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ATP-binding cassette sub-family G member 3

AlphaFold DB , UniProt , Accession Q99P81, Species MOUSE (Mus musculus, Mouse), Gene Abcg3, Length 650 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	31.5	Very low	30.7	Very low	248 Å²	248	142.1 Å²	142.1	100%	1.222	84%	0.84	S	S	*	*				0	124.7	0	-84.3	176.4	166.7	0	0	108
2	A	33.5	Very low	30.7	Very low	109 Å²	109	143.5 Å²	143.5	90%	0.901	84%	0.835	S	S	*	*			trans	57.7	107.7	171.8	0	0	0	0	0	118.8
3	S	31.8	Very low	30.3	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	82%	0.824	S	S	*	*			trans	-84.8	153.8	173.8	55.6	0	0	0	0	113.1
4	N	31.6	Very low	30	Very low	156 Å²	156	145.4 Å²	145.4	83%	0.834	83%	0.825	S	S	*	*			trans	-54.7	138.8	171.5	-69.2	-21	0	0	0	113.8
5	N	35.9	Very low	29.7	Very low	161 Å²	161	150.4 Å²	150.4	86%	0.861	83%	0.825	S	S	*	*			trans	-117.7	106	162	-90.1	-12.6	0	0	0	108.6
6	D	31.3	Very low	29.5	Very low	151 Å²	151	152.7 Å²	152.7	81%	0.807	83%	0.828	S	S	*	*			trans	-93.1	138.1	156.7	-89.4	-37	0	0	0	108.5	T8	D6-T8 PolarHBondContact O-N 3.36Å
7	P	33	Very low	29.4	Very low	118 Å²	118	153.1 Å²	153.1	77%	0.766	83%	0.828	S	S	*	*			trans	-83.4	108.9	177.1	32	-28	0	0	0	109.8	V9	P7-V9 PolarHBondContact O-N 3.32Å
8	T	29.3	Very low	29.1	Very low	119 Å²	119	150.3 Å²	150.3	73%	0.73	82%	0.821	S	S	*	*			trans	-59.2	121.3	166.5	42	0	0	0	0	111.3	D6 I10	D6-T8 PolarHBondContact O-N 3.36Å; T8-I10 PolarHBondContact O-N 3.3Å
9	V	26.4	Very low	28.9	Very low	149 Å²	149	150.2 Å²	150.2	90%	0.903	82%	0.82	S	S	*	*			trans	-72.5	107.3	166.9	176.6	0	0	0	0	108.2	P7	P7-V9 PolarHBondContact O-N 3.32Å
10	I	29.2	Very low	28.8	Very low	132 Å²	132	151.4 Å²	151.4	68%	0.677	82%	0.824	S	S	*	*			trans	-88.9	121.8	176.9	-65.7	172	0	0	0	108.9	T8	T8-I10 PolarHBondContact O-N 3.3Å
11	S	24.9	Very low	28.7	Very low	109 Å²	109	149.1 Å²	149.1	76%	0.762	82%	0.817	S	S	*	*			trans	-71.1	131.9	162.7	51.1	0	0	0	0	109.6
12	M	30.4	Very low	28.5	Very low	159 Å²	159	146.7 Å²	146.7	78%	0.783	80%	0.803	S	S	*	*			trans	-106.8	114.3	173.1	-93.3	-163.7	174.2	0	0	111.9
13	I	25.4	Very low	28.2	Very low	135 Å²	135	146.9 Å²	146.9	69%	0.692	79%	0.793	S	S	*	*			trans	-76.9	146.2	158.3	-73.8	168.6	0	0	0	108.9
14	E	26.2	Very low	28.2	Very low	178 Å²	178	148.1 Å²	148.1	83%	0.832	79%	0.791	S	S	*	*			trans	31.7	112.5	157.7	-64.4	167.2	156.7	0	0	119.3
15	R	25.7	Very low	28.3	Very low	221 Å²	221	145.4 Å²	145.4	83%	0.834	78%	0.78	S	S	*	*			trans	-139.7	128.9	146.4	-79	-166.1	175.1	159.4	-1.3	112.9
16	H	26.5	Very low	28.2	Very low	187 Å²	187	140.8 Å²	140.8	87%	0.866	76%	0.76	S	S	*	*			trans	-44.6	141.8	166.1	-86.4	-98.9	0	0	0	113.2
17	L	27.7	Very low	28.3	Very low	159 Å²	159	138.4 Å²	138.4	83%	0.832	75%	0.747	S	S	*	*			trans	-116.9	106.3	163.6	-125.9	99.2	0	0	0	108.6
18	C	24.2	Very low	28.3	Very low	104 Å²	104	138.4 Å²	138.4	70%	0.703	74%	0.741	S	S	*	*			trans	-105.9	148.3	155.8	-77.3	0	0	0	0	108
19	D	25.6	Very low	28.4	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	74%	0.735	S	S	*	*			trans	96.3	106.8	166.4	-53.4	-21.2	0	0	0	118.1
20	L	26.8	Very low	28.8	Very low	173 Å²	173	136 Å²	136	91%	0.906	71%	0.714	S	S	*	*	S	Bend	trans	130.2	147.7	156.1	-74.7	145.6	0	0	0	114.5
21	P	26.8	Very low	29.3	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	69%	0.691	S	S	*	*				-83.6	150.8	-126.3	32.6	-35.7	0	0	0	114.3	T23	P21-T23 PolarHBondContact O-N 3.35Å
22	E	26.9	Very low	30.3	Very low	197 Å²	197	132 Å²	132	92%	0.921	69%	0.69	S	S	*	*			trans	-35	89.4	-178.4	-65.7	174.4	160.4	0	0	114.7
23	T	26.7	Very low	31.5	Very low	113 Å²	113	130.6 Å²	130.6	69%	0.693	68%	0.682	S	S	*	*	S	Bend	trans	-110.1	122.1	145.3	28.5	0	0	0	0	105	P21 T25	P21-T23 PolarHBondContact O-N 3.35Å; T23-T25 PolarHBondContact O-N 3.33Å
24	N	31.3	Very low	34.1	Very low	137 Å²	137	130.5 Å²	130.5	73%	0.733	68%	0.678	S	S	*	*			trans	-46.7	93.4	-171.5	-71.2	-11	0	0	0	112.1
25	T	34.3	Very low	37.1	Very low	100 Å²	100	122 Å²	122	61%	0.613	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-1.4	176.3	37.8	0	0	0	0	111.5	T23 D27 K29	T23-T25 PolarHBondContact O-N 3.33Å; T25-D27 VanDerWaalsContact C-N 3.33Å; T25-D27 PolarHBondContact O-N 2.74Å; T25-K29 PolarHBondContact O-N 2.95Å
26	S	33.6	Very low	40.3	Very low	63 Å²	63	113.4 Å²	113.4	44%	0.441	61%	0.61	S	S	.	*	H	α-helix	trans	-60.2	-40.3	175.5	52.9	0	0	0	0	112.1	L28 K29 T30	S26-L28 VanDerWaalsContact C-N 3.32Å; S26-L28 PolarHBondContact O-N 3.29Å; S26-K29 PolarHBondContact O-N 3.08Å; S26-T30 WeakPolarHBondContact O-CG2 3.38Å; S26-T30 PolarHBondContact O-N 2.72Å; S26-T30 VanDerWaalsContact O-N 3.1Å; S26-T30 PolarHBondContact O-OG1 3.26Å; S26-T30 VanDerWaalsContact O-OG1 3.05Å
27	D	33.9	Very low	43.6	Very low	101 Å²	101	104.5 Å²	104.5	54%	0.54	57%	0.569	S	S	.	*	H	α-helix	trans	-76.2	-19.6	-171.6	-65.4	-4.6	0	0	0	113.4	T25 T30 L31	T25-D27 VanDerWaalsContact C-N 3.33Å; T25-D27 PolarHBondContact O-N 2.74Å; D27-T30 PolarHBondContact O-OG1 3.26Å; D27-L31 VanDerWaalsContact O-CD1 3.32Å; D27-L31 WeakPolarHBondContact O-CD1 3.33Å
28	L	33.2	Very low	46.8	Very low	119 Å²	119	97 Å²	97	62%	0.623	53%	0.53	S	S	*	.	H	α-helix	trans	-91.5	-29.2	175.9	-156.5	73.8	0	0	0	111.9	S26	S26-L28 VanDerWaalsContact C-N 3.32Å; S26-L28 PolarHBondContact O-N 3.29Å
29	K	30.8	Very low	50.2	Low	140 Å²	140	92 Å²	92	61%	0.609	50%	0.496	S	S	*	.	H	α-helix	trans	-76.3	-29.1	175.4	-81.3	-177	174.3	178.9	0	112.9	T25 S26 L31 T32	T25-K29 PolarHBondContact O-N 2.95Å; S26-K29 PolarHBondContact O-N 3.08Å; K29-L31 PolarHBondContact O-N 2.76Å; K29-T32 PolarHBondContact O-N 3.24Å; K29-T32 PolarHBondContact O-OG1 2.84Å
30	T	35.4	Very low	53.5	Low	76 Å²	76	85.3 Å²	85.3	47%	0.466	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17	173.2	45.1	0	0	0	0	113.4	S26 D27	S26-T30 WeakPolarHBondContact O-CG2 3.38Å; S26-T30 PolarHBondContact O-N 2.72Å; S26-T30 VanDerWaalsContact O-N 3.1Å; S26-T30 PolarHBondContact O-OG1 3.26Å; S26-T30 VanDerWaalsContact O-OG1 3.05Å; D27-T30 PolarHBondContact O-OG1 3.26Å
31	L	39.4	Very low	56.7	Low	36 Å²	36	80.6 Å²	80.6	19%	0.188	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.7	177	-93.6	127.2	0	0	0	114.2	D27 K29 E33 T120 P198	D27-L31 VanDerWaalsContact O-CD1 3.32Å; D27-L31 WeakPolarHBondContact O-CD1 3.33Å; K29-L31 PolarHBondContact O-N 2.76Å; L31-E33 VanDerWaalsContact C-N 3.3Å; L31-T120 HydrophobicContact CD1-CG2 4.45Å; L31-P198 HydrophobicContact CB-CG 4.13Å; L31-P198 HydrophobicContact CD2-CB 4.44Å; L31-P198 HydrophobicContact CD2-CG 3.28Å; L31-P198 HydrophobicContact CG-CG 4.29Å; L31-P198 VanDerWaalsContact O-CB 3.31Å; L31-P198 WeakPolarHBondContact O-CB 3.48Å
32	T	44.9	Very low	60	Low	121 Å²	121	75.7 Å²	75.7	74%	0.742	40%	0.404	S	S	*	.	S	Bend	trans	-82.7	-8.2	167.6	35.5	0	0	0	0	113.3	K29	K29-T32 PolarHBondContact O-N 3.24Å; K29-T32 PolarHBondContact O-OG1 2.84Å
33	E	56.3	Low	63.3	Low	131 Å²	131	66.8 Å²	66.8	61%	0.612	36%	0.363	S	S	*	.	S	Bend	trans	-77.8	143.2	169	-69.3	178.3	170.3	0	0	110.2	L31 A35	L31-E33 VanDerWaalsContact C-N 3.3Å; E33-A35 PolarHBondContact O-N 2.63Å
34	E	79.3	Confident	66.6	Low	132 Å²	132	62 Å²	62	62%	0.617	33%	0.333	S	S	*	.			trans	-40.7	105.5	174.2	-84.8	-175.3	-175.1	0	0	112.1	V36 P73 N109	E34-V36 PolarHBondContact O-N 2.95Å; E34-P73 HydrophobicContact CB-CG 3.51Å; E34-P73 HydrophobicContact CG-CB 4.3Å; E34-P73 HydrophobicContact CG-CG 3.73Å; E34-N109 PolarHBondContact O-OD1 3.27Å
35	A	89.4	Confident	69.6	Low	1 Å²	1	59.6 Å²	59.6	1%	0.008	32%	0.317	C	S	.	.			trans	-86	98.7	-169.3	0	0	0	0	0	111.8	E33 N109 P198 I199 T230	E33-A35 PolarHBondContact O-N 2.63Å; A35-N109 WeakPolarHBondContact CA-OD1 3.32Å; A35-P198 HydrophobicContact CB-CB 4.19Å; A35-I199 HydrophobicContact CB-CD1 4.04Å; A35-I199 HydrophobicContact CB-CG1 3.76Å; A35-T230 WeakPolarHBondContact O-CB 3.44Å; A35-T230 PolarHBondContact O-OG1 3.02Å
36	V	93.8	Very high	72.1	Confident	39 Å²	39	57.1 Å²	57.1	24%	0.236	30%	0.299	C	S	.	.			trans	-82.3	120.5	174	-177.1	0	0	0	0	109.6	E34 I70 K72 I108 N109	E34-V36 PolarHBondContact O-N 2.95Å; V36-I70 HydrophobicContact CG1-CG2 3.64Å; V36-K72 HydrophobicContact CG1-CG 4.22Å; V36-K72 HydrophobicContact CG2-CG 4.38Å; V36-I108 CarbonylContact O-C 3.58Å; V36-I108 WeakPolarHBondContact O-CA 3.22Å; V36-N109 PolarHBondContact N-OD1 3.34Å; V36-N109 PolarHBondContact O-N 3.24Å
37	L	95.5	Very high	74.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.1	173.3	-177.2	149.2	0	0	0	109.1	F39 M71 L93 L107 I199 F201 I232	L37-F39 HydrophobicContact CD2-CD1 3.71Å; L37-F39 HydrophobicContact CD2-CE1 4.29Å; L37-M71 HydrophobicContact CB-CB 4.48Å; L37-M71 PolarHBondContact N-O 2.72Å; L37-M71 PolarHBondContact O-N 2.89Å; L37-L93 HydrophobicContact CD2-CD1 4.3Å; L37-L93 HydrophobicContact CD2-CD2 4.18Å; L37-L107 WeakPolarHBondContact CA-O 3.44Å; L37-I199 HydrophobicContact CB-CD1 4.43Å; L37-I199 HydrophobicContact CD1-CD1 4.33Å; L37-F201 HydrophobicContact CD1-CE1 4.16Å; L37-F201 HydrophobicContact CD1-CZ 3.68Å; L37-I232 HydrophobicContact CB-CD1 4.48Å; L37-I232 HydrophobicContact CD1-CD1 4.05Å; L37-I232 HydrophobicContact CD2-CD1 4.41Å
