258 A266 Y293 Y294 E299 R300 F303	W252-V297 HydrophobicContact CE3-CG2 4.5Å; W252-V297 HydrophobicContact CZ3-CG2 3.86Å; F258-V297 HydrophobicContact CE2-CG2 4.25Å; A266-V297 HydrophobicContact CB-CG1 3.42Å; A266-V297 VanDerWaalsContact CB-CG1 3.42Å; Y293-V297 HydrophobicContact CD1-CG2 3.91Å; Y293-V297 HydrophobicContact CE1-CG2 3.4Å; Y293-V297 HydrophobicContact CE2-CG2 4.21Å; Y293-V297 HydrophobicContact CG-CG2 4.48Å; Y293-V297 WeakPolarHBondContact O-CG2 3.3Å; Y293-V297 PolarHBondContact O-N 3.37Å; Y294-V297 PolarHBondContact O-N 3.42Å; Y294-V297 VanDerWaalsContact O-N 3.14Å; V297-E299 PolarHBondContact O-N 2.91Å; V297-E299 VanDerWaalsContact O-N 3.17Å; V297-R300 WeakPolarHBondContact O-CB 3.36Å; V297-R300 WeakPolarHBondContact O-CG 3.4Å; V297-R300 PolarHBondContact O-N 2.86Å; V297-R300 VanDerWaalsContact O-N 3.07Å; V297-F303 HydrophobicContact CG1-CD2 3.48Å; V297-F303 VanDerWaalsContact CG1-CD2 3.48Å; V297-F303 HydrophobicContact CG1-CE2 3.63Å; V297-F303 HydrophobicContact CG1-CG 4.22Å; V297-F303 HydrophobicContact CG1-CZ 4.47Å; V297-F303 WeakPolarHBondContact O-CB 3.34Å; V297-F303 WeakPolarHBondContact O-CG 3.4Å
298	V	97.1	Very high	96.8	Very high	38 Å²	38	50.9 Å²	50.9	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-17.6	-178.2	-61.3	0	0	0	0	113.4	Y294 E295 F303 R304	Y294-V298 HydrophobicContact CD1-CG1 4.35Å; Y294-V298 HydrophobicContact CD2-CG1 4.31Å; Y294-V298 HydrophobicContact CE1-CG1 3.85Å; Y294-V298 HydrophobicContact CE2-CG1 3.83Å; Y294-V298 WeakPolarHBondContact O-CG1 3.18Å; Y294-V298 PolarHBondContact O-N 2.81Å; E295-V298 WeakPolarHBondContact O-CG2 3.35Å; V298-F303 HydrophobicContact CB-CD1 4.3Å; V298-F303 HydrophobicContact CB-CE1 4.09Å; V298-F303 HydrophobicContact CG1-CD1 4.39Å; V298-F303 HydrophobicContact CG1-CE1 3.74Å; V298-F303 HydrophobicContact CG1-CZ 3.97Å; V298-R304 WeakPolarHBondContact O-CG 3.49Å; V298-R304 PolarHBondContact O-NE 3.11Å
299	E	96.9	Very high	96.5	Very high	105 Å²	105	53 Å²	53	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.1	176.7	-65.3	-65	104.4	0	0	113.1	E295 R296 V297 R304	E295-E299 VanDerWaalsContact O-CG 3.32Å; E295-E299 WeakPolarHBondContact O-CG 3.32Å; R296-E299 PolarHBondContact O-N 3.31Å; V297-E299 PolarHBondContact O-N 2.91Å; V297-E299 VanDerWaalsContact O-N 3.17Å; E299-R304 PolarHBondContact O-NH1 3.39Å; E299-R304 IonicContact OE1-CZ 3.19Å; E299-R304 IonicContact OE1-NE 3.79Å; E299-R304 IonicContact OE1-NH2 2.74Å; E299-R304 PolarHBondContact OE1-NH2 2.76Å; E299-R304 IonicContact OE2-CZ 3.65Å; E299-R304 IonicContact OE2-NH1 3.13Å; E299-R304 IonicContact OE2-NH2 2.77Å; E299-R304 PolarHBondContact OE2-NH2 2.78Å
300	R	96.7	Very high	96.2	Very high	48 Å²	48	51.3 Å²	51.3	18%	0.181	25%	0.251	C	S	.	.	S	Bend	trans	-62.7	136.6	-178.1	-64.9	-177.3	65.7	82.7	4.5	111.3	E60 W252 F258 V297 A302 F303 R304	E60-R300 IonicContact OE1-CZ 3.94Å; E60-R300 IonicContact OE1-NE 3.73Å; E60-R300 PolarHBondContact OE1-NE 3.44Å; E60-R300 IonicContact OE1-NH2 3.55Å; E60-R300 PolarHBondContact OE1-NH2 2.71Å; E60-R300 IonicContact OE2-CZ 2.75Å; E60-R300 IonicContact OE2-NE 2.81Å; E60-R300 IonicContact OE2-NH2 3.16Å; E60-R300 PolarHBondContact OE2-NH2 3.42Å; W252-R300 HydrophobicContact CH2-CG 4.19Å; F258-R300 VanDerWaalsContact CE2-CD 3.5Å; F258-R300 VanDerWaalsContact CG-CZ 3.49Å; V297-R300 WeakPolarHBondContact O-CB 3.36Å; V297-R300 WeakPolarHBondContact O-CG 3.4Å; V297-R300 PolarHBondContact O-N 2.86Å; V297-R300 VanDerWaalsContact O-N 3.07Å; R300-A302 PolarHBondContact O-N 2.78Å; R300-F303 HydrophobicContact CB-CB 3.93Å; R300-F303 PolarHBondContact O-N 3.02Å; R300-R304 WeakPolarHBondContact O-CG 3.3Å; R300-R304 PolarHBondContact O-N 3.37Å
301	P	97.8	Very high	95.8	Very high	103 Å²	103	52.4 Å²	52.4	67%	0.669	26%	0.257	S	S	*	.	H	α-helix	trans	-58.2	-43	-179.1	-26.9	34.8	0	0	0	114.2	R305	P301-R305 WeakPolarHBondContact O-CB 3.19Å; P301-R305 PolarHBondContact O-N 2.88Å
302	A	97.6	Very high	95.4	Very high	6 Å²	6	53 Å²	53	5%	0.05	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-43.6	177.5	0	0	0	0	0	111.4	L56 A59 E60 R300 R305 V306	L56-A302 HydrophobicContact CD1-CB 4.31Å; A59-A302 HydrophobicContact CB-CB 3.9Å; E60-A302 VanDerWaalsContact CD-CB 3.47Å; E60-A302 HydrophobicContact CG-CB 3.86Å; E60-A302 WeakPolarHBondContact OE1-CB 3.34Å; R300-A302 PolarHBondContact O-N 2.78Å; A302-R305 PolarHBondContact O-N 2.91Å; A302-V306 WeakPolarHBondContact O-CG2 3.16Å; A302-V306 PolarHBondContact O-N 3.42Å