38	S	95.5	Very high	76.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.007	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.7	174.3	68.3	0	0	0	0	111.2	H40 I106 L107	S38-H40 PolarHBondContact OG-NE2 2.92Å; S38-I106 CarbonylContact O-C 3.48Å; S38-I106 WeakPolarHBondContact O-CA 3.46Å; S38-L107 PolarHBondContact N-O 3.35Å; S38-L107 PolarHBondContact O-N 3.23Å; S38-L107 WeakPolarHBondContact OG-CB 3.49Å
39	F	95.8	Very high	78.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	179.9	51.6	-89.1	0	0	0	110.1	L37 I42 I67 S68 G69 M71 L93 D105 I106	L37-F39 HydrophobicContact CD2-CD1 3.71Å; L37-F39 HydrophobicContact CD2-CE1 4.29Å; F39-I42 HydrophobicContact CB-CD1 4.33Å; F39-I42 HydrophobicContact CB-CG1 3.73Å; F39-I42 HydrophobicContact CD2-CG1 4.4Å; F39-I67 HydrophobicContact CD2-CG2 3.93Å; F39-I67 HydrophobicContact CE2-CG2 3.6Å; F39-S68 CarbonylContact O-C 3.59Å; F39-S68 VanDerWaalsContact O-CA 3.25Å; F39-S68 WeakPolarHBondContact O-CA 3.26Å; F39-G69 WeakPolarHBondContact CD1-O 3.32Å; F39-G69 VanDerWaalsContact CD2-N 3.31Å; F39-G69 VanDerWaalsContact CE2-CA 3.44Å; F39-G69 VanDerWaalsContact CZ-CA 3.42Å; F39-G69 PolarHBondContact N-O 3.06Å; F39-G69 PolarHBondContact O-N 2.86Å; F39-M71 HydrophobicContact CE1-CE 4.05Å; F39-M71 HydrophobicContact CE1-CG 4.14Å; F39-M71 HydrophobicContact CE1-SD 4.13Å; F39-M71 HydrophobicContact CZ-CE 4.25Å; F39-L93 HydrophobicContact CB-CD2 3.72Å; F39-L93 HydrophobicContact CD1-CD1 4.15Å; F39-L93 HydrophobicContact CD1-CD2 3.69Å; F39-L93 HydrophobicContact CE1-CD1 4.11Å; F39-L93 HydrophobicContact CE1-CD2 4.44Å; F39-L93 HydrophobicContact CG-CD2 3.74Å; F39-D105 CarbonylContact C-O 3.46Å; F39-D105 WeakPolarHBondContact CA-O 3.43Å; F39-I106 HydrophobicContact CB-CG1 4.26Å
40	H	94.6	Very high	80.7	Confident	7 Å²	7	49.4 Å²	49.4	3%	0.032	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	115.2	-165.3	-55.5	-116.6	0	0	0	109.3	S38 I42 G104 D105 L342 L346	S38-H40 PolarHBondContact OG-NE2 2.92Å; H40-I42 VanDerWaalsContact C-N 3.26Å; H40-I42 PolarHBondContact O-N 3.03Å; H40-G104 VanDerWaalsContact O-CA 3.26Å; H40-G104 WeakPolarHBondContact O-CA 3.46Å; H40-D105 HydrophobicContact CB-CB 4.38Å; H40-D105 PolarHBondContact CD2-O 3.12Å; H40-D105 PolarHBondContact N-O 2.94Å; H40-D105 PolarHBondContact O-N 3.1Å; H40-L342 VanDerWaalsContact CE1-CB 3.49Å; H40-L342 WeakPolarHBondContact CE1-CB 3.5Å; H40-L342 WeakPolarHBondContact CE1-CD2 3.13Å; H40-L342 PolarHBondContact CE1-O 2.62Å; H40-L342 WeakPolarHBondContact NE2-CD2 3.21Å; H40-L346 HydrophobicContact CB-CD1 4.27Å; H40-L346 WeakPolarHBondContact ND1-CD1 3.31Å
41	N	94.4	Very high	82	Confident	75 Å²	75	48.2 Å²	48.2	40%	0.401	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.2	45.9	174.3	-59.2	14.3	0	0	0	112.3	S43 I67 S68	N41-S43 PolarHBondContact O-N 3.23Å; N41-I67 PolarHBondContact N-O 3.46Å; N41-S68 PolarHBondContact N-OG 2.98Å; N41-S68 PolarHBondContact OD1-OG 2.95Å; N41-S68 VanDerWaalsContact OD1-OG 3.05Å
42	I	95.6	Very high	82.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	117.4	-178.6	-60.5	-54.9	0	0	0	110	F39 H40 N66 I67 V92 L102 S103 I106	F39-I42 HydrophobicContact CB-CD1 4.33Å; F39-I42 HydrophobicContact CB-CG1 3.73Å; F39-I42 HydrophobicContact CD2-CG1 4.4Å; H40-I42 VanDerWaalsContact C-N 3.26Å; H40-I42 PolarHBondContact O-N 3.03Å; I42-N66 PolarHBondContact O-N 3.4Å; I42-N66 VanDerWaalsContact O-N 3.14Å; I42-I67 HydrophobicContact CB-CB 4.27Å; I42-I67 WeakPolarHBondContact CB-O 3.45Å; I42-I67 PolarHBondContact N-O 3.43Å; I42-I67 PolarHBondContact O-N 3.49Å; I42-V92 HydrophobicContact CG2-CG1 3.82Å; I42-L102 HydrophobicContact CD1-CD1 4.46Å; I42-L102 HydrophobicContact CG2-CD1 3.85Å; I42-S103 WeakPolarHBondContact CA-O 3.46Å; I42-I106 HydrophobicContact CD1-CD1 4.1Å; I42-I106 HydrophobicContact CD1-CG1 3.56Å; I42-I106 HydrophobicContact CG1-CG1 4.35Å
43	S	96.4	Very high	83.8	Confident	10 Å²	10	53 Å²	53	7%	0.07	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	142.7	165.4	-84	0	0	0	0	109.2	N41 E62 L64 S65 N66 S103	N41-S43 PolarHBondContact O-N 3.23Å; S43-E62 WeakPolarHBondContact CB-OE1 3.49Å; S43-E62 PolarHBondContact OG-OE1 3.38Å; S43-L64 CarbonylContact C-O 3.18Å; S43-L64 VanDerWaalsContact CA-O 3.23Å; S43-L64 WeakPolarHBondContact CA-O 3.35Å; S43-S65 WeakPolarHBondContact OG-CA 3.21Å; S43-N66 PolarHBondContact OG-N 3.14Å; S43-S103 PolarHBondContact N-O 2.92Å; S43-S103 PolarHBondContact O-N 2.94Å
44	Y	95.5	Very high	84.3	Confident	13 Å²	13	54.2 Å²	54.2	5%	0.051	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.4	175.6	-171.6	-97.4	0	0	0	110.8	E46 R63 L64 L88 V92 R97 G101 L102	Y44-E46 HydrophobicContact CE1-CB 4.35Å; Y44-R63 HydrophobicContact CD1-CB 4.47Å; Y44-R63 PolarHBondContact O-N 3.34Å; Y44-L64 PolarHBondContact N-O 3.09Å; Y44-L64 PolarHBondContact O-N 3.38Å; Y44-L88 HydrophobicContact CD1-CD1 3.89Å; Y44-L88 HydrophobicContact CD1-CD2 4.02Å; Y44-L88 HydrophobicContact CD1-CG 4.38Å; Y44-L88 HydrophobicContact CE1-CD1 3.98Å; Y44-V92 HydrophobicContact CD2-CG2 3.96Å; Y44-V92 HydrophobicContact CG-CG2 4.17Å; Y44-R97 HydrophobicContact CD2-CB 4.48Å; Y44-R97 HydrophobicContact CE2-CB 3.67Å; Y44-R97 HydrophobicContact CE2-CG 4.32Å; Y44-G101 CarbonylContact C-O 3.59Å; Y44-G101 VanDerWaalsContact CA-O 3.31Å; Y44-G101 WeakPolarHBondContact CA-O 3.26Å; Y44-L102 HydrophobicContact CD2-CB 4.29Å
45	Q	93.3	Very high	83.6	Confident	87 Å²	87	58.3 Å²	58.3	41%	0.407	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.9	179.3	-66.6	-177.2	2	0	0	110.6	V60 I61 E62 G101	Q45-V60 HydrophobicContact CB-CG1 3.78Å; Q45-V60 HydrophobicContact CG-CG1 4.21Å; Q45-I61 WeakPolarHBondContact CA-O 3.47Å; Q45-E62 HydrophobicContact CG-CB 4.22Å; Q45-E62 HydrophobicContact CG-CG 4.26Å; Q45-G101 PolarHBondContact N-O 3.18Å; Q45-G101 VanDerWaalsContact O-CA 3.24Å; Q45-G101 WeakPolarHBondContact O-CA 3.46Å
46	E	86.6	Confident	82.6	Confident	47 Å²	47	63.7 Å²	63.7	22%	0.22	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.6	176.5	-171.8	169.3	-144.6	0	0	110.5	Y44 V48 V60 I61 R63	Y44-E46 HydrophobicContact CE1-CB 4.35Å; E46-V48 HydrophobicContact CG-CG2 4.32Å; E46-V48 PolarHBondContact O-N 3.44Å; E46-V60 WeakPolarHBondContact O-CA 3.42Å; E46-I61 PolarHBondContact N-O 3.14Å; E46-I61 PolarHBondContact O-N 3.32Å; E46-R63 HydrophobicContact CB-CG 4.44Å; E46-R63 IonicContact OE2-NE 2.67Å
47	T	84.3	Confident	81.6	Confident	76 Å²	76	70.1 Å²	70.1	47%	0.466	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	105.6	173.2	-34	0	0	0	0	109.3	A58 V60	T47-A58 HydrophobicContact CG2-CB 3.93Å; T47-V60 HydrophobicContact CG2-CG2 4.31Å
48	V	80.8	Confident	80.9	Confident	27 Å²	27	73.3 Å²	73.3	16%	0.164	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.4	176.2	-168.1	0	0	0	0	108.5	E46 A58 Y59 I61	E46-V48 HydrophobicContact CG-CG2 4.32Å; E46-V48 PolarHBondContact O-N 3.44Å; V48-A58 WeakPolarHBondContact O-CA 3.38Å; V48-Y59 HydrophobicContact CB-CD1 4.4Å; V48-Y59 HydrophobicContact CB-CD2 4.11Å; V48-Y59 HydrophobicContact CB-CE1 3.84Å; V48-Y59 HydrophobicContact CB-CE2 3.6Å; V48-Y59 VanDerWaalsContact CB-CZ 3.45Å; V48-Y59 HydrophobicContact CG1-CE1 3.9Å; V48-Y59 HydrophobicContact CG1-CE2 3.96Å; V48-Y59 WeakPolarHBondContact CG1-OH 3.45Å; V48-Y59 HydrophobicContact CG2-CE2 4.24Å; V48-Y59 PolarHBondContact N-O 2.83Å; V48-Y59 WeakPolarHBondContact O-CD1 3.42Å; V48-Y59 WeakPolarHBondContact O-CE1 3.38Å; V48-Y59 PolarHBondContact O-N 3.44Å; V48-I61 HydrophobicContact CG2-CD1 4.04Å; V48-I61 HydrophobicContact CG2-CG1 4.48Å
49	Q	76.3	Confident	80.4	Confident	92 Å²	92	78.1 Å²	78.1	43%	0.43	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.3	175.6	-69.4	-177.8	-9.1	0	0	108	K56 A58	Q49-K56 HydrophobicContact CB-CD 4.35Å; Q49-A58 HydrophobicContact CG-CB 4.5Å
50	S	71.4	Confident	80	Confident	66 Å²	66	82.2 Å²	82.2	46%	0.462	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	151.1	173	175.7	0	0	0	0	109.6	K57	S50-K57 PolarHBondContact N-O 3.07Å; S50-K57 PolarHBondContact O-N 3Å
51	G	62.4	Low	79.7	Confident	52 Å²	52	84.6 Å²	84.6	54%	0.536	44%	0.438	S	S	.	.	S	Bend	trans	107.7	173.3	179.2	0	0	0	0	0	113.9
52	F	59.6	Low	79.5	Confident	160 Å²	160	85.6 Å²	85.6	70%	0.702	44%	0.44	S	S	*	.			trans	-63.1	147.5	-178.9	-140.8	-101.3	0	0	0	110.8	L54 R55 K56	F52-L54 PolarHBondContact O-N 2.97Å; F52-R55 CarbonylContact O-C 3.54Å; F52-R55 PolarHBondContact O-N 2.75Å; F52-K56 PolarHBondContact O-N 3.36Å
53	P	64.1	Low	79.4	Confident	97 Å²	97	90.9 Å²	90.9	63%	0.63	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-26.5	-175	13.5	-29.2	0	0	0	115.8
54	L	66.5	Low	79.4	Confident	157 Å²	157	90.5 Å²	90.5	82%	0.822	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-13.9	177	-75.8	146.3	0	0	0	114.5	F52	F52-L54 PolarHBondContact O-N 2.97Å
55	R	64.1	Low	79.3	Confident	217 Å²	217	90.9 Å²	90.9	82%	0.819	46%	0.462	S	S	*	.	S	Bend	trans	-140.5	58.8	177.8	-77.6	-172.3	175.7	177.3	-0.7	110.3	F52 K57	F52-R55 CarbonylContact O-C 3.54Å; F52-R55 PolarHBondContact O-N 2.75Å; R55-K57 PolarHBondContact O-N 2.9Å
56	K	67.8	Low	79.3	Confident	115 Å²	115	92.1 Å²	92.1	50%	0.5	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-72.6	120	173.8	-66.6	-172	179.1	-175	0	109.4	Q49 F52	Q49-K56 HydrophobicContact CB-CD 4.35Å; F52-K56 PolarHBondContact O-N 3.36Å
57	K	73.8	Confident	79.7	Confident	173 Å²	173	90 Å²	90	75%	0.752	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.2	164	-77.4	-175.1	177.4	-178.8	0	108	S50 R55	S50-K57 PolarHBondContact N-O 3.07Å; S50-K57 PolarHBondContact O-N 3Å; R55-K57 PolarHBondContact O-N 2.9Å
58	A	80.8	Confident	80.3	Confident	68 Å²	68	86.7 Å²	86.7	56%	0.562	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.8	172.8	0	0	0	0	0	108.7	T47 V48 Q49	T47-A58 HydrophobicContact CG2-CB 3.93Å; V48-A58 WeakPolarHBondContact O-CA 3.38Å; Q49-A58 HydrophobicContact CG-CB 4.5Å
59	Y	85.4	Confident	81	Confident	102 Å²	102	85.4 Å²	85.4	40%	0.4	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.9	171.2	53.1	-72.6	0	0	0	108.1	V48 I61	V48-Y59 HydrophobicContact CB-CD1 4.4Å; V48-Y59 HydrophobicContact CB-CD2 4.11Å; V48-Y59 HydrophobicContact CB-CE1 3.84Å; V48-Y59 HydrophobicContact CB-CE2 3.6Å; V48-Y59 VanDerWaalsContact CB-CZ 3.45Å; V48-Y59 HydrophobicContact CG1-CE1 3.9Å; V48-Y59 HydrophobicContact CG1-CE2 3.96Å; V48-Y59 WeakPolarHBondContact CG1-OH 3.45Å; V48-Y59 HydrophobicContact CG2-CE2 4.24Å; V48-Y59 PolarHBondContact N-O 2.83Å; V48-Y59 WeakPolarHBondContact O-CD1 3.42Å; V48-Y59 WeakPolarHBondContact O-CE1 3.38Å; V48-Y59 PolarHBondContact O-N 3.44Å; Y59-I61 HydrophobicContact CD2-CD1 3.69Å; Y59-I61 HydrophobicContact CD2-CG1 3.71Å; Y59-I61 HydrophobicContact CE2-CD1 3.41Å; Y59-I61 VanDerWaalsContact CE2-CD1 3.41Å; Y59-I61 HydrophobicContact CE2-CG1 4Å
60	V	86.6	Confident	82	Confident	86 Å²	86	81.8 Å²	81.8	52%	0.521	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.3	178.9	-178.3	0	0	0	0	107.2	Q45 E46 T47	Q45-V60 HydrophobicContact CB-CG1 3.78Å; Q45-V60 HydrophobicContact CG-CG1 4.21Å; E46-V60 WeakPolarHBondContact O-CA 3.42Å; T47-V60 HydrophobicContact CG2-CG2 4.31Å
61	I	89.2	Confident	83.2	Confident	57 Å²	57	78.7 Å²	78.7	29%	0.292	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.2	174.3	-63.1	177.2	0	0	0	107.8	Q45 E46 V48 Y59 R63	Q45-I61 WeakPolarHBondContact CA-O 3.47Å; E46-I61 PolarHBondContact N-O 3.14Å; E46-I61 PolarHBondContact O-N 3.32Å; V48-I61 HydrophobicContact CG2-CD1 4.04Å; V48-I61 HydrophobicContact CG2-CG1 4.48Å; Y59-I61 HydrophobicContact CD2-CD1 3.69Å; Y59-I61 HydrophobicContact CD2-CG1 3.71Å; Y59-I61 HydrophobicContact CE2-CD1 3.41Å; Y59-I61 VanDerWaalsContact CE2-CD1 3.41Å; Y59-I61 HydrophobicContact CE2-CG1 4Å; I61-R63 HydrophobicContact CG2-CG 4.28Å
62	E	90.2	Very high	84.8	Confident	95 Å²	95	82 Å²	82	44%	0.444	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121	166.2	-170.3	170.1	-150.7	0	0	109.2	S43 Q45 L64	S43-E62 WeakPolarHBondContact CB-OE1 3.49Å; S43-E62 PolarHBondContact OG-OE1 3.38Å; Q45-E62 HydrophobicContact CG-CB 4.22Å; Q45-E62 HydrophobicContact CG-CG 4.26Å; E62-L64 WeakPolarHBondContact CG-O 3.44Å
63	R	92.6	Very high	86.5	Confident	112 Å²	112	76 Å²	76	42%	0.423	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-27.4	-176.8	-65.9	-69.3	-161.2	164.2	3.9	112.8	Y44 E46 I61 L88 G255	Y44-R63 HydrophobicContact CD1-CB 4.47Å; Y44-R63 PolarHBondContact O-N 3.34Å; E46-R63 HydrophobicContact CB-CG 4.44Å; E46-R63 IonicContact OE2-NE 2.67Å; I61-R63 HydrophobicContact CG2-CG 4.28Å; R63-L88 HydrophobicContact CB-CD2 3.32Å; R63-L88 HydrophobicContact CG-CD2 4.21Å; R63-G255 WeakPolarHBondContact O-CA 3.26Å
64	L	95.5	Very high	88.1	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.9	169.3	-58.9	177.2	0	0	0	107.7	S43 Y44 E62 I67 L88 L89 V92 G255	S43-L64 CarbonylContact C-O 3.18Å; S43-L64 VanDerWaalsContact CA-O 3.23Å; S43-L64 WeakPolarHBondContact CA-O 3.35Å; Y44-L64 PolarHBondContact N-O 3.09Å; Y44-L64 PolarHBondContact O-N 3.38Å; E62-L64 WeakPolarHBondContact CG-O 3.44Å; L64-I67 HydrophobicContact CB-CD1 4Å; L64-I67 HydrophobicContact CD1-CD1 4.49Å; L64-I67 HydrophobicContact CD2-CD1 3.8Å; L64-I67 HydrophobicContact CG-CD1 4.3Å; L64-L88 HydrophobicContact CD1-CD2 4.23Å; L64-L88 HydrophobicContact CD1-CG 3.95Å; L64-L88 HydrophobicContact CD2-CD2 4.14Å; L64-L88 HydrophobicContact CD2-CG 4.38Å; L64-L88 HydrophobicContact CG-CD2 3.75Å; L64-L88 HydrophobicContact CG-CG 4.02Å; L64-L89 HydrophobicContact CD1-CB 4.22Å; L64-L89 HydrophobicContact CD1-CD1 4.29Å; L64-L89 HydrophobicContact CD2-CB 4.44Å; L64-V92 HydrophobicContact CD1-CG2 4.14Å; L64-G255 CarbonylContact C-O 3.41Å; L64-G255 WeakPolarHBondContact CA-O 3.21Å
65	S	94.6	Very high	89.5	Confident	22 Å²	22	64 Å²	64	15%	0.154	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120	-177.1	62.7	0	0	0	0	112	S43 I67 G255 K256	S43-S65 WeakPolarHBondContact OG-CA 3.21Å; S65-I67 VanDerWaalsContact C-N 3.34Å; S65-I67 PolarHBondContact O-N 2.92Å; S65-G255 PolarHBondContact N-O 2.85Å; S65-G255 PolarHBondContact OG-O 2.92Å; S65-K256 WeakPolarHBondContact OG-CE 3.17Å; S65-K256 WeakPolarHBondContact OG-CG 3.46Å
66	N	93.5	Very high	91.1	Very high	113 Å²	113	53.9 Å²	53.9	60%	0.604	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	45.8	48.3	172.3	-68.5	-41.8	0	0	0	115.2	I42 S43	I42-N66 PolarHBondContact O-N 3.4Å; I42-N66 VanDerWaalsContact O-N 3.14Å; S43-N66 PolarHBondContact OG-N 3.14Å
67	I	95.4	Very high	92.6	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	125.6	-180	-61.9	-173.5	0	0	0	110.3	F39 N41 I42 L64 S65 L89 V252 V257	F39-I67 HydrophobicContact CD2-CG2 3.93Å; F39-I67 HydrophobicContact CE2-CG2 3.6Å; N41-I67 PolarHBondContact N-O 3.46Å; I42-I67 HydrophobicContact CB-CB 4.27Å; I42-I67 WeakPolarHBondContact CB-O 3.45Å; I42-I67 PolarHBondContact N-O 3.43Å; I42-I67 PolarHBondContact O-N 3.49Å; L64-I67 HydrophobicContact CB-CD1 4Å; L64-I67 HydrophobicContact CD1-CD1 4.49Å; L64-I67 HydrophobicContact CD2-CD1 3.8Å; L64-I67 HydrophobicContact CG-CD1 4.3Å; S65-I67 VanDerWaalsContact C-N 3.34Å; S65-I67 PolarHBondContact O-N 2.92Å; I67-L89 HydrophobicContact CD1-CD1 4.39Å; I67-L89 HydrophobicContact CG2-CD1 4.01Å; I67-L89 HydrophobicContact CG2-CD2 4.27Å; I67-V252 HydrophobicContact CD1-CG1 4.33Å; I67-V257 HydrophobicContact CB-CG2 4.16Å; I67-V257 HydrophobicContact CD1-CG2 4.33Å; I67-V257 HydrophobicContact CG1-CG2 4Å; I67-V257 HydrophobicContact CG2-CG2 3.57Å
68	S	95.7	Very high	93.7	Very high	8 Å²	8	40.1 Å²	40.1	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.7	176.2	-62.5	0	0	0	0	111.1	F39 N41	F39-S68 CarbonylContact O-C 3.59Å; F39-S68 VanDerWaalsContact O-CA 3.25Å; F39-S68 WeakPolarHBondContact O-CA 3.26Å; N41-S68 PolarHBondContact N-OG 2.98Å; N41-S68 PolarHBondContact OD1-OG 2.95Å; N41-S68 VanDerWaalsContact OD1-OG 3.05Å
69	G	96.3	Very high	94.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173	171.7	-180	0	0	0	0	0	114.4	F39 H260	F39-G69 WeakPolarHBondContact CD1-O 3.32Å; F39-G69 VanDerWaalsContact CD2-N 3.31Å; F39-G69 VanDerWaalsContact CE2-CA 3.44Å; F39-G69 VanDerWaalsContact CZ-CA 3.42Å; F39-G69 PolarHBondContact N-O 3.06Å; F39-G69 PolarHBondContact O-N 2.86Å; G69-H260 VanDerWaalsContact CA-NE2 3.34Å; G69-H260 WeakPolarHBondContact CA-NE2 3.49Å
70	I	96.6	Very high	94.8	Very high	16 Å²	16	32 Å²	32	8%	0.082	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.8	-177.2	-57.6	174.4	0	0	0	109.1	V36 K72 H260 T338 I341 L342	V36-I70 HydrophobicContact CG1-CG2 3.64Å; I70-K72 HydrophobicContact CG2-CG 4.09Å; I70-H260 PolarHBondContact N-CE1 3.29Å; I70-H260 PolarHBondContact N-NE2 2.95Å; I70-H260 PolarHBondContact O-CE1 2.99Å; I70-H260 PolarHBondContact O-NE2 2.72Å; I70-T338 HydrophobicContact CD1-CG2 4.31Å; I70-T338 HydrophobicContact CG1-CG2 4.23Å; I70-I341 HydrophobicContact CD1-CB 3.73Å; I70-I341 HydrophobicContact CD1-CG2 3.41Å; I70-I341 VanDerWaalsContact CD1-CG2 3.41Å; I70-L342 HydrophobicContact CD1-CD2 3.98Å; I70-L342 HydrophobicContact CD1-CG 4.02Å; I70-L342 HydrophobicContact CG1-CD2 3.5Å; I70-L342 VanDerWaalsContact CG1-CD2 3.5Å; I70-L342 HydrophobicContact CG1-CG 3.94Å