303	F	98.4	Very high	94.8	Very high	4 Å²	4	51 Å²	51	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-50.9	175	-170.3	-77.2	0	0	0	111.8	L56 A266 H270 V297 V298 R300 R305 V306 L307 G308	L56-F303 HydrophobicContact CD1-CB 4.29Å; L56-F303 HydrophobicContact CD2-CD2 4.19Å; A266-F303 HydrophobicContact CB-CD2 4.28Å; A266-F303 HydrophobicContact CB-CE2 4.13Å; H270-F303 HydrophobicContact CB-CE2 4.34Å; H270-F303 HydrophobicContact CB-CZ 3.87Å; H270-F303 AromaticContact CG-CZ 3.66Å; H270-F303 AromaticContact ND1-CE1 3.91Å; H270-F303 AromaticContact ND1-CZ 3.47Å; H270-F303 WeakPolarHBondContact ND1-CZ 3.48Å; V297-F303 HydrophobicContact CG1-CD2 3.48Å; V297-F303 VanDerWaalsContact CG1-CD2 3.48Å; V297-F303 HydrophobicContact CG1-CE2 3.63Å; V297-F303 HydrophobicContact CG1-CG 4.22Å; V297-F303 HydrophobicContact CG1-CZ 4.47Å; V297-F303 WeakPolarHBondContact O-CB 3.34Å; V297-F303 WeakPolarHBondContact O-CG 3.4Å; V298-F303 HydrophobicContact CB-CD1 4.3Å; V298-F303 HydrophobicContact CB-CE1 4.09Å; V298-F303 HydrophobicContact CG1-CD1 4.39Å; V298-F303 HydrophobicContact CG1-CE1 3.74Å; V298-F303 HydrophobicContact CG1-CZ 3.97Å; R300-F303 HydrophobicContact CB-CB 3.93Å; R300-F303 PolarHBondContact O-N 3.02Å; F303-R305 VanDerWaalsContact C-N 3.29Å; F303-R305 PolarHBondContact O-N 2.95Å; F303-V306 PolarHBondContact O-N 3.09Å; F303-L307 HydrophobicContact CD1-CB 4.09Å; F303-L307 HydrophobicContact CD2-CB 4.5Å; F303-L307 HydrophobicContact CD2-CD1 3.76Å; F303-L307 HydrophobicContact CE1-CB 3.79Å; F303-L307 HydrophobicContact CE2-CB 4.25Å; F303-L307 HydrophobicContact CE2-CD1 3.44Å; F303-L307 VanDerWaalsContact CE2-CD1 3.44Å; F303-L307 HydrophobicContact CE2-CG 4.42Å; F303-L307 HydrophobicContact CG-CB 4.43Å; F303-L307 HydrophobicContact CG-CD1 4.43Å; F303-L307 HydrophobicContact CZ-CB 3.88Å; F303-L307 HydrophobicContact CZ-CD1 3.86Å; F303-L307 WeakPolarHBondContact O-CA 3.23Å; F303-L307 PolarHBondContact O-N 3Å; F303-G308 PolarHBondContact O-N 3.46Å
304	R	97.5	Very high	94	Very high	122 Å²	122	55.6 Å²	55.6	46%	0.46	27%	0.273	S	S	.	.	H	α-helix	trans	-57.1	-43.6	178.7	-73.5	175.8	162.7	171.4	-16.4	112.1	V298 E299 R300 G308	V298-R304 WeakPolarHBondContact O-CG 3.49Å; V298-R304 PolarHBondContact O-NE 3.11Å; E299-R304 PolarHBondContact O-NH1 3.39Å; E299-R304 IonicContact OE1-CZ 3.19Å; E299-R304 IonicContact OE1-NE 3.79Å; E299-R304 IonicContact OE1-NH2 2.74Å; E299-R304 PolarHBondContact OE1-NH2 2.76Å; E299-R304 IonicContact OE2-CZ 3.65Å; E299-R304 IonicContact OE2-NH1 3.13Å; E299-R304 IonicContact OE2-NH2 2.77Å; E299-R304 PolarHBondContact OE2-NH2 2.78Å; R300-R304 WeakPolarHBondContact O-CG 3.3Å; R300-R304 PolarHBondContact O-N 3.37Å; R304-G308 WeakPolarHBondContact O-CA 3.35Å; R304-G308 PolarHBondContact O-N 2.79Å; R304-G308 VanDerWaalsContact O-N 3.1Å
305	R	96.2	Very high	93.2	Very high	156 Å²	156	59 Å²	59	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-62.7	-42.7	178.9	-176.3	173.1	67	-121.7	7.5	112.4	A59 P301 A302 F303	A59-R305 VanDerWaalsContact CA-NH2 3.31Å; A59-R305 PolarHBondContact O-NH2 3.45Å; P301-R305 WeakPolarHBondContact O-CB 3.19Å; P301-R305 PolarHBondContact O-N 2.88Å; A302-R305 PolarHBondContact O-N 2.91Å; F303-R305 VanDerWaalsContact C-N 3.29Å; F303-R305 PolarHBondContact O-N 2.95Å
306	V	96.3	Very high	92.6	Very high	10 Å²	10	54.1 Å²	54.1	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-91	-42.8	-172.2	176.9	0	0	0	0	112.9	R55 A59 A302 F303	R55-V306 HydrophobicContact CB-CG1 3.44Å; R55-V306 VanDerWaalsContact CB-CG1 3.44Å; R55-V306 PolarHBondContact NH1-O 3.32Å; A59-V306 HydrophobicContact CB-CG2 3.45Å; A59-V306 VanDerWaalsContact CB-CG2 3.45Å; A302-V306 WeakPolarHBondContact O-CG2 3.16Å; A302-V306 PolarHBondContact O-N 3.42Å; F303-V306 PolarHBondContact O-N 3.09Å