71	M	97	Very high	95	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	107	175.5	-69.6	176.9	174.5	0	0	109.1	L37 F39 N76 I78 L93 T230 I232	L37-M71 HydrophobicContact CB-CB 4.48Å; L37-M71 PolarHBondContact N-O 2.72Å; L37-M71 PolarHBondContact O-N 2.89Å; F39-M71 HydrophobicContact CE1-CE 4.05Å; F39-M71 HydrophobicContact CE1-CG 4.14Å; F39-M71 HydrophobicContact CE1-SD 4.13Å; F39-M71 HydrophobicContact CZ-CE 4.25Å; M71-N76 HydrophobicContact CB-CB 4.27Å; M71-N76 HydrophobicContact CG-CB 3.98Å; M71-N76 HydrophobicContact SD-CB 4.17Å; M71-I78 HydrophobicContact CE-CD1 4.05Å; M71-I78 HydrophobicContact CE-CG1 3.96Å; M71-L93 HydrophobicContact CE-CD1 4.26Å; M71-L93 HydrophobicContact SD-CD1 4.09Å; M71-T230 HydrophobicContact CB-CG2 4.43Å; M71-I232 HydrophobicContact CB-CD1 4.09Å; M71-I232 HydrophobicContact CB-CG1 4.24Å; M71-I232 HydrophobicContact CE-CG2 3.95Å; M71-I232 HydrophobicContact CG-CD1 4.44Å; M71-I232 HydrophobicContact CG-CG1 4.46Å; M71-I232 HydrophobicContact SD-CB 4.1Å; M71-I232 HydrophobicContact SD-CD1 3.49Å; M71-I232 WeakPolarHBondContact SD-CD1 3.39Å; M71-I232 HydrophobicContact SD-CG1 3.54Å; M71-I232 VanDerWaalsContact SD-CG1 3.54Å; M71-I232 HydrophobicContact SD-CG2 3.41Å; M71-I232 WeakPolarHBondContact SD-CG2 3.31Å
72	K	95.6	Very high	94.9	Very high	122 Å²	122	33.7 Å²	33.7	53%	0.53	16%	0.163	S	C	.	.			trans	-87.4	166	-179.7	-66.6	-176.9	-176.9	177.8	0	110.6	V36 I70 G74 N76	V36-K72 HydrophobicContact CG1-CG 4.22Å; V36-K72 HydrophobicContact CG2-CG 4.38Å; I70-K72 HydrophobicContact CG2-CG 4.09Å; K72-G74 PolarHBondContact O-N 3.38Å; K72-N76 PolarHBondContact O-ND2 3.1Å
73	P	96.3	Very high	94.7	Very high	34 Å²	34	31.9 Å²	31.9	22%	0.221	16%	0.156	C	C	.	.	S	Bend	trans	-48.3	126.4	167.6	-23.7	28.1	0	0	0	111.3	E34 T230	E34-P73 HydrophobicContact CB-CG 3.51Å; E34-P73 HydrophobicContact CG-CB 4.3Å; E34-P73 HydrophobicContact CG-CG 3.73Å; P73-T230 VanDerWaalsContact CA-OG1 3.25Å; P73-T230 WeakPolarHBondContact CA-OG1 3.19Å
74	G	96.2	Very high	94.6	Very high	3 Å²	3	28.7 Å²	28.7	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.7	-178.8	-163.4	0	0	0	0	0	113	K72 N76 S225 R229 I231 D247	K72-G74 PolarHBondContact O-N 3.38Å; G74-N76 PolarHBondContact O-ND2 3.39Å; G74-S225 VanDerWaalsContact C-CB 3.49Å; G74-R229 PolarHBondContact N-O 3.39Å; G74-I231 PolarHBondContact O-N 3.22Å; G74-D247 VanDerWaalsContact CA-OD2 3.22Å; G74-D247 WeakPolarHBondContact CA-OD2 3.46Å
75	L	97	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	103.9	170.1	-85.6	157.3	0	0	0	109.5	L221 R222 I231 F233 F245 D247 S248	L75-L221 HydrophobicContact CD2-CB 3.9Å; L75-R222 VanDerWaalsContact CD1-CA 3.47Å; L75-R222 HydrophobicContact CD1-CB 3.53Å; L75-R222 HydrophobicContact CD1-CG 3.73Å; L75-I231 HydrophobicContact CD2-CG2 4.36Å; L75-F233 HydrophobicContact CB-CE1 4.15Å; L75-F233 HydrophobicContact CD2-CD1 4.13Å; L75-F233 HydrophobicContact CD2-CE1 3.32Å; L75-F233 HydrophobicContact CD2-CZ 3.9Å; L75-F233 HydrophobicContact CG-CE1 4.35Å; L75-F245 HydrophobicContact CD1-CB 4.39Å; L75-F245 WeakPolarHBondContact CD1-O 3.46Å; L75-D247 PolarHBondContact N-OD2 2.66Å; L75-D247 PolarHBondContact O-N 2.94Å; L75-S248 PolarHBondContact O-N 3.39Å
76	N	98.1	Very high	94.4	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.5	178.9	-53	-89	0	0	0	109	M71 K72 G74 I231 I232 F233 S248	M71-N76 HydrophobicContact CB-CB 4.27Å; M71-N76 HydrophobicContact CG-CB 3.98Å; M71-N76 HydrophobicContact SD-CB 4.17Å; K72-N76 PolarHBondContact O-ND2 3.1Å; G74-N76 PolarHBondContact O-ND2 3.39Å; N76-I231 WeakPolarHBondContact CB-O 3.41Å; N76-I231 PolarHBondContact N-O 3.47Å; N76-I231 PolarHBondContact ND2-O 3.37Å; N76-I231 VanDerWaalsContact ND2-O 3.12Å; N76-I232 HydrophobicContact CB-CG1 4.19Å; N76-I232 WeakPolarHBondContact O-CA 3.34Å; N76-F233 WeakPolarHBondContact O-CD1 3.46Å; N76-F233 PolarHBondContact O-N 3.33Å; N76-S248 WeakPolarHBondContact OD1-CB 3.47Å
77	A	97.8	Very high	94.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.3	-178.1	0	0	0	0	0	111.6	F233 I235 F246 S248 L249 T250	A77-F233 CarbonylContact C-O 3.59Å; A77-F233 WeakPolarHBondContact CA-O 3.38Å; A77-F233 HydrophobicContact CB-CE1 4.42Å; A77-F233 HydrophobicContact CB-CE2 4.06Å; A77-F233 HydrophobicContact CB-CZ 3.86Å; A77-I235 HydrophobicContact CB-CG2 4.43Å; A77-F246 HydrophobicContact CB-CB 4.38Å; A77-F246 HydrophobicContact CB-CD1 4.16Å; A77-F246 HydrophobicContact CB-CD2 3.5Å; A77-F246 VanDerWaalsContact CB-CD2 3.5Å; A77-F246 HydrophobicContact CB-CE1 4.34Å; A77-F246 HydrophobicContact CB-CE2 3.67Å; A77-F246 HydrophobicContact CB-CG 3.76Å; A77-F246 HydrophobicContact CB-CZ 4.1Å; A77-S248 PolarHBondContact N-O 3.18Å; A77-L249 HydrophobicContact CB-CD1 4.21Å; A77-T250 PolarHBondContact O-N 3.27Å
78	I	98	Very high	94.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.9	170.2	-51.6	176.2	0	0	0	108.4	M71 R86 L89 L90 I232 F233 S234 I235 T250 V252	M71-I78 HydrophobicContact CE-CD1 4.05Å; M71-I78 HydrophobicContact CE-CG1 3.96Å; I78-R86 HydrophobicContact CG2-CB 4.1Å; I78-R86 HydrophobicContact CG2-CG 4.12Å; I78-L89 HydrophobicContact CD1-CD2 4.27Å; I78-L89 HydrophobicContact CD1-CG 4.41Å; I78-L89 HydrophobicContact CG2-CD2 4.45Å; I78-L90 HydrophobicContact CD1-CB 4.42Å; I78-L90 HydrophobicContact CD1-CD1 4Å; I78-I232 HydrophobicContact CD1-CG2 3.98Å; I78-I232 HydrophobicContact CG1-CG2 4.4Å; I78-F233 PolarHBondContact N-O 3.39Å; I78-S234 WeakPolarHBondContact O-CA 3.39Å; I78-I235 PolarHBondContact O-N 3.16Å; I78-T250 CarbonylContact C-O 3.57Å; I78-T250 WeakPolarHBondContact CA-O 3.42Å; I78-V252 HydrophobicContact CG2-CG2 4.05Å
79	M	96.1	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	162.4	-178.3	-79	-177.7	58	0	0	111.1	I235 P238 F246 L249 T250 L251 V252 A284 L288	M79-I235 HydrophobicContact CG-CG2 3.62Å; M79-I235 HydrophobicContact SD-CG2 4.24Å; M79-P238 HydrophobicContact CE-CG 4.09Å; M79-P238 HydrophobicContact SD-CG 3.69Å; M79-F246 HydrophobicContact SD-CE2 4.23Å; M79-L249 HydrophobicContact CB-CD1 4.08Å; M79-L249 HydrophobicContact CG-CD1 3.97Å; M79-L249 HydrophobicContact SD-CD1 3.67Å; M79-T250 PolarHBondContact N-O 3.16Å; M79-L251 HydrophobicContact CB-CD2 3.54Å; M79-L251 CarbonylContact O-C 3.59Å; M79-L251 WeakPolarHBondContact O-CA 3.32Å; M79-V252 PolarHBondContact O-N 3.11Å; M79-A284 HydrophobicContact CE-CB 3.74Å; M79-A284 HydrophobicContact SD-CB 4.46Å; M79-L288 HydrophobicContact CE-CD1 3.91Å; M79-L288 HydrophobicContact CE-CD2 4.42Å; M79-L288 HydrophobicContact CE-CG 4.02Å
80	G	93.1	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.			trans	155.6	173.6	-167.7	0	0	0	0	0	113	R86 V252 L288	G80-R86 PolarHBondContact O-NE 3.36Å; G80-R86 PolarHBondContact O-NH1 3.33Å; G80-R86 PolarHBondContact O-NH2 3.23Å; G80-V252 WeakPolarHBondContact CA-O 3.31Å; G80-L288 WeakPolarHBondContact O-CD2 3.44Å
81	P	90.2	Very high	94.3	Very high	11 Å²	11	25.1 Å²	25.1	7%	0.071	14%	0.138	C	C	.	.			trans	-69.8	174.6	176.4	26.5	-30.6	0	0	0	113.2	D83 R86 V252 A253 I291 N292	P81-D83 HydrophobicContact CG-CB 4.37Å; P81-D83 PolarHBondContact O-N 3.05Å; P81-R86 VanDerWaalsContact C-NH2 3.29Å; P81-R86 VanDerWaalsContact O-CZ 3.28Å; P81-R86 PolarHBondContact O-NE 3.32Å; P81-R86 VanDerWaalsContact O-NE 3.12Å; P81-R86 PolarHBondContact O-NH2 3.13Å; P81-V252 WeakPolarHBondContact CD-O 3.15Å; P81-A253 HydrophobicContact CG-CB 3.81Å; P81-I291 HydrophobicContact CG-CG2 4.48Å; P81-N292 WeakPolarHBondContact CB-OD1 3.37Å
82	Q	86.5	Confident	94.2	Very high	167 Å²	167	25.2 Å²	25.2	78%	0.78	14%	0.139	S	C	*	.	S	Bend	trans	-81.6	58.6	173.2	-68.4	-173.3	-3.1	0	0	111.4	N236	Q82-N236 PolarHBondContact NE2-ND2 3.48Å
83	D	87.6	Confident	94.2	Very high	57 Å²	57	19.4 Å²	19.4	31%	0.305	11%	0.114	S	C	.	.	S	Bend	trans	-107.7	1	178.4	67.1	-3.1	0	0	0	113.2	P81 S85 S254	P81-D83 HydrophobicContact CG-CB 4.37Å; P81-D83 PolarHBondContact O-N 3.05Å; D83-S85 VanDerWaalsContact C-N 3.26Å; D83-S85 VanDerWaalsContact CG-OG 3.27Å; D83-S85 PolarHBondContact O-N 3.29Å; D83-S85 VanDerWaalsContact OD1-CB 3.24Å; D83-S85 WeakPolarHBondContact OD1-CB 3.4Å; D83-S85 PolarHBondContact OD1-N 3.2Å; D83-S85 PolarHBondContact OD1-OG 3.17Å; D83-S85 PolarHBondContact OD2-OG 3.45Å; D83-S254 PolarHBondContact OD2-N 3.36Å
84	G	88.8	Confident	94.1	Very high	45 Å²	45	17.8 Å²	17.8	46%	0.464	10%	0.103	S	C	.	.	S	Bend	trans	79.4	-6.2	-177.6	0	0	0	0	0	115.3	R86 L88	G84-R86 VanDerWaalsContact C-N 3.34Å; G84-R86 PolarHBondContact O-N 3.22Å; G84-L88 VanDerWaalsContact O-CB 3.27Å; G84-L88 WeakPolarHBondContact O-CB 3.43Å; G84-L88 PolarHBondContact O-N 3.46Å
85	S	92.2	Very high	93.9	Very high	5 Å²	5	18.6 Å²	18.6	4%	0.035	11%	0.109	C	C	.	.	H	α-helix	trans	-64.6	-36.6	-176.5	65.4	0	0	0	0	112.9	D83 L89	D83-S85 VanDerWaalsContact C-N 3.26Å; D83-S85 VanDerWaalsContact CG-OG 3.27Å; D83-S85 PolarHBondContact O-N 3.29Å; D83-S85 VanDerWaalsContact OD1-CB 3.24Å; D83-S85 WeakPolarHBondContact OD1-CB 3.4Å; D83-S85 PolarHBondContact OD1-N 3.2Å; D83-S85 PolarHBondContact OD1-OG 3.17Å; D83-S85 PolarHBondContact OD2-OG 3.45Å; S85-L89 WeakPolarHBondContact O-CB 3.5Å; S85-L89 PolarHBondContact O-N 2.85Å
86	R	94.1	Very high	93.5	Very high	19 Å²	19	19.4 Å²	19.4	7%	0.072	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-56.7	177.2	-62.8	178.6	-79.9	-172.5	-8.2	112.6	I78 G80 P81 G84 L88 L89 L90 I235 N236	I78-R86 HydrophobicContact CG2-CB 4.1Å; I78-R86 HydrophobicContact CG2-CG 4.12Å; G80-R86 PolarHBondContact O-NE 3.36Å; G80-R86 PolarHBondContact O-NH1 3.33Å; G80-R86 PolarHBondContact O-NH2 3.23Å; P81-R86 VanDerWaalsContact C-NH2 3.29Å; P81-R86 VanDerWaalsContact O-CZ 3.28Å; P81-R86 PolarHBondContact O-NE 3.32Å; P81-R86 VanDerWaalsContact O-NE 3.12Å; P81-R86 PolarHBondContact O-NH2 3.13Å; G84-R86 VanDerWaalsContact C-N 3.34Å; G84-R86 PolarHBondContact O-N 3.22Å; R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 2.74Å; R86-L89 PolarHBondContact O-N 3.22Å; R86-L90 WeakPolarHBondContact O-CB 3.45Å; R86-L90 PolarHBondContact O-N 2.96Å; R86-I235 PolarHBondContact NH1-O 3.22Å; R86-N236 VanDerWaalsContact NH1-CA 3.31Å; R86-N236 PolarHBondContact NH1-OD1 3.46Å; R86-N236 PolarHBondContact NH2-OD1 2.84Å; R86-N236 VanDerWaalsContact NH2-OD1 3.12Å
87	S	94.3	Very high	93	Very high	29 Å²	29	22.1 Å²	22.1	20%	0.203	12%	0.122	C	C	.	.	H	α-helix	trans	-64.9	-36.2	-179.8	-57.3	0	0	0	0	110.5	L90 D91 D203	S87-L90 PolarHBondContact O-N 3.43Å; S87-D91 WeakPolarHBondContact O-CB 3.42Å; S87-D91 PolarHBondContact O-N 3.13Å; S87-D203 WeakPolarHBondContact CB-OD1 3.5Å; S87-D203 PolarHBondContact OG-OD1 3.46Å; S87-D203 PolarHBondContact OG-OD2 2.68Å
88	L	94.8	Very high	92.3	Very high	15 Å²	15	24.3 Å²	24.3	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-45.8	174.7	-178.9	61.5	0	0	0	112.6	Y44 R63 L64 G84 R86 L90 D91 V92 R97	Y44-L88 HydrophobicContact CD1-CD1 3.89Å; Y44-L88 HydrophobicContact CD1-CD2 4.02Å; Y44-L88 HydrophobicContact CD1-CG 4.38Å; Y44-L88 HydrophobicContact CE1-CD1 3.98Å; R63-L88 HydrophobicContact CB-CD2 3.32Å; R63-L88 HydrophobicContact CG-CD2 4.21Å; L64-L88 HydrophobicContact CD1-CD2 4.23Å; L64-L88 HydrophobicContact CD1-CG 3.95Å; L64-L88 HydrophobicContact CD2-CD2 4.14Å; L64-L88 HydrophobicContact CD2-CG 4.38Å; L64-L88 HydrophobicContact CG-CD2 3.75Å; L64-L88 HydrophobicContact CG-CG 4.02Å; G84-L88 VanDerWaalsContact O-CB 3.27Å; G84-L88 WeakPolarHBondContact O-CB 3.43Å; G84-L88 PolarHBondContact O-N 3.46Å; R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 2.74Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-L90 PolarHBondContact O-N 3.35Å; L88-D91 PolarHBondContact O-N 3.49Å; L88-V92 HydrophobicContact CD1-CG2 4.39Å; L88-V92 VanDerWaalsContact O-CG2 3.32Å; L88-V92 WeakPolarHBondContact O-CG2 3.49Å; L88-V92 PolarHBondContact O-N 3Å; L88-R97 HydrophobicContact CD1-CG 3.92Å
89	L	96.3	Very high	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-47.8	175	177.1	60	0	0	0	110.1	L64 I67 I78 S85 R86 D91 V92 L93 T250 V252	L64-L89 HydrophobicContact CD1-CB 4.22Å; L64-L89 HydrophobicContact CD1-CD1 4.29Å; L64-L89 HydrophobicContact CD2-CB 4.44Å; I67-L89 HydrophobicContact CD1-CD1 4.39Å; I67-L89 HydrophobicContact CG2-CD1 4.01Å; I67-L89 HydrophobicContact CG2-CD2 4.27Å; I78-L89 HydrophobicContact CD1-CD2 4.27Å; I78-L89 HydrophobicContact CD1-CG 4.41Å; I78-L89 HydrophobicContact CG2-CD2 4.45Å; S85-L89 WeakPolarHBondContact O-CB 3.5Å; S85-L89 PolarHBondContact O-N 2.85Å; R86-L89 PolarHBondContact O-N 3.22Å; L89-D91 VanDerWaalsContact C-N 3.33Å; L89-D91 PolarHBondContact O-N 3.2Å; L89-V92 PolarHBondContact O-N 3.29Å; L89-V92 VanDerWaalsContact O-N 3.16Å; L89-L93 HydrophobicContact CD1-CD1 4.3Å; L89-L93 HydrophobicContact CD1-CD2 4.33Å; L89-L93 HydrophobicContact CD1-CG 4.12Å; L89-L93 HydrophobicContact CG-CD1 4.25Å; L89-L93 HydrophobicContact CG-CG 4.43Å; L89-L93 VanDerWaalsContact O-CG 3.31Å; L89-L93 WeakPolarHBondContact O-CG 3.25Å; L89-L93 PolarHBondContact O-N 2.74Å; L89-T250 HydrophobicContact CD2-CG2 4.49Å; L89-V252 HydrophobicContact CD2-CG2 3.74Å
90	L	96.6	Very high	91.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.7	-45.5	177.7	-168.2	75.3	0	0	0	112	I78 R86 S87 L88 V92 L93 A94 Y123 F201 L202 D203 I232	I78-L90 HydrophobicContact CD1-CB 4.42Å; I78-L90 HydrophobicContact CD1-CD1 4Å; R86-L90 WeakPolarHBondContact O-CB 3.45Å; R86-L90 PolarHBondContact O-N 2.96Å; S87-L90 PolarHBondContact O-N 3.43Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-L90 PolarHBondContact O-N 3.35Å; L90-V92 PolarHBondContact O-N 3.36Å; L90-L93 PolarHBondContact O-N 3.49Å; L90-A94 WeakPolarHBondContact O-CB 3.36Å; L90-A94 PolarHBondContact O-N 2.92Å; L90-Y123 HydrophobicContact CD2-CE2 4.37Å; L90-Y123 HydrophobicContact CG-CE2 4.47Å; L90-F201 HydrophobicContact CD1-CB 4.31Å; L90-F201 HydrophobicContact CD1-CD1 3.81Å; L90-F201 HydrophobicContact CG-CB 4.49Å; L90-F201 HydrophobicContact CG-CD1 4.43Å; L90-L202 WeakPolarHBondContact CD2-O 2.93Å; L90-D203 HydrophobicContact CD2-CB 3.65Å; L90-I232 HydrophobicContact CD1-CB 4.36Å; L90-I232 HydrophobicContact CD1-CG2 3.64Å
91	D	94.5	Very high	91	Very high	17 Å²	17	38.5 Å²	38.5	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-40	177.6	-70.8	-20.8	0	0	0	112.6	S87 L88 L89 A94 A95 R96 R97 Y123	S87-D91 WeakPolarHBondContact O-CB 3.42Å; S87-D91 PolarHBondContact O-N 3.13Å; L88-D91 PolarHBondContact O-N 3.49Å; L89-D91 VanDerWaalsContact C-N 3.33Å; L89-D91 PolarHBondContact O-N 3.2Å; D91-A94 PolarHBondContact O-N 2.8Å; D91-A95 PolarHBondContact O-N 3.43Å; D91-R96 HydrophobicContact CB-CB 4.17Å; D91-R96 PolarHBondContact O-N 3.47Å; D91-R97 HydrophobicContact CB-CG 3.73Å; D91-R97 IonicContact OD2-CZ 2.77Å; D91-R97 VanDerWaalsContact OD2-CZ 3.29Å; D91-R97 IonicContact OD2-NE 3.23Å; D91-R97 PolarHBondContact OD2-NE 3.11Å; D91-R97 IonicContact OD2-NH2 3.35Å; D91-R97 PolarHBondContact OD2-NH2 3.36Å; D91-Y123 PolarHBondContact OD1-OH 2.94Å
92	V	94.3	Very high	91.1	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-46.5	177.6	165.1	0	0	0	0	110.4	I42 Y44 L64 L88 L89 L90 A94 A95 R97 L102 I106 R113	I42-V92 HydrophobicContact CG2-CG1 3.82Å; Y44-V92 HydrophobicContact CD2-CG2 3.96Å; Y44-V92 HydrophobicContact CG-CG2 4.17Å; L64-V92 HydrophobicContact CD1-CG2 4.14Å; L88-V92 HydrophobicContact CD1-CG2 4.39Å; L88-V92 VanDerWaalsContact O-CG2 3.32Å; L88-V92 WeakPolarHBondContact O-CG2 3.49Å; L88-V92 PolarHBondContact O-N 3Å; L89-V92 PolarHBondContact O-N 3.29Å; L89-V92 VanDerWaalsContact O-N 3.16Å; L90-V92 PolarHBondContact O-N 3.36Å; V92-A94 VanDerWaalsContact C-N 3.34Å; V92-A94 PolarHBondContact O-N 3.03Å; V92-A95 PolarHBondContact O-N 3.31Å; V92-A95 VanDerWaalsContact O-N 3.15Å; V92-R97 HydrophobicContact CG2-CB 4.12Å; V92-R97 HydrophobicContact CG2-CG 3.9Å; V92-L102 HydrophobicContact CG1-CD1 3.45Å; V92-L102 VanDerWaalsContact CG1-CD1 3.45Å; V92-L102 HydrophobicContact CG1-CD2 4.32Å; V92-I106 HydrophobicContact CG1-CD1 3.92Å; V92-R113 PolarHBondContact O-NH1 3.36Å
93	L	95.6	Very high	91.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-42.4	177.4	-62.6	-176.6	0	0	0	111.3	L37 F39 M71 L89 L90 A95 I106 R113 F201	L37-L93 HydrophobicContact CD2-CD1 4.3Å; L37-L93 HydrophobicContact CD2-CD2 4.18Å; F39-L93 HydrophobicContact CB-CD2 3.72Å; F39-L93 HydrophobicContact CD1-CD1 4.15Å; F39-L93 HydrophobicContact CD1-CD2 3.69Å; F39-L93 HydrophobicContact CE1-CD1 4.11Å; F39-L93 HydrophobicContact CE1-CD2 4.44Å; F39-L93 HydrophobicContact CG-CD2 3.74Å; M71-L93 HydrophobicContact CE-CD1 4.26Å; M71-L93 HydrophobicContact SD-CD1 4.09Å; L89-L93 HydrophobicContact CD1-CD1 4.3Å; L89-L93 HydrophobicContact CD1-CD2 4.33Å; L89-L93 HydrophobicContact CD1-CG 4.12Å; L89-L93 HydrophobicContact CG-CD1 4.25Å; L89-L93 HydrophobicContact CG-CG 4.43Å; L89-L93 VanDerWaalsContact O-CG 3.31Å; L89-L93 WeakPolarHBondContact O-CG 3.25Å; L89-L93 PolarHBondContact O-N 2.74Å; L90-L93 PolarHBondContact O-N 3.49Å; L93-A95 PolarHBondContact O-N 2.87Å; L93-I106 HydrophobicContact CD2-CD1 4.15Å; L93-I106 HydrophobicContact CD2-CG1 4.47Å; L93-R113 PolarHBondContact O-NH1 2.55Å; L93-F201 HydrophobicContact CB-CE1 3.82Å; L93-F201 HydrophobicContact CB-CZ 4.4Å
94	A	93.9	Very high	91.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	5.8	177.6	0	0	0	0	0	114.9	L90 D91 V92 R96 Y123 F201	L90-A94 WeakPolarHBondContact O-CB 3.36Å; L90-A94 PolarHBondContact O-N 2.92Å; D91-A94 PolarHBondContact O-N 2.8Å; V92-A94 VanDerWaalsContact C-N 3.34Å; V92-A94 PolarHBondContact O-N 3.03Å; A94-R96 HydrophobicContact CB-CG 3.84Å; A94-R96 PolarHBondContact O-N 2.7Å; A94-Y123 HydrophobicContact CB-CD2 3.52Å; A94-Y123 HydrophobicContact CB-CE2 3.96Å; A94-F201 HydrophobicContact CB-CB 4.29Å; A94-F201 HydrophobicContact CB-CD1 4.08Å; A94-F201 HydrophobicContact CB-CD2 3.68Å; A94-F201 HydrophobicContact CB-CE1 4.3Å; A94-F201 HydrophobicContact CB-CE2 3.94Å; A94-F201 HydrophobicContact CB-CG 3.75Å; A94-F201 HydrophobicContact CB-CZ 4.24Å
95	A	91.4	Very high	91.8	Very high	19 Å²	19	35.7 Å²	35.7	16%	0.157	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	29.7	-176.6	0	0	0	0	0	114.2	D91 V92 L93 F117 K118	D91-A95 PolarHBondContact O-N 3.43Å; V92-A95 PolarHBondContact O-N 3.31Å; V92-A95 VanDerWaalsContact O-N 3.15Å; L93-A95 PolarHBondContact O-N 2.87Å; A95-F117 HydrophobicContact CB-CD1 3.96Å; A95-F117 HydrophobicContact CB-CE1 4.38Å; A95-K118 HydrophobicContact CB-CG 4.45Å; A95-K118 WeakPolarHBondContact O-CE 3.41Å; A95-K118 PolarHBondContact O-NZ 2.89Å