307	L	96.2	Very high	92	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-116.3	-11.8	-167.6	-57.2	179.5	0	0	0	113.7	Q52 L56 V267 H270 F303 H309 V310	Q52-L307 HydrophobicContact CB-CD2 3.54Å; Q52-L307 HydrophobicContact CG-CD2 3.44Å; Q52-L307 VanDerWaalsContact CG-CD2 3.44Å; L56-L307 HydrophobicContact CD2-CD1 4.11Å; V267-L307 HydrophobicContact CG2-CD1 3.95Å; H270-L307 PolarHBondContact NE2-O 3.23Å; F303-L307 HydrophobicContact CD1-CB 4.09Å; F303-L307 HydrophobicContact CD2-CB 4.5Å; F303-L307 HydrophobicContact CD2-CD1 3.76Å; F303-L307 HydrophobicContact CE1-CB 3.79Å; F303-L307 HydrophobicContact CE2-CB 4.25Å; F303-L307 HydrophobicContact CE2-CD1 3.44Å; F303-L307 VanDerWaalsContact CE2-CD1 3.44Å; F303-L307 HydrophobicContact CE2-CG 4.42Å; F303-L307 HydrophobicContact CG-CB 4.43Å; F303-L307 HydrophobicContact CG-CD1 4.43Å; F303-L307 HydrophobicContact CZ-CB 3.88Å; F303-L307 HydrophobicContact CZ-CD1 3.86Å; F303-L307 WeakPolarHBondContact O-CA 3.23Å; F303-L307 PolarHBondContact O-N 3Å; L307-H309 PolarHBondContact O-N 2.85Å; L307-V310 HydrophobicContact CB-CG2 4.48Å; L307-V310 HydrophobicContact CD2-CG2 3.98Å; L307-V310 WeakPolarHBondContact O-CB 3.39Å; L307-V310 PolarHBondContact O-N 3.02Å
308	G	92.9	Very high	91.3	Very high	42 Å²	42	54.3 Å²	54.3	43%	0.433	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25	-173.7	0	0	0	0	0	115.2	F303 R304	F303-G308 PolarHBondContact O-N 3.46Å; R304-G308 WeakPolarHBondContact O-CA 3.35Å; R304-G308 PolarHBondContact O-N 2.79Å; R304-G308 VanDerWaalsContact O-N 3.1Å
309	H	90.4	Very high	90.7	Very high	124 Å²	124	57 Å²	57	57%	0.574	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-1.4	178.8	-58.6	-49.8	0	0	0	114.4	L307 N311 N312 I315 S316	L307-H309 PolarHBondContact O-N 2.85Å; H309-N311 VanDerWaalsContact C-N 3.33Å; H309-N311 PolarHBondContact O-N 3.14Å; H309-N312 PolarHBondContact O-N 3.38Å; H309-I315 HydrophobicContact CB-CG2 4.39Å; H309-S316 WeakPolarHBondContact O-CB 3.3Å; H309-S316 PolarHBondContact O-OG 3.18Å
310	V	89.4	Confident	90.2	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.018	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-41.8	-175.5	162.2	0	0	0	0	111.6	T46 Q47 L307 N312 S316	T46-V310 HydrophobicContact CG2-CG2 4.16Å; Q47-V310 PolarHBondContact NE2-O 3.21Å; L307-V310 HydrophobicContact CB-CG2 4.48Å; L307-V310 HydrophobicContact CD2-CG2 3.98Å; L307-V310 WeakPolarHBondContact O-CB 3.39Å; L307-V310 PolarHBondContact O-N 3.02Å; V310-N312 PolarHBondContact O-N 3.07Å; V310-S316 PolarHBondContact O-OG 3.23Å; V310-S316 VanDerWaalsContact O-OG 3.12Å
311	N	90	Very high	89.7	Confident	23 Å²	23	53.5 Å²	53.5	12%	0.123	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-7.2	179.7	-67.9	0.4	0	0	0	113.7	H165 H270 F274 H309 I313	H165-N311 PolarHBondContact ND1-O 2.85Å; H270-N311 PolarHBondContact CE1-ND2 2.91Å; H270-N311 PolarHBondContact NE2-OD1 3.43Å; F274-N311 WeakPolarHBondContact CB-OD1 3.3Å; F274-N311 HydrophobicContact CD2-CB 4.5Å; H309-N311 VanDerWaalsContact C-N 3.33Å; H309-N311 PolarHBondContact O-N 3.14Å; N311-I313 PolarHBondContact O-N 3.45Å
312	N	88.4	Confident	89.1	Confident	71 Å²	71	51.2 Å²	51.2	38%	0.38	27%	0.273	S	S	.	.			trans	-92.8	86.5	168.4	-170.8	-29.7	0	0	0	109.4	H309 V310 L314 I315 S316	H309-N312 PolarHBondContact O-N 3.38Å; V310-N312 PolarHBondContact O-N 3.07Å; N312-L314 PolarHBondContact O-N 3.42Å; N312-L314 WeakPolarHBondContact OD1-CB 3.36Å; N312-L314 PolarHBondContact OD1-N 2.94Å; N312-I315 HydrophobicContact CB-CB 4.37Å; N312-I315 HydrophobicContact CB-CD1 4.45Å; N312-I315 VanDerWaalsContact ND2-CD1 3.27Å; N312-I315 WeakPolarHBondContact ND2-CD1 3.38Å; N312-I315 PolarHBondContact O-N 3.25Å; N312-I315 VanDerWaalsContact O-N 3.08Å; N312-I315 PolarHBondContact OD1-N 3.22Å; N312-S316 WeakPolarHBondContact O-CB 3.39Å; N312-S316 PolarHBondContact O-N 2.95Å; N312-S316 PolarHBondContact O-OG 3.36Å
313	I	83.4	Confident	88.6	Confident	23 Å²	23	55.4 Å²	55.4	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-31	-176.1	-68.7	-63.2	0	0	0	113.1	Q47 P167 F274 N311 I315 S316 A317 V318	Q47-I313 HydrophobicContact CG-CD1 4.46Å; P167-I313 HydrophobicContact CG-CB 4.47Å; P167-I313 HydrophobicContact CG-CG2 3.75Å; F274-I313 HydrophobicContact CD2-CD1 4.43Å; F274-I313 HydrophobicContact CE2-CD1 3.31Å; F274-I313 HydrophobicContact CE2-CG1 3.5Å; F274-I313 VanDerWaalsContact CE2-CG1 3.5Å; F274-I313 HydrophobicContact CZ-CD1 3.54Å; F274-I313 HydrophobicContact CZ-CG1 3.98Å; N311-I313 PolarHBondContact O-N 3.45Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 2.86Å; I313-S316 WeakPolarHBondContact CA-OG 3.45Å; I313-A317 HydrophobicContact CG2-CB 4.34Å; I313-A317 PolarHBondContact O-N 2.97Å; I313-V318 HydrophobicContact CG2-CG2 3.92Å; I313-V318 PolarHBondContact O-N 3.03Å