96	R	89.6	Confident	91.9	Very high	17 Å²	17	36 Å²	36	6%	0.064	20%	0.199	C	C	.	.			trans	-91.4	-9	-179	-57.2	-63.8	166.5	147.5	1.1	113.5	D91 A94 Y123 T452 S453 N646	D91-R96 HydrophobicContact CB-CB 4.17Å; D91-R96 PolarHBondContact O-N 3.47Å; A94-R96 HydrophobicContact CB-CG 3.84Å; A94-R96 PolarHBondContact O-N 2.7Å; R96-Y123 HydrophobicContact CG-CD2 4.15Å; R96-Y123 HydrophobicContact CG-CE2 4.21Å; R96-Y123 HydrophobicContact CG-CG 4.38Å; R96-T452 PolarHBondContact NH1-O 3Å; R96-T452 PolarHBondContact NH1-OG1 3.43Å; R96-S453 VanDerWaalsContact NH1-N 3.17Å; R96-S453 PolarHBondContact NH1-OG 2.96Å; R96-N646 PolarHBondContact O-ND2 3.26Å
97	R	88.1	Confident	91.8	Very high	60 Å²	60	35.1 Å²	35.1	23%	0.226	20%	0.196	C	C	.	.	S	Bend	trans	-95.9	162.7	172.9	-65.3	-61.1	173.2	154.7	-2.6	113.9	Y44 L88 D91 V92	Y44-R97 HydrophobicContact CD2-CB 4.48Å; Y44-R97 HydrophobicContact CE2-CB 3.67Å; Y44-R97 HydrophobicContact CE2-CG 4.32Å; L88-R97 HydrophobicContact CD1-CG 3.92Å; D91-R97 HydrophobicContact CB-CG 3.73Å; D91-R97 IonicContact OD2-CZ 2.77Å; D91-R97 VanDerWaalsContact OD2-CZ 3.29Å; D91-R97 IonicContact OD2-NE 3.23Å; D91-R97 PolarHBondContact OD2-NE 3.11Å; D91-R97 IonicContact OD2-NH2 3.35Å; D91-R97 PolarHBondContact OD2-NH2 3.36Å; V92-R97 HydrophobicContact CG2-CB 4.12Å; V92-R97 HydrophobicContact CG2-CG 3.9Å
98	D	83.3	Confident	91.7	Very high	46 Å²	46	34.6 Å²	34.6	25%	0.246	19%	0.19	C	C	.	.			trans	-68.3	123	177.4	-172.6	-21.7	0	0	0	109.3	R100 G101	D98-R100 PolarHBondContact O-N 3.4Å; D98-R100 VanDerWaalsContact O-N 3.13Å; D98-R100 WeakPolarHBondContact OD1-CB 3.4Å; D98-R100 WeakPolarHBondContact OD1-CG 3.45Å; D98-R100 PolarHBondContact OD1-N 3.38Å; D98-R100 IonicContact OD1-NE 2.7Å; D98-R100 PolarHBondContact OD1-NE 3.09Å; D98-R100 IonicContact OD2-CZ 3Å; D98-R100 VanDerWaalsContact OD2-CZ 3.27Å; D98-R100 IonicContact OD2-NE 3.8Å; D98-R100 PolarHBondContact OD2-NE 3.49Å; D98-R100 IonicContact OD2-NH2 3.82Å; D98-R100 PolarHBondContact OD2-NH2 3.27Å; D98-G101 PolarHBondContact O-N 3.06Å
99	P	85.7	Confident	91.5	Very high	98 Å²	98	36.6 Å²	36.6	64%	0.636	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-63.3	-18.8	-178.6	26.4	-36.3	0	0	0	113.4	G101 L102	P99-G101 PolarHBondContact O-N 2.96Å; P99-L102 PolarHBondContact O-N 3.27Å; P99-L102 VanDerWaalsContact O-N 3.1Å
100	R	85.6	Confident	91.1	Very high	187 Å²	187	36.8 Å²	36.8	71%	0.706	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-65	-27.2	179.9	-68.8	-178.9	-69.7	175.8	3.3	113.9	D98	D98-R100 PolarHBondContact O-N 3.4Å; D98-R100 VanDerWaalsContact O-N 3.13Å; D98-R100 WeakPolarHBondContact OD1-CB 3.4Å; D98-R100 WeakPolarHBondContact OD1-CG 3.45Å; D98-R100 PolarHBondContact OD1-N 3.38Å; D98-R100 IonicContact OD1-NE 2.7Å; D98-R100 PolarHBondContact OD1-NE 3.09Å; D98-R100 IonicContact OD2-CZ 3Å; D98-R100 VanDerWaalsContact OD2-CZ 3.27Å; D98-R100 IonicContact OD2-NE 3.8Å; D98-R100 PolarHBondContact OD2-NE 3.49Å; D98-R100 IonicContact OD2-NH2 3.82Å; D98-R100 PolarHBondContact OD2-NH2 3.27Å
101	G	87.1	Confident	90.7	Very high	14 Å²	14	42.2 Å²	42.2	14%	0.144	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-89.5	-6.9	175.8	0	0	0	0	0	113.4	Y44 Q45 D98 P99	Y44-G101 CarbonylContact C-O 3.59Å; Y44-G101 VanDerWaalsContact CA-O 3.31Å; Y44-G101 WeakPolarHBondContact CA-O 3.26Å; Q45-G101 PolarHBondContact N-O 3.18Å; Q45-G101 VanDerWaalsContact O-CA 3.24Å; Q45-G101 WeakPolarHBondContact O-CA 3.46Å; D98-G101 PolarHBondContact O-N 3.06Å; P99-G101 PolarHBondContact O-N 2.96Å
102	L	92.6	Very high	90.4	Very high	40 Å²	40	44.4 Å²	44.4	21%	0.209	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.2	-172.8	-178.9	64.4	0	0	0	110.9	I42 Y44 V92 P99 I106	I42-L102 HydrophobicContact CD1-CD1 4.46Å; I42-L102 HydrophobicContact CG2-CD1 3.85Å; Y44-L102 HydrophobicContact CD2-CB 4.29Å; V92-L102 HydrophobicContact CG1-CD1 3.45Å; V92-L102 VanDerWaalsContact CG1-CD1 3.45Å; V92-L102 HydrophobicContact CG1-CD2 4.32Å; P99-L102 PolarHBondContact O-N 3.27Å; P99-L102 VanDerWaalsContact O-N 3.1Å; L102-I106 HydrophobicContact CD2-CD1 4.29Å
103	S	94.1	Very high	90	Very high	66 Å²	66	47.3 Å²	47.3	46%	0.462	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	150.4	167.8	-62.5	0	0	0	0	109.6	I42 S43	I42-S103 WeakPolarHBondContact CA-O 3.46Å; S43-S103 PolarHBondContact N-O 2.92Å; S43-S103 PolarHBondContact O-N 2.94Å
104	G	92.8	Very high	89.5	Confident	38 Å²	38	49.5 Å²	49.5	39%	0.392	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	178.4	-176	0	0	0	0	0	113.3	H40	H40-G104 VanDerWaalsContact O-CA 3.26Å; H40-G104 WeakPolarHBondContact O-CA 3.46Å
105	D	91.7	Very high	88.7	Confident	76 Å²	76	52.1 Å²	52.1	41%	0.406	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.5	-172	-68	-64.3	0	0	0	111.5	F39 H40	F39-D105 CarbonylContact C-O 3.46Å; F39-D105 WeakPolarHBondContact CA-O 3.43Å; H40-D105 HydrophobicContact CB-CB 4.38Å; H40-D105 PolarHBondContact CD2-O 3.12Å; H40-D105 PolarHBondContact N-O 2.94Å; H40-D105 PolarHBondContact O-N 3.1Å
106	I	93.7	Very high	88.2	Confident	12 Å²	12	53 Å²	53	6%	0.062	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.6	173.4	-57.2	170	0	0	0	107.5	S38 F39 I42 V92 L93 L102 R113	S38-I106 CarbonylContact O-C 3.48Å; S38-I106 WeakPolarHBondContact O-CA 3.46Å; F39-I106 HydrophobicContact CB-CG1 4.26Å; I42-I106 HydrophobicContact CD1-CD1 4.1Å; I42-I106 HydrophobicContact CD1-CG1 3.56Å; I42-I106 HydrophobicContact CG1-CG1 4.35Å; V92-I106 HydrophobicContact CG1-CD1 3.92Å; L93-I106 HydrophobicContact CD2-CD1 4.15Å; L93-I106 HydrophobicContact CD2-CG1 4.47Å; L102-I106 HydrophobicContact CD2-CD1 4.29Å; I106-R113 HydrophobicContact CG2-CG 4.16Å
107	L	92.8	Very high	88.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.4	-176.1	-45.4	175	0	0	0	110.6	L37 S38 K111 L346 Q349	L37-L107 WeakPolarHBondContact CA-O 3.44Å; S38-L107 PolarHBondContact N-O 3.35Å; S38-L107 PolarHBondContact O-N 3.23Å; S38-L107 WeakPolarHBondContact OG-CB 3.49Å; L107-K111 CarbonylContact C-O 3.59Å; L107-K111 WeakPolarHBondContact CA-O 3.46Å; L107-K111 WeakPolarHBondContact CB-O 3.05Å; L107-L346 HydrophobicContact CD1-CG 4.41Å; L107-Q349 HydrophobicContact CD2-CG 4.43Å
108	I	91.9	Very high	87.8	Confident	18 Å²	18	52.8 Å²	52.8	9%	0.092	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	119.2	170.8	-58.3	168.2	0	0	0	106	V36 G110 K111 R113 F117 I199	V36-I108 CarbonylContact O-C 3.58Å; V36-I108 WeakPolarHBondContact O-CA 3.22Å; I108-G110 PolarHBondContact O-N 3.47Å; I108-K111 PolarHBondContact N-O 2.97Å; I108-K111 PolarHBondContact O-N 3.44Å; I108-R113 HydrophobicContact CD1-CB 4.37Å; I108-R113 HydrophobicContact CD1-CG 3.89Å; I108-R113 HydrophobicContact CG1-CG 4.15Å; I108-F117 HydrophobicContact CD1-CD2 3.31Å; I108-F117 HydrophobicContact CD1-CE2 3.15Å; I108-F117 HydrophobicContact CD1-CG 4.22Å; I108-F117 HydrophobicContact CD1-CZ 3.94Å; I108-F117 HydrophobicContact CG1-CE2 4.35Å; I108-I199 HydrophobicContact CD1-CD1 4.24Å; I108-I199 HydrophobicContact CG1-CD1 4.24Å; I108-I199 HydrophobicContact CG2-CD1 4.07Å
109	N	90	Very high	87.8	Confident	57 Å²	57	51.5 Å²	51.5	31%	0.305	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	44.9	-174.7	-62.4	-11.3	0	0	0	111.9	E34 A35 V36 K111	E34-N109 PolarHBondContact O-OD1 3.27Å; A35-N109 WeakPolarHBondContact CA-OD1 3.32Å; V36-N109 PolarHBondContact N-OD1 3.34Å; V36-N109 PolarHBondContact O-N 3.24Å; N109-K111 PolarHBondContact O-N 3.18Å; N109-K111 VanDerWaalsContact O-N 3.13Å
110	G	87.6	Confident	87.7	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.031	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-7.6	-179.1	0	0	0	0	0	115.7	I108	I108-G110 PolarHBondContact O-N 3.47Å
111	K	88.5	Confident	88	Confident	115 Å²	115	38.9 Å²	38.9	50%	0.5	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	149.8	-178.7	-58.7	-167.6	-174.6	-161.1	0	112.1	L107 I108 N109 E352	L107-K111 CarbonylContact C-O 3.59Å; L107-K111 WeakPolarHBondContact CA-O 3.46Å; L107-K111 WeakPolarHBondContact CB-O 3.05Å; I108-K111 PolarHBondContact N-O 2.97Å; I108-K111 PolarHBondContact O-N 3.44Å; N109-K111 PolarHBondContact O-N 3.18Å; N109-K111 VanDerWaalsContact O-N 3.13Å; K111-E352 IonicContact NZ-OE2 3.37Å; K111-E352 PolarHBondContact NZ-OE2 3.14Å
112	P	87.7	Confident	88.4	Confident	62 Å²	62	38.2 Å²	38.2	40%	0.403	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	147	172.3	-16.6	25.7	0	0	0	111.6	Q349	P112-Q349 HydrophobicContact CG-CG 4.19Å
113	R	87	Confident	88.5	Confident	64 Å²	64	37.1 Å²	37.1	24%	0.242	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-53.8	130.9	175.5	-62.6	-175.5	-66.2	-163.7	-3.1	110.7	V92 L93 I106 I108 F117	V92-R113 PolarHBondContact O-NH1 3.36Å; L93-R113 PolarHBondContact O-NH1 2.55Å; I106-R113 HydrophobicContact CG2-CG 4.16Å; I108-R113 HydrophobicContact CD1-CB 4.37Å; I108-R113 HydrophobicContact CD1-CG 3.89Å; I108-R113 HydrophobicContact CG1-CG 4.15Å; R113-F117 HydrophobicContact CB-CB 4.24Å; R113-F117 HydrophobicContact CB-CG 4.27Å; R113-F117 HydrophobicContact CG-CD1 4.45Å; R113-F117 HydrophobicContact CG-CG 4.49Å
114	P	83.4	Confident	88.6	Confident	46 Å²	46	34 Å²	34	30%	0.299	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-68.7	155.8	177.4	31	-36.3	0	0	0	110.5	N116 F117	P114-N116 VanDerWaalsContact CB-OD1 3.32Å; P114-N116 WeakPolarHBondContact CB-OD1 3.48Å; P114-N116 WeakPolarHBondContact CG-OD1 3.28Å; P114-N116 PolarHBondContact O-N 3.07Å; P114-N116 VanDerWaalsContact O-N 3.14Å; P114-F117 HydrophobicContact CG-CB 4.26Å; P114-F117 WeakPolarHBondContact O-CB 3.49Å; P114-F117 PolarHBondContact O-N 2.89Å
115	A	78.6	Confident	88.6	Confident	55 Å²	55	33 Å²	33	46%	0.455	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31	-178.4	0	0	0	0	0	112.9	F117 A356 E358	A115-F117 VanDerWaalsContact C-N 3.31Å; A115-F117 PolarHBondContact O-N 3.21Å; A115-A356 HydrophobicContact CB-CB 3.93Å; A115-E358 HydrophobicContact CB-CG 4.33Å
116	N	79.9	Confident	88.6	Confident	38 Å²	38	33.3 Å²	33.3	20%	0.203	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	12.5	176.9	68.5	-12	0	0	0	113.8	P114 K118 C119 T120 T359	P114-N116 VanDerWaalsContact CB-OD1 3.32Å; P114-N116 WeakPolarHBondContact CB-OD1 3.48Å; P114-N116 WeakPolarHBondContact CG-OD1 3.28Å; P114-N116 PolarHBondContact O-N 3.07Å; P114-N116 VanDerWaalsContact O-N 3.14Å; N116-K118 PolarHBondContact O-N 2.88Å; N116-C119 WeakPolarHBondContact O-CA 3.32Å; N116-C119 VanDerWaalsContact O-CB 3.3Å; N116-C119 WeakPolarHBondContact O-CB 3.32Å; N116-C119 PolarHBondContact O-N 3.37Å; N116-T120 PolarHBondContact O-N 2.82Å; N116-T359 VanDerWaalsContact CB-O 3.3Å; N116-T359 WeakPolarHBondContact CB-O 3.23Å
117	F	87.7	Confident	88.4	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-51.1	-36.8	-174.8	176.2	-118.7	0	0	0	113.8	A95 I108 R113 P114 A115 C119 T120 S121 I199 F201	A95-F117 HydrophobicContact CB-CD1 3.96Å; A95-F117 HydrophobicContact CB-CE1 4.38Å; I108-F117 HydrophobicContact CD1-CD2 3.31Å; I108-F117 HydrophobicContact CD1-CE2 3.15Å; I108-F117 HydrophobicContact CD1-CG 4.22Å; I108-F117 HydrophobicContact CD1-CZ 3.94Å; I108-F117 HydrophobicContact CG1-CE2 4.35Å; R113-F117 HydrophobicContact CB-CB 4.24Å; R113-F117 HydrophobicContact CB-CG 4.27Å; R113-F117 HydrophobicContact CG-CD1 4.45Å; R113-F117 HydrophobicContact CG-CG 4.49Å; P114-F117 HydrophobicContact CG-CB 4.26Å; P114-F117 WeakPolarHBondContact O-CB 3.49Å; P114-F117 PolarHBondContact O-N 2.89Å; A115-F117 VanDerWaalsContact C-N 3.31Å; A115-F117 PolarHBondContact O-N 3.21Å; F117-C119 PolarHBondContact O-N 2.91Å; F117-T120 WeakPolarHBondContact CA-OG1 3.17Å; F117-T120 PolarHBondContact O-N 3.35Å; F117-T120 VanDerWaalsContact O-N 3.16Å; F117-T120 PolarHBondContact O-OG1 3.32Å; F117-S121 WeakPolarHBondContact O-CB 3.41Å; F117-S121 PolarHBondContact O-N 3.18Å; F117-S121 PolarHBondContact O-OG 2.77Å; F117-I199 HydrophobicContact CE2-CD1 4.22Å; F117-F201 HydrophobicContact CE1-CE2 4.25Å; F117-F201 AromaticContact CZ-CE2 3.76Å; F117-F201 HydrophobicContact CZ-CE2 3.76Å; F117-F201 HydrophobicContact CZ-CZ 4.02Å
118	K	83	Confident	88.2	Confident	66 Å²	66	39.9 Å²	39.9	29%	0.287	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-20.2	179.1	-49.1	176	169.6	174.5	0	113.9	A95 N116 T452	A95-K118 HydrophobicContact CB-CG 4.45Å; A95-K118 WeakPolarHBondContact O-CE 3.41Å; A95-K118 PolarHBondContact O-NZ 2.89Å; N116-K118 PolarHBondContact O-N 2.88Å; K118-T452 WeakPolarHBondContact CB-O 3.4Å
119	C	82.1	Confident	88.2	Confident	19 Å²	19	40 Å²	40	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-89.3	-24.7	174.6	-56.3	0	0	0	0	112.1	N116 F117 T360 G454	N116-C119 WeakPolarHBondContact O-CA 3.32Å; N116-C119 VanDerWaalsContact O-CB 3.3Å; N116-C119 WeakPolarHBondContact O-CB 3.32Å; N116-C119 PolarHBondContact O-N 3.37Å; F117-C119 PolarHBondContact O-N 2.91Å; C119-T360 PolarHBondContact SG-O 2.88Å; C119-G454 VanDerWaalsContact SG-CA 3.59Å
120	T	84.4	Confident	88.4	Confident	21 Å²	21	38 Å²	38	13%	0.129	20%	0.204	C	C	.	.	H	α-helix	trans	-97.1	-6	179.9	62.9	0	0	0	0	112.9	L31 N116 F117 P198	L31-T120 HydrophobicContact CD1-CG2 4.45Å; N116-T120 PolarHBondContact O-N 2.82Å; F117-T120 WeakPolarHBondContact CA-OG1 3.17Å; F117-T120 PolarHBondContact O-N 3.35Å; F117-T120 VanDerWaalsContact O-N 3.16Å; F117-T120 PolarHBondContact O-OG1 3.32Å; T120-P198 WeakPolarHBondContact O-CD 3.1Å
121	S	92.3	Very high	88.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	148	172.9	58.5	0	0	0	0	111.9	F117 I199	F117-S121 WeakPolarHBondContact O-CB 3.41Å; F117-S121 PolarHBondContact O-N 3.18Å; F117-S121 PolarHBondContact O-OG 2.77Å; S121-I199 WeakPolarHBondContact CA-O 3.39Å
122	G	94.3	Very high	88.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	144.2	172.5	0	0	0	0	0	111.2	E192 H197 I199 F201	G122-E192 WeakPolarHBondContact CA-OE2 3.5Å; G122-H197 VanDerWaalsContact CA-CE1 3.48Å; G122-H197 WeakPolarHBondContact CA-CE1 3.34Å; G122-H197 VanDerWaalsContact CA-ND1 3.28Å; G122-H197 WeakPolarHBondContact CA-ND1 3.35Å; G122-H197 VanDerWaalsContact N-CG 3.28Å; G122-H197 PolarHBondContact N-ND1 2.98Å; G122-I199 PolarHBondContact N-O 3.23Å; G122-F201 WeakPolarHBondContact O-CD2 3.45Å; G122-F201 PolarHBondContact O-N 3Å
123	Y	95.7	Very high	88.8	Confident	17 Å²	17	32.7 Å²	32.7	7%	0.067	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	117.2	175.2	-179.1	-85.9	0	0	0	110.4	L90 D91 A94 R96 P125 E192 F201 H449	L90-Y123 HydrophobicContact CD2-CE2 4.37Å; L90-Y123 HydrophobicContact CG-CE2 4.47Å; D91-Y123 PolarHBondContact OD1-OH 2.94Å; A94-Y123 HydrophobicContact CB-CD2 3.52Å; A94-Y123 HydrophobicContact CB-CE2 3.96Å; R96-Y123 HydrophobicContact CG-CD2 4.15Å; R96-Y123 HydrophobicContact CG-CE2 4.21Å; R96-Y123 HydrophobicContact CG-CG 4.38Å; Y123-P125 HydrophobicContact CE1-CB 3.92Å; Y123-E192 PolarHBondContact N-OE2 2.88Å; Y123-F201 CarbonylContact C-O 3.52Å; Y123-F201 WeakPolarHBondContact CA-O 3.38Å; Y123-F201 HydrophobicContact CD2-CB 3.6Å; Y123-F201 HydrophobicContact CD2-CG 4.37Å; Y123-F201 HydrophobicContact CE2-CB 4.32Å; Y123-F201 HydrophobicContact CG-CB 4.41Å; Y123-H449 PolarHBondContact O-CE1 3.02Å
124	V	95.7	Very high	89.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.6	174.5	-177	0	0	0	0	108.5	I189 E192 L200 F201 L202 D203	V124-I189 HydrophobicContact CG1-CG1 4.04Å; V124-I189 HydrophobicContact CG2-CG1 4.4Å; V124-E192 HydrophobicContact CG2-CB 3.92Å; V124-E192 HydrophobicContact CG2-CG 3.6Å; V124-L200 HydrophobicContact CG2-CD1 4.46Å; V124-F201 PolarHBondContact N-O 3.46Å; V124-L202 HydrophobicContact CB-CB 4.22Å; V124-L202 HydrophobicContact CB-CD2 4.26Å; V124-L202 HydrophobicContact CB-CG 4.15Å; V124-L202 HydrophobicContact CG2-CD2 3.99Å; V124-L202 HydrophobicContact CG2-CG 4.08Å; V124-D203 PolarHBondContact O-N 2.81Å
125	P	93.1	Very high	89.7	Confident	17 Å²	17	28.9 Å²	28.9	11%	0.11	17%	0.169	C	C	.	.			trans	-71.1	159.4	178.1	28.7	-33.8	0	0	0	111.8	Y123 N127 V129 H449	Y123-P125 HydrophobicContact CE1-CB 3.92Å; P125-N127 WeakPolarHBondContact CG-O 3.49Å; P125-V129 HydrophobicContact CG-CG2 3.99Å; P125-H449 VanDerWaalsContact CD-CE1 3.46Å; P125-H449 WeakPolarHBondContact CD-CE1 3.46Å
126	Q	90.9	Very high	90.6	Very high	82 Å²	82	26.3 Å²	26.3	38%	0.383	15%	0.147	S	C	.	.	S	Bend	trans	-60	-48.2	174.9	-174.4	179.8	32.7	0	0	111.5	K185 D203 D204	Q126-K185 PolarHBondContact O-NZ 3.3Å; Q126-D203 VanDerWaalsContact CA-O 3.26Å; Q126-D203 WeakPolarHBondContact CA-O 3.43Å; Q126-D203 HydrophobicContact CB-CB 4.22Å; Q126-D204 HydrophobicContact CG-CB 4.26Å
127	N	89	Confident	91.4	Very high	130 Å²	130	26.1 Å²	26.1	70%	0.695	14%	0.143	S	C	*	.	S	Bend	trans	-83	115.2	174.3	-73.9	-32.6	0	0	0	110.4	P125 V129	P125-N127 WeakPolarHBondContact CG-O 3.49Å; N127-V129 WeakPolarHBondContact O-CG2 3.48Å; N127-V129 PolarHBondContact O-N 3.39Å
128	D	90.3	Very high	91.8	Very high	21 Å²	21	27.2 Å²	27.2	11%	0.112	15%	0.15	C	C	.	.			trans	-65.3	108.2	-174.4	-57.9	-54.5	0	0	0	112.7	V130 R184 K185 S188	D128-V130 HydrophobicContact CB-CG2 4.36Å; D128-V130 PolarHBondContact O-N 3.45Å; D128-R184 HydrophobicContact CB-CB 3.93Å; D128-R184 PolarHBondContact O-NH2 2.94Å; D128-K185 VanDerWaalsContact OD1-CA 3.28Å; D128-K185 WeakPolarHBondContact OD1-CA 3.47Å; D128-K185 WeakPolarHBondContact OD1-CD 3.21Å; D128-K185 WeakPolarHBondContact OD1-CE 3.49Å; D128-K185 IonicContact OD1-NZ 3.09Å; D128-K185 PolarHBondContact OD2-N 3.17Å; D128-S188 WeakPolarHBondContact OD1-CB 3.43Å