314	L	80.3	Confident	88.2	Confident	101 Å²	101	57.9 Å²	57.9	53%	0.529	30%	0.3	S	S	.	.	I	π-helix	trans	-59.6	-49.1	175.9	-179.6	62.6	0	0	0	110.4	N312 V318 L319	N312-L314 PolarHBondContact O-N 3.42Å; N312-L314 WeakPolarHBondContact OD1-CB 3.36Å; N312-L314 PolarHBondContact OD1-N 2.94Å; L314-V318 HydrophobicContact CD1-CB 4.21Å; L314-V318 HydrophobicContact CD1-CG1 4.13Å; L314-L319 HydrophobicContact CD1-CD2 4.46Å; L314-L319 HydrophobicContact CD1-CG 4.06Å; L314-L319 HydrophobicContact CG-CD1 4.17Å; L314-L319 HydrophobicContact CG-CG 4.19Å; L314-L319 VanDerWaalsContact O-CB 3.3Å; L314-L319 WeakPolarHBondContact O-CB 3.26Å; L314-L319 VanDerWaalsContact O-CG 3.25Å; L314-L319 WeakPolarHBondContact O-CG 3.39Å; L314-L319 PolarHBondContact O-N 2.96Å
315	I	82.8	Confident	87.7	Confident	82 Å²	82	54.9 Å²	54.9	42%	0.421	30%	0.295	S	S	.	.	I	π-helix	trans	-75.8	-42.1	-177.9	-63	179.4	0	0	0	111.8	H309 N312 I313 P320	H309-I315 HydrophobicContact CB-CG2 4.39Å; N312-I315 HydrophobicContact CB-CB 4.37Å; N312-I315 HydrophobicContact CB-CD1 4.45Å; N312-I315 VanDerWaalsContact ND2-CD1 3.27Å; N312-I315 WeakPolarHBondContact ND2-CD1 3.38Å; N312-I315 PolarHBondContact O-N 3.25Å; N312-I315 VanDerWaalsContact O-N 3.08Å; N312-I315 PolarHBondContact OD1-N 3.22Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 2.86Å; I315-P320 WeakPolarHBondContact O-CD 3.44Å; I315-P320 VanDerWaalsContact O-CG 3.31Å; I315-P320 WeakPolarHBondContact O-CG 3.45Å
316	S	83.2	Confident	87.2	Confident	10 Å²	10	49.2 Å²	49.2	7%	0.07	28%	0.282	C	S	.	.	I	π-helix	trans	-90.6	-15.1	-168.2	57.2	0	0	0	0	114.9	Q47 H309 V310 N312 I313	Q47-S316 PolarHBondContact NE2-OG 3.02Å; H309-S316 WeakPolarHBondContact O-CB 3.3Å; H309-S316 PolarHBondContact O-OG 3.18Å; V310-S316 PolarHBondContact O-OG 3.23Å; V310-S316 VanDerWaalsContact O-OG 3.12Å; N312-S316 WeakPolarHBondContact O-CB 3.39Å; N312-S316 PolarHBondContact O-N 2.95Å; N312-S316 PolarHBondContact O-OG 3.36Å; I313-S316 WeakPolarHBondContact CA-OG 3.45Å
317	A	83.6	Confident	86.7	Confident	14 Å²	14	57.7 Å²	57.7	12%	0.116	31%	0.313	C	S	.	.	I	π-helix	trans	-136	-53.5	-179.7	0	0	0	0	0	113	Q47 I313 P320 V321	Q47-A317 HydrophobicContact CG-CB 4.06Å; I313-A317 HydrophobicContact CG2-CB 4.34Å; I313-A317 PolarHBondContact O-N 2.97Å; A317-P320 WeakPolarHBondContact O-CD 3.28Å; A317-V321 WeakPolarHBondContact O-CB 3.15Å; A317-V321 WeakPolarHBondContact O-CG2 3.42Å; A317-V321 PolarHBondContact O-N 2.81Å
318	V	83.1	Confident	86	Confident	56 Å²	56	65.7 Å²	65.7	34%	0.339	35%	0.348	S	S	.	.	I	π-helix	trans	-68	-52.2	-171	177.5	0	0	0	0	112	I313 L314 V321 A322	I313-V318 HydrophobicContact CG2-CG2 3.92Å; I313-V318 PolarHBondContact O-N 3.03Å; L314-V318 HydrophobicContact CD1-CB 4.21Å; L314-V318 HydrophobicContact CD1-CG1 4.13Å; V318-V321 PolarHBondContact O-N 2.75Å; V318-A322 WeakPolarHBondContact O-CB 3.43Å; V318-A322 PolarHBondContact O-N 2.63Å
319	L	84.5	Confident	85.2	Confident	95 Å²	95	69.4 Å²	69.4	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-45.7	179.1	-72.2	174.5	0	0	0	112.4	L314 V321 A322 F323	L314-L319 HydrophobicContact CD1-CD2 4.46Å; L314-L319 HydrophobicContact CD1-CG 4.06Å; L314-L319 HydrophobicContact CG-CD1 4.17Å; L314-L319 HydrophobicContact CG-CG 4.19Å; L314-L319 VanDerWaalsContact O-CB 3.3Å; L314-L319 WeakPolarHBondContact O-CB 3.26Å; L314-L319 VanDerWaalsContact O-CG 3.25Å; L314-L319 WeakPolarHBondContact O-CG 3.39Å; L314-L319 PolarHBondContact O-N 2.96Å; L319-V321 VanDerWaalsContact C-N 3.34Å; L319-V321 PolarHBondContact O-N 2.88Å; L319-A322 PolarHBondContact O-N 3.38Å; L319-F323 WeakPolarHBondContact O-CB 3.29Å; L319-F323 PolarHBondContact O-N 3.11Å
320	P	86.2	Confident	84.3	Confident	47 Å²	47	65 Å²	65	31%	0.305	34%	0.342	S	S	.	.	H	α-helix	trans	-57	-43.8	174	-28.4	34.8	0	0	0	113.4	I315 A317 F323 R324	I315-P320 WeakPolarHBondContact O-CD 3.44Å; I315-P320 VanDerWaalsContact O-CG 3.31Å; I315-P320 WeakPolarHBondContact O-CG 3.45Å; A317-P320 WeakPolarHBondContact O-CD 3.28Å; P320-F323 PolarHBondContact O-N 2.79Å; P320-R324 WeakPolarHBondContact O-CG 3.34Å; P320-R324 PolarHBondContact O-N 3.09Å
321	V	86.4	Confident	83	Confident	31 Å²	31	68.9 Å²	68.9	19%	0.188	37%	0.367	C	S	.	.	H	α-helix	trans	-64.8	-47.4	177.6	169.4	0	0	0	0	110.7	P73 L74 A317 V318 L319 F323 R324 V325	P73-V321 HydrophobicContact CB-CG2 4.01Å; P73-V321 HydrophobicContact CG-CG2 4.09Å; L74-V321 HydrophobicContact CD1-CG1 4.43Å; L74-V321 HydrophobicContact CD2-CG1 3.92Å; L74-V321 HydrophobicContact CG-CG1 4.1Å; A317-V321 WeakPolarHBondContact O-CB 3.15Å; A317-V321 WeakPolarHBondContact O-CG2 3.42Å; A317-V321 PolarHBondContact O-N 2.81Å; V318-V321 PolarHBondContact O-N 2.75Å; L319-V321 VanDerWaalsContact C-N 3.34Å; L319-V321 PolarHBondContact O-N 2.88Å; V321-F323 VanDerWaalsContact C-N 3.31Å; V321-F323 PolarHBondContact O-N 2.69Å; V321-R324 PolarHBondContact O-N 3.02Å; V321-V325 HydrophobicContact CG1-CG2 4.5Å; V321-V325 WeakPolarHBondContact O-CG2 3.45Å; V321-V325 PolarHBondContact O-N 3.3Å
322	A	84.1	Confident	81.5	Confident	55 Å²	55	75.1 Å²	75.1	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-59.1	-42.8	177.7	0	0	0	0	0	111.8	V318 L319 V325 A326	V318-A322 WeakPolarHBondContact O-CB 3.43Å; V318-A322 PolarHBondContact O-N 2.63Å; L319-A322 PolarHBondContact O-N 3.38Å; A322-V325 PolarHBondContact O-N 2.89Å; A322-A326 WeakPolarHBondContact O-CB 3.43Å; A322-A326 PolarHBondContact O-N 3.5Å
323	F	87.8	Confident	79.9	Confident	94 Å²	94	79.5 Å²	79.5	41%	0.412	43%	0.428	S	S	.	.	H	α-helix	trans	-63.8	-42.9	176.4	-176.2	-99	0	0	0	112.3	L319 P320 V321 A326 R327 L339 L343	L319-F323 WeakPolarHBondContact O-CB 3.29Å; L319-F323 PolarHBondContact O-N 3.11Å; P320-F323 PolarHBondContact O-N 2.79Å; V321-F323 VanDerWaalsContact C-N 3.31Å; V321-F323 PolarHBondContact O-N 2.69Å; F323-A326 PolarHBondContact O-N 3.26Å; F323-R327 WeakPolarHBondContact O-CB 3.46Å; F323-R327 PolarHBondContact O-N 3.28Å; F323-L339 HydrophobicContact CD2-CD2 4.39Å; F323-L339 HydrophobicContact CE2-CD2 3.92Å; F323-L343 HydrophobicContact CD2-CD1 4.04Å; F323-L343 HydrophobicContact CE2-CD1 4.46Å
324	R	89.2	Confident	78.2	Confident	57 Å²	57	81 Å²	81	22%	0.215	44%	0.438	C	S	.	.	H	α-helix	trans	-60.2	-46.4	174.5	-78.9	179.1	-158.8	-122.5	-4	112.2	D69 L74 E76 P320 V321 A326 R327 K328	D69-R324 VanDerWaalsContact CB-NH2 3.32Å; D69-R324 VanDerWaalsContact O-CZ 3.28Å; D69-R324 PolarHBondContact O-NH1 2.71Å; D69-R324 PolarHBondContact O-NH2 2.64Å; D69-R324 IonicContact OD1-CZ 2.65Å; D69-R324 IonicContact OD1-NH2 2.71Å; D69-R324 PolarHBondContact OD1-NH2 3.23Å; L74-R324 HydrophobicContact CD1-CB 3.71Å; L74-R324 HydrophobicContact CD1-CG 4.42Å; E76-R324 IonicContact OE1-CZ 2.94Å; E76-R324 IonicContact OE1-NH1 3.88Å; E76-R324 PolarHBondContact OE1-NH1 3.41Å; E76-R324 IonicContact OE2-CZ 3Å; E76-R324 IonicContact OE2-NH1 2.71Å; E76-R324 PolarHBondContact OE2-NH1 3.34Å; P320-R324 WeakPolarHBondContact O-CG 3.34Å; P320-R324 PolarHBondContact O-N 3.09Å; V321-R324 PolarHBondContact O-N 3.02Å; R324-A326 VanDerWaalsContact C-N 3.34Å; R324-R327 PolarHBondContact O-N 2.94Å; R324-K328 WeakPolarHBondContact O-CB 3.45Å; R324-K328 PolarHBondContact O-N 2.85Å
325	V	86.9	Confident	76.8	Confident	58 Å²	58	78.2 Å²	78.2	35%	0.352	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-44.7	178.4	172.7	0	0	0	0	110.4	L74 V321 A322 R327 K328 N329	L74-V325 HydrophobicContact CD1-CG2 4.3Å; L74-V325 HydrophobicContact CD2-CG2 3.74Å; V321-V325 HydrophobicContact CG1-CG2 4.5Å; V321-V325 WeakPolarHBondContact O-CG2 3.45Å; V321-V325 PolarHBondContact O-N 3.3Å; A322-V325 PolarHBondContact O-N 2.89Å; V325-R327 PolarHBondContact O-N 3.01Å; V325-K328 PolarHBondContact O-N 3.26Å; V325-N329 WeakPolarHBondContact O-CB 3.1Å; V325-N329 PolarHBondContact O-N 2.9Å; V325-N329 PolarHBondContact O-ND2 2.74Å
326	A	86.2	Confident	75.4	Confident	38 Å²	38	80.2 Å²	80.2	31%	0.314	45%	0.45	S	S	.	.	H	α-helix	trans	-60.1	-44.2	175.3	0	0	0	0	0	111.8	A322 F323 R324 N329 A330 L339	A322-A326 WeakPolarHBondContact O-CB 3.43Å; A322-A326 PolarHBondContact O-N 3.5Å; F323-A326 PolarHBondContact O-N 3.26Å; R324-A326 VanDerWaalsContact C-N 3.34Å; A326-N329 PolarHBondContact O-N 3.28Å; A326-A330 WeakPolarHBondContact O-CB 3.49Å; A326-A330 PolarHBondContact O-N 3.32Å; A326-L339 HydrophobicContact CB-CD2 4.4Å
327	R	85.5	Confident	74	Confident	188 Å²	188	85.6 Å²	85.6	71%	0.709	48%	0.483	S	S	*	.	H	α-helix	trans	-65.2	-39.4	178.1	-163.5	179.9	91.8	165.3	4.5	112.5	F323 R324 V325	F323-R327 WeakPolarHBondContact O-CB 3.46Å; F323-R327 PolarHBondContact O-N 3.28Å; R324-R327 PolarHBondContact O-N 2.94Å; V325-R327 PolarHBondContact O-N 3.01Å
328	K	82.1	Confident	72.5	Confident	168 Å²	168	90.3 Å²	90.3	73%	0.73	51%	0.506	S	S	*	.	H	α-helix	trans	-68.1	-35.4	179.2	-172.7	173.4	-178.1	171.6	0	112.2	R324 V325	R324-K328 WeakPolarHBondContact O-CB 3.45Å; R324-K328 PolarHBondContact O-N 2.85Å; V325-K328 PolarHBondContact O-N 3.26Å
329	N	76.1	Confident	71.1	Confident	119 Å²	119	89.4 Å²	89.4	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-95.4	-3.5	-178.4	-64.1	-28.8	0	0	0	113.5	V325 A326	V325-N329 WeakPolarHBondContact O-CB 3.1Å; V325-N329 PolarHBondContact O-N 2.9Å; V325-N329 PolarHBondContact O-ND2 2.74Å; A326-N329 PolarHBondContact O-N 3.28Å
330	A	71.9	Confident	69.9	Low	31 Å²	31	89.7 Å²	89.7	26%	0.256	50%	0.504	S	S	.	.	S	Bend	trans	-67.3	126	176.8	0	0	0	0	0	109.5	A326 V332 L339	A326-A330 WeakPolarHBondContact O-CB 3.49Å; A326-A330 PolarHBondContact O-N 3.32Å; A330-V332 PolarHBondContact O-N 3.25Å; A330-L339 HydrophobicContact CB-CD1 4.1Å
331	P	61.9	Low	68.8	Low	85 Å²	85	89.8 Å²	89.8	55%	0.552	51%	0.514	S	S	*	.			trans	-60.1	137.4	171.4	11.4	-11.5	0	0	0	109	I333 V334	P331-I333 PolarHBondContact O-N 3.17Å; P331-V334 HydrophobicContact CG-CG2 3.95Å; P331-V334 PolarHBondContact O-N 3.49Å
332	V	59	Low	67.9	Low	155 Å²	155	93 Å²	93	94%	0.939	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-17.6	-175.4	178.2	0	0	0	0	113.7	A330	A330-V332 PolarHBondContact O-N 3.25Å
333	I	53.6	Low	67	Low	163 Å²	163	94.4 Å²	94.4	84%	0.836	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-17.3	-179.2	-60.3	167.8	0	0	0	112.9	P331 G335	P331-I333 PolarHBondContact O-N 3.17Å; I333-G335 PolarHBondContact O-N 2.95Å
334	V	48.5	Very low	66.2	Low	53 Å²	53	91.7 Å²	91.7	32%	0.321	53%	0.531	S	S	.	.	S	Bend	trans	-91	93	-175.9	-173.5	0	0	0	0	109.9	P331 L338	P331-V334 HydrophobicContact CG-CG2 3.95Å; P331-V334 PolarHBondContact O-N 3.49Å; V334-L338 HydrophobicContact CG1-CB 3.66Å; V334-L338 HydrophobicContact CG1-CD2 3.67Å; V334-L338 HydrophobicContact CG1-CG 4.29Å
335	G	50	Low	65.5	Low	44 Å²	44	90.5 Å²	90.5	45%	0.454	54%	0.536	S	S	.	.			trans	-53.1	150.6	174.3	0	0	0	0	0	113	I333 T337 L338	I333-G335 PolarHBondContact O-N 2.95Å; G335-T337 PolarHBondContact O-N 2.9Å; G335-L338 PolarHBondContact O-N 3.41Å
336	T	52.9	Low	65	Low	124 Å²	124	90.5 Å²	90.5	76%	0.761	54%	0.542	S	S	*	.	H	α-helix	trans	-49.3	-27.2	-174.6	44.6	0	0	0	0	114.9
337	T	53.7	Low	64.4	Low	122 Å²	122	93.1 Å²	93.1	75%	0.748	56%	0.555	S	S	*	*	H	α-helix	trans	-66.7	-34.2	178.1	17.1	0	0	0	0	114.3	G335 G341	G335-T337 PolarHBondContact O-N 2.9Å; T337-G341 PolarHBondContact O-N 3.46Å
338	L	53.9	Low	64.1	Low	114 Å²	114	91 Å²	91	60%	0.597	55%	0.547	S	S	*	.	H	α-helix	trans	-76.9	-35.3	-177.8	-153.4	86.9	0	0	0	111.7	V334 G335 G341 V342	V334-L338 HydrophobicContact CG1-CB 3.66Å; V334-L338 HydrophobicContact CG1-CD2 3.67Å; V334-L338 HydrophobicContact CG1-CG 4.29Å; G335-L338 PolarHBondContact O-N 3.41Å; L338-G341 PolarHBondContact O-N 3.01Å; L338-V342 WeakPolarHBondContact O-CG2 3.41Å; L338-V342 PolarHBondContact O-N 3.15Å
339	L	53.6	Low	63.9	Low	37 Å²	37	88.4 Å²	88.4	19%	0.194	54%	0.541	C	S	.	.	H	α-helix	trans	-66.3	-40.4	-179.1	-144.6	100.1	0	0	0	111.6	F323 A326 A330 G341 L343	F323-L339 HydrophobicContact CD2-CD2 4.39Å; F323-L339 HydrophobicContact CE2-CD2 3.92Å; A326-L339 HydrophobicContact CB-CD2 4.4Å; A330-L339 HydrophobicContact CB-CD1 4.1Å; L339-G341 VanDerWaalsContact C-N 3.35Å; L339-L343 WeakPolarHBondContact O-CG 3.47Å; L339-L343 PolarHBondContact O-N 3.45Å; L339-L343 VanDerWaalsContact O-N 3.16Å
340	V	57.7	Low	63.9	Low	101 Å²	101	85.3 Å²	85.3	61%	0.612	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-38	173.9	178	0	0	0	0	110.9	G344	V340-G344 PolarHBondContact O-N 3.17Å
341	G	63.5	Low	64.5	Low	49 Å²	49	89.5 Å²	89.5	51%	0.505	54%	0.544	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.4	0	0	0	0	0	113.6	T337 L338 L339 G345	T337-G341 PolarHBondContact O-N 3.46Å; L338-G341 PolarHBondContact O-N 3.01Å; L339-G341 VanDerWaalsContact C-N 3.35Å; G341-G345 PolarHBondContact O-N 3.23Å
342	V	67.5	Low	65.1	Low	98 Å²	98	88.6 Å²	88.6	59%	0.594	54%	0.535	S	S	*	.	H	α-helix	trans	-69.8	-42.6	178.4	174.7	0	0	0	0	111.5	L338 G345 A346	L338-V342 WeakPolarHBondContact O-CG2 3.41Å; L338-V342 PolarHBondContact O-N 3.15Å; V342-G345 PolarHBondContact O-N 3.25Å; V342-A346 WeakPolarHBondContact O-CB 3.02Å; V342-A346 PolarHBondContact O-N 3.42Å
343	L	65.1	Low	66.1	Low	85 Å²	85	88.9 Å²	88.9	45%	0.445	52%	0.52	S	S	.	.	H	α-helix	trans	-69.3	-39.6	177.5	-71.9	170.1	0	0	0	112.2	F323 L339 A346 T347	F323-L343 HydrophobicContact CD2-CD1 4.04Å; F323-L343 HydrophobicContact CE2-CD1 4.46Å; L339-L343 WeakPolarHBondContact O-CG 3.47Å; L339-L343 PolarHBondContact O-N 3.45Å; L339-L343 VanDerWaalsContact O-N 3.16Å; L343-A346 PolarHBondContact O-N 2.77Å; L343-T347 PolarHBondContact O-N 3.43Å; L343-T347 PolarHBondContact O-OG1 2.92Å
344	G	72.4	Confident	67.2	Low	37 Å²	37	86.6 Å²	86.6	38%	0.381	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-40.2	172.4	0	0	0	0	0	112.4	V340 T347 Y348	V340-G344 PolarHBondContact O-N 3.17Å; G344-T347 WeakPolarHBondContact CA-OG1 3.42Å; G344-T347 PolarHBondContact O-OG1 2.93Å; G344-Y348 VanDerWaalsContact O-CB 3.23Å; G344-Y348 WeakPolarHBondContact O-CB 3.44Å; G344-Y348 PolarHBondContact O-N 3.44Å
345	G	74.5	Confident	68.4	Low	31 Å²	31	90.3 Å²	90.3	32%	0.32	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-44.3	175	0	0	0	0	0	112.8	G341 V342 Y348 L349	G341-G345 PolarHBondContact O-N 3.23Å; V342-G345 PolarHBondContact O-N 3.25Å; G345-Y348 PolarHBondContact O-N 3.11Å; G345-L349 WeakPolarHBondContact O-CB 3.4Å; G345-L349 VanDerWaalsContact O-CG 3.24Å; G345-L349 WeakPolarHBondContact O-CG 3.45Å; G345-L349 PolarHBondContact O-N 3.25Å
346	A	74.8	Confident	69.4	Low	58 Å²	58	95.3 Å²	95.3	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-41.6	178.3	0	0	0	0	0	112.4	V342 L343 L349 A350	V342-A346 WeakPolarHBondContact O-CB 3.02Å; V342-A346 PolarHBondContact O-N 3.42Å; L343-A346 PolarHBondContact O-N 2.77Å; A346-L349 PolarHBondContact O-N 3.03Å; A346-A350 WeakPolarHBondContact O-CB 3.39Å; A346-A350 PolarHBondContact O-N 2.85Å
347	T	74.6	Confident	70.3	Confident	94 Å²	94	97 Å²	97	58%	0.577	52%	0.521	S	S	*	.	H	α-helix	trans	-67.8	-39.7	175.5	42.2	0	0	0	0	112.2	L343 G344 A350 F351	L343-T347 PolarHBondContact O-N 3.43Å; L343-T347 PolarHBondContact O-OG1 2.92Å; G344-T347 WeakPolarHBondContact CA-OG1 3.42Å; G344-T347 PolarHBondContact O-OG1 2.93Å; T347-A350 PolarHBondContact O-N 3.19Å; T347-F351 WeakPolarHBondContact O-CB 3.41Å; T347-F351 PolarHBondContact O-N 3.26Å
348	Y	79	Confident	70.9	Confident	142 Å²	142	97.5 Å²	97.5	56%	0.557	52%	0.518	S	S	*	.	H	α-helix	trans	-63.8	-41.1	174.2	-177.5	-108.9	0	0	0	112.5	G344 G345 F351 L352	G344-Y348 VanDerWaalsContact O-CB 3.23Å; G344-Y348 WeakPolarHBondContact O-CB 3.44Å; G344-Y348 PolarHBondContact O-N 3.44Å; G345-Y348 PolarHBondContact O-N 3.11Å; Y348-F351 WeakPolarHBondContact O-CB 3.49Å; Y348-F351 PolarHBondContact O-N 3.14Å; Y348-L352 HydrophobicContact CD1-CD1 3.84Å; Y348-L352 HydrophobicContact CD1-CG 4.39Å; Y348-L352 HydrophobicContact CE1-CD1 3.36Å; Y348-L352 HydrophobicContact CE1-CG 4.06Å; Y348-L352 HydrophobicContact CE2-CG 4.48Å; Y348-L352 WeakPolarHBondContact O-CG 3.37Å; Y348-L352 PolarHBondContact O-N 3.46Å
349	L	77.4	Confident	71.2	Confident	115 Å²	115	95.6 Å²	95.6	60%	0.602	51%	0.514	S	S	*	.	H	α-helix	trans	-67.1	-39.5	176.1	-73.3	169.3	0	0	0	112.2	G345 A346 F351 L352 Y353	G345-L349 WeakPolarHBondContact O-CB 3.4Å; G345-L349 VanDerWaalsContact O-CG 3.24Å; G345-L349 WeakPolarHBondContact O-CG 3.45Å; G345-L349 PolarHBondContact O-N 3.25Å; A346-L349 PolarHBondContact O-N 3.03Å; L349-F351 VanDerWaalsContact C-N 3.33Å; L349-L352 PolarHBondContact O-N 3.36Å; L349-Y353 WeakPolarHBondContact O-CB 3.46Å; L349-Y353 PolarHBondContact O-N 3.22Å
350	A	76.8	Confident	71.2	Confident	53 Å²	53	100.1 Å²	100.1	44%	0.438	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-40.6	173.4	0	0	0	0	0	111.8	A346 T347 Y353 M354	A346-A350 WeakPolarHBondContact O-CB 3.39Å; A346-A350 PolarHBondContact O-N 2.85Å; T347-A350 PolarHBondContact O-N 3.19Å; A350-Y353 PolarHBondContact O-N 2.64Å; A350-M354 WeakPolarHBondContact O-CG 3.49Å; A350-M354 PolarHBondContact O-N 3.45Å
351	F	83.7	Confident	70.9	Confident	119 Å²	119	104.1 Å²	104.1	52%	0.522	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-46.5	173.7	174.6	-99.7	0	0	0	112.2	T347 Y348 L349 Y353 M354 K355	T347-F351 WeakPolarHBondContact O-CB 3.41Å; T347-F351 PolarHBondContact O-N 3.26Å; Y348-F351 WeakPolarHBondContact O-CB 3.49Å; Y348-F351 PolarHBondContact O-N 3.14Å; L349-F351 VanDerWaalsContact C-N 3.33Å; F351-Y353 VanDerWaalsContact C-N 3.32Å; F351-Y353 PolarHBondContact O-N 2.93Å; F351-M354 PolarHBondContact O-N 2.78Å; F351-K355 HydrophobicContact CE1-CD 4.45Å; F351-K355 WeakPolarHBondContact O-CB 3.41Å; F351-K355 PolarHBondContact O-N 3.08Å
352	L	75.4	Confident	70	Confident	66 Å²	66	109.4 Å²	109.4	35%	0.346	58%	0.577	S	S	.	*	H	α-helix	trans	-62.1	-39.6	176.4	-75.6	178.4	0	0	0	112.4	Y348 L349 K355 K356	Y348-L352 HydrophobicContact CD1-CD1 3.84Å; Y348-L352 HydrophobicContact CD1-CG 4.39Å; Y348-L352 HydrophobicContact CE1-CD1 3.36Å; Y348-L352 HydrophobicContact CE1-CG 4.06Å; Y348-L352 HydrophobicContact CE2-CG 4.48Å; Y348-L352 WeakPolarHBondContact O-CG 3.37Å; Y348-L352 PolarHBondContact O-N 3.46Å; L349-L352 PolarHBondContact O-N 3.36Å; L352-K355 PolarHBondContact O-N 2.98Å; L352-K356 WeakPolarHBondContact O-CB 3.46Å; L352-K356 PolarHBondContact O-N 3.3Å
353	Y	80.4	Confident	70.1	Confident	161 Å²	161	110 Å²	110	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-63.1	-45.7	176.2	-178.2	-100.6	0	0	0	111.6	L349 A350 F351 K356 R357	L349-Y353 WeakPolarHBondContact O-CB 3.46Å; L349-Y353 PolarHBondContact O-N 3.22Å; A350-Y353 PolarHBondContact O-N 2.64Å; F351-Y353 VanDerWaalsContact C-N 3.32Å; F351-Y353 PolarHBondContact O-N 2.93Å; Y353-K356 PolarHBondContact O-N 3.35Å; Y353-R357 WeakPolarHBondContact O-CB 3.28Å; Y353-R357 PolarHBondContact O-N 3.24Å
354	M	74.9	Confident	70.3	Confident	115 Å²	115	111.3 Å²	111.3	57%	0.567	58%	0.583	S	S	*	*	H	α-helix	trans	-64.7	-41.4	175.4	-73.5	-158.8	-69.9	0	0	112.5	A350 F351 K356 R357 L358	A350-M354 WeakPolarHBondContact O-CG 3.49Å; A350-M354 PolarHBondContact O-N 3.45Å; F351-M354 PolarHBondContact O-N 2.78Å; M354-K356 PolarHBondContact O-N 3.2Å; M354-R357 PolarHBondContact O-N 3.44Å; M354-L358 WeakPolarHBondContact O-CG 3.48Å; M354-L358 PolarHBondContact O-N 2.72Å
355	K	75.8	Confident	70.2	Confident	131 Å²	131	115.4 Å²	115.4	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-60.3	-44.4	175.9	-173.2	180	178.7	-179.7	0	111.8	F351 L352 R357 L358 S359	F351-K355 HydrophobicContact CE1-CD 4.45Å; F351-K355 WeakPolarHBondContact O-CB 3.41Å; F351-K355 PolarHBondContact O-N 3.08Å; L352-K355 PolarHBondContact O-N 2.98Å; K355-R357 VanDerWaalsContact C-N 3.31Å; K355-R357 PolarHBondContact O-N 2.8Å; K355-L358 PolarHBondContact O-N 3.47Å; K355-S359 PolarHBondContact O-N 3.06Å; K355-S359 VanDerWaalsContact O-N 3.09Å; K355-S359 PolarHBondContact O-OG 2.99Å
356	K	70	Confident	70	Confident	149 Å²	149	120.4 Å²	120.4	65%	0.648	61%	0.61	S	S	*	*	H	α-helix	trans	-66.1	-33.7	177.7	-168.2	177.1	-177.8	-179.3	0	112.4	L352 Y353 M354 S359	L352-K356 WeakPolarHBondContact O-CB 3.46Å; L352-K356 PolarHBondContact O-N 3.3Å; Y353-K356 PolarHBondContact O-N 3.35Å; M354-K356 PolarHBondContact O-N 3.2Å; K356-S359 WeakPolarHBondContact CA-OG 3.35Å; K356-S359 PolarHBondContact O-OG 2.76Å
357	R	71.9	Confident	69.7	Low	161 Å²	161	124.3 Å²	124.3	61%	0.608	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-36.2	175.3	-162.8	179.8	-176.9	-171.5	0.8	111.9	Y353 M354 K355 L360 F361	Y353-R357 WeakPolarHBondContact O-CB 3.28Å; Y353-R357 PolarHBondContact O-N 3.24Å; M354-R357 PolarHBondContact O-N 3.44Å; K355-R357 VanDerWaalsContact C-N 3.31Å; K355-R357 PolarHBondContact O-N 2.8Å; R357-L360 PolarHBondContact O-N 3.48Å; R357-F361 WeakPolarHBondContact O-CD2 3.43Å
358	L	66.1	Low	69.4	Low	132 Å²	132	126.3 Å²	126.3	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-71.6	-33.1	176.5	-73.8	161.9	0	0	0	112.7	M354 K355 L360 F361	M354-L358 WeakPolarHBondContact O-CG 3.48Å; M354-L358 PolarHBondContact O-N 2.72Å; K355-L358 PolarHBondContact O-N 3.47Å; L358-L360 PolarHBondContact O-N 3.24Å; L358-F361 PolarHBondContact O-N 2.91Å
359	S	60	Low	68.7	Low	74 Å²	74	125.1 Å²	125.1	52%	0.517	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-4.4	174.9	60.2	0	0	0	0	114.8	K355 K356	K355-S359 PolarHBondContact O-N 3.06Å; K355-S359 VanDerWaalsContact O-N 3.09Å; K355-S359 PolarHBondContact O-OG 2.99Å; K356-S359 WeakPolarHBondContact CA-OG 3.35Å; K356-S359 PolarHBondContact O-OG 2.76Å
360	L	53.8	Low	68	Low	132 Å²	132	125.9 Å²	125.9	69%	0.691	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-2.2	174.3	-77	162.7	0	0	0	112.7	R357 L358	R357-L360 PolarHBondContact O-N 3.48Å; L358-L360 PolarHBondContact O-N 3.24Å
361	F	52.3	Low	67.3	Low	184 Å²	184	132 Å²	132	81%	0.807	64%	0.643	S	S	*	*			trans	-116.4	11.3	177.3	-75.7	-81	0	0	0	113.2	R357 L358	R357-F361 WeakPolarHBondContact O-CD2 3.43Å; L358-F361 PolarHBondContact O-N 2.91Å
362	S	42.8	Very low	65.8	Low	160 Å²	160	133.2 Å²	133.2	100%	1.119	65%	0.654	S	S	*	*			trans	-112.7	0	163	171.9	0	0	0	0	108.4

Retrieved 362 of 362 residues in 70.3 ms (Link to these results)

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