129	V	91.4	Very high	92.5	Very high	20 Å²	20	24.4 Å²	24.4	12%	0.121	14%	0.138	C	C	.	.			trans	-88.7	79.5	176.8	-174	0	0	0	0	109.4	P125 N127 V445 R446 H449	P125-V129 HydrophobicContact CG-CG2 3.99Å; N127-V129 WeakPolarHBondContact O-CG2 3.48Å; N127-V129 PolarHBondContact O-N 3.39Å; V129-V445 HydrophobicContact CG2-CG1 4.26Å; V129-R446 HydrophobicContact CG1-CB 3.87Å; V129-R446 HydrophobicContact CG1-CG 3.84Å; V129-H449 HydrophobicContact CB-CB 4.32Å; V129-H449 HydrophobicContact CG1-CB 4.02Å; V129-H449 HydrophobicContact CG2-CB 4.1Å
130	V	93.7	Very high	93.2	Very high	16 Å²	16	23.5 Å²	23.5	10%	0.097	13%	0.132	C	C	.	.			trans	-126.5	141.8	-179.7	-173.9	0	0	0	0	109.7	D128 G132 N139 P178 T187 M191	D128-V130 HydrophobicContact CB-CG2 4.36Å; D128-V130 PolarHBondContact O-N 3.45Å; V130-G132 PolarHBondContact O-N 3.31Å; V130-G132 VanDerWaalsContact O-N 3.13Å; V130-N139 HydrophobicContact CG1-CB 4.33Å; V130-P178 HydrophobicContact CG1-CG 3.71Å; V130-T187 HydrophobicContact CG1-CG2 3.66Å; V130-T187 HydrophobicContact CG2-CG2 4.43Å; V130-M191 HydrophobicContact CG2-CE 3.84Å
131	L	91.9	Very high	93.8	Very high	17 Å²	17	25 Å²	25	9%	0.089	14%	0.137	C	C	.	.			trans	-76.5	103	176.3	-171.6	66.8	0	0	0	110.2	T133 V134 N139 Q375 N379	L131-T133 WeakPolarHBondContact CG-OG1 3.33Å; L131-T133 PolarHBondContact O-N 2.93Å; L131-V134 HydrophobicContact CB-CG2 3.98Å; L131-V134 HydrophobicContact CD2-CB 4.36Å; L131-V134 HydrophobicContact CD2-CG1 3.68Å; L131-V134 HydrophobicContact CD2-CG2 3.76Å; L131-V134 HydrophobicContact CG-CG1 4.38Å; L131-V134 HydrophobicContact CG-CG2 4Å; L131-N139 WeakPolarHBondContact CB-OD1 3.48Å; L131-N139 PolarHBondContact N-OD1 3.15Å; L131-N139 VanDerWaalsContact N-OD1 3.16Å; L131-N139 PolarHBondContact O-ND2 3.19Å; L131-N139 VanDerWaalsContact O-ND2 3.15Å; L131-Q375 HydrophobicContact CD2-CG 4.15Å; L131-N379 HydrophobicContact CD2-CB 4.09Å
132	G	90.9	Very high	94	Very high	32 Å²	32	25.3 Å²	25.3	33%	0.33	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	0.2	-176.3	0	0	0	0	0	116	V130	V130-G132 PolarHBondContact O-N 3.31Å; V130-G132 VanDerWaalsContact O-N 3.13Å
133	T	89.3	Confident	94.1	Very high	19 Å²	19	25.3 Å²	25.3	12%	0.117	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-15.3	-175.2	58.6	0	0	0	0	113.1	L131 K177 N379 F383	L131-T133 WeakPolarHBondContact CG-OG1 3.33Å; L131-T133 PolarHBondContact O-N 2.93Å; T133-K177 VanDerWaalsContact O-CD 3.31Å; T133-K177 WeakPolarHBondContact O-CD 3.09Å; T133-K177 WeakPolarHBondContact O-CE 3.37Å; T133-K177 PolarHBondContact O-NZ 2.87Å; T133-N379 WeakPolarHBondContact CB-OD1 3.4Å; T133-N379 WeakPolarHBondContact CG2-OD1 3.41Å; T133-N379 PolarHBondContact OG1-OD1 2.54Å; T133-F383 HydrophobicContact CG2-CD2 4.11Å; T133-F383 HydrophobicContact CG2-CE1 4.48Å; T133-F383 HydrophobicContact CG2-CE2 3.19Å; T133-F383 HydrophobicContact CG2-CZ 3.41Å; T133-F383 VanDerWaalsContact CG2-CZ 3.41Å
134	V	93.4	Very high	94.1	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.024	14%	0.136	C	C	.	.	S	Bend	trans	-113	170.8	176.5	-55.9	0	0	0	0	109.7	L131 D138 N139 K177 P178 K378	L131-V134 HydrophobicContact CB-CG2 3.98Å; L131-V134 HydrophobicContact CD2-CB 4.36Å; L131-V134 HydrophobicContact CD2-CG1 3.68Å; L131-V134 HydrophobicContact CD2-CG2 3.76Å; L131-V134 HydrophobicContact CG-CG1 4.38Å; L131-V134 HydrophobicContact CG-CG2 4Å; V134-D138 HydrophobicContact CB-CB 3.86Å; V134-D138 HydrophobicContact CG2-CB 3.9Å; V134-N139 VanDerWaalsContact CG2-ND2 3.33Å; V134-N139 WeakPolarHBondContact CG2-ND2 3.36Å; V134-K177 WeakPolarHBondContact O-CA 3.26Å; V134-P178 VanDerWaalsContact O-CD 3.25Å; V134-P178 WeakPolarHBondContact O-CD 3.5Å; V134-K378 HydrophobicContact CG1-CB 3.84Å
135	T	95.6	Very high	94.2	Very high	27 Å²	27	24.8 Å²	24.8	17%	0.166	14%	0.137	C	C	.	.			trans	-75.5	164.3	-176.5	67.3	0	0	0	0	112.4	R137 D138 N139 Q174 N175 I176	T135-R137 VanDerWaalsContact C-N 3.3Å; T135-R137 PolarHBondContact O-N 3.33Å; T135-D138 WeakPolarHBondContact CB-OD2 3.48Å; T135-D138 PolarHBondContact N-OD2 3.44Å; T135-D138 VanDerWaalsContact N-OD2 3.08Å; T135-D138 PolarHBondContact O-N 2.82Å; T135-D138 PolarHBondContact OG1-N 3.27Å; T135-D138 VanDerWaalsContact OG1-N 3.11Å; T135-D138 PolarHBondContact OG1-OD2 3.21Å; T135-N139 PolarHBondContact O-N 2.94Å; T135-N139 PolarHBondContact O-ND2 3.48Å; T135-Q174 WeakPolarHBondContact CB-O 3.36Å; T135-N175 VanDerWaalsContact CG2-O 3.26Å; T135-N175 WeakPolarHBondContact CG2-O 3.4Å; T135-I176 CarbonylContact C-O 3.55Å; T135-I176 VanDerWaalsContact CA-O 3.3Å; T135-I176 WeakPolarHBondContact CA-O 3.45Å
136	V	97.3	Very high	94.2	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-53.8	-49.2	170.9	172.5	0	0	0	0	110.2	D138 N139 L140 L165 L170 Q174 I176 P178 L183 T187	V136-D138 VanDerWaalsContact C-N 3.33Å; V136-D138 PolarHBondContact O-N 2.97Å; V136-N139 WeakPolarHBondContact O-CB 3.34Å; V136-N139 PolarHBondContact O-N 3.44Å; V136-N139 VanDerWaalsContact O-N 3.16Å; V136-L140 HydrophobicContact CG1-CD1 4.02Å; V136-L140 WeakPolarHBondContact O-CD1 3.37Å; V136-L140 PolarHBondContact O-N 3.41Å; V136-L140 VanDerWaalsContact O-N 3.16Å; V136-L165 HydrophobicContact CG1-CD2 3.95Å; V136-L170 HydrophobicContact CG1-CB 4.47Å; V136-L170 HydrophobicContact CG1-CD1 4.07Å; V136-Q174 PolarHBondContact N-O 3.36Å; V136-I176 WeakPolarHBondContact CG2-O 3.48Å; V136-I176 PolarHBondContact N-O 2.95Å; V136-P178 HydrophobicContact CG2-CB 4.26Å; V136-L183 HydrophobicContact CG2-CD1 4Å; V136-L183 HydrophobicContact CG2-CD2 4.29Å; V136-L183 HydrophobicContact CG2-CG 4.13Å; V136-T187 HydrophobicContact CG1-CG2 4.1Å; V136-T187 WeakPolarHBondContact CG2-OG1 3.45Å
137	R	97.3	Very high	94.4	Very high	34 Å²	34	20.8 Å²	20.8	13%	0.128	12%	0.117	C	C	.	.	H	α-helix	trans	-59.4	-41.5	178.3	178.1	171.8	-73.4	-80.3	3.7	112.4	T135 N139 L140 E141 N162 Q174	T135-R137 VanDerWaalsContact C-N 3.3Å; T135-R137 PolarHBondContact O-N 3.33Å; R137-N139 VanDerWaalsContact C-N 3.3Å; R137-N139 PolarHBondContact O-N 3.04Å; R137-L140 PolarHBondContact O-N 3Å; R137-E141 HydrophobicContact CG-CG 4.19Å; R137-E141 WeakPolarHBondContact O-CB 3.37Å; R137-E141 WeakPolarHBondContact O-CG 3.23Å; R137-E141 PolarHBondContact O-N 3.47Å; R137-N162 PolarHBondContact NH1-OD1 2.8Å; R137-N162 PolarHBondContact NH2-OD1 3.02Å; R137-Q174 HydrophobicContact CB-CB 4.4Å; R137-Q174 VanDerWaalsContact CB-O 3.32Å; R137-Q174 WeakPolarHBondContact CB-O 3.49Å; R137-Q174 PolarHBondContact N-O 3.07Å
138	D	96.5	Very high	94.6	Very high	30 Å²	30	14.8 Å²	14.8	16%	0.16	9%	0.085	C	C	.	.	H	α-helix	trans	-60.6	-39.2	177.6	-70	-51.7	0	0	0	112.4	V134 T135 V136 F142 K378	V134-D138 HydrophobicContact CB-CB 3.86Å; V134-D138 HydrophobicContact CG2-CB 3.9Å; T135-D138 WeakPolarHBondContact CB-OD2 3.48Å; T135-D138 PolarHBondContact N-OD2 3.44Å; T135-D138 VanDerWaalsContact N-OD2 3.08Å; T135-D138 PolarHBondContact O-N 2.82Å; T135-D138 PolarHBondContact OG1-N 3.27Å; T135-D138 VanDerWaalsContact OG1-N 3.11Å; T135-D138 PolarHBondContact OG1-OD2 3.21Å; V136-D138 VanDerWaalsContact C-N 3.33Å; V136-D138 PolarHBondContact O-N 2.97Å; D138-F142 WeakPolarHBondContact O-CB 3.47Å; D138-F142 PolarHBondContact O-N 3.4Å; D138-K378 IonicContact OD1-NZ 3.32Å; D138-K378 PolarHBondContact OD1-NZ 2.91Å
139	N	97.1	Very high	94.6	Very high	7 Å²	7	15.4 Å²	15.4	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-64.1	-44.8	176.1	-78.1	-76.7	0	0	0	111.1	V130 L131 V134 T135 V136 R137 F142 S143 T187 M191	V130-N139 HydrophobicContact CG1-CB 4.33Å; L131-N139 WeakPolarHBondContact CB-OD1 3.48Å; L131-N139 PolarHBondContact N-OD1 3.15Å; L131-N139 VanDerWaalsContact N-OD1 3.16Å; L131-N139 PolarHBondContact O-ND2 3.19Å; L131-N139 VanDerWaalsContact O-ND2 3.15Å; V134-N139 VanDerWaalsContact CG2-ND2 3.33Å; V134-N139 WeakPolarHBondContact CG2-ND2 3.36Å; T135-N139 PolarHBondContact O-N 2.94Å; T135-N139 PolarHBondContact O-ND2 3.48Å; V136-N139 WeakPolarHBondContact O-CB 3.34Å; V136-N139 PolarHBondContact O-N 3.44Å; V136-N139 VanDerWaalsContact O-N 3.16Å; R137-N139 VanDerWaalsContact C-N 3.3Å; R137-N139 PolarHBondContact O-N 3.04Å; N139-F142 PolarHBondContact O-N 3.08Å; N139-S143 PolarHBondContact O-N 2.69Å; N139-S143 VanDerWaalsContact O-N 3.07Å; N139-T187 HydrophobicContact CB-CG2 4.04Å; N139-M191 HydrophobicContact CB-CG 4.36Å; N139-M191 HydrophobicContact CB-SD 3.81Å
140	L	97.6	Very high	94.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-42.5	177.1	-85.5	69.2	0	0	0	111.9	V136 R137 F142 S143 A144 I161 V164 L165 T187 A190 M191 V194	V136-L140 HydrophobicContact CG1-CD1 4.02Å; V136-L140 WeakPolarHBondContact O-CD1 3.37Å; V136-L140 PolarHBondContact O-N 3.41Å; V136-L140 VanDerWaalsContact O-N 3.16Å; R137-L140 PolarHBondContact O-N 3Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 3.14Å; L140-S143 PolarHBondContact O-N 3.22Å; L140-A144 VanDerWaalsContact O-CB 3.27Å; L140-A144 WeakPolarHBondContact O-CB 3.43Å; L140-A144 PolarHBondContact O-N 3.32Å; L140-I161 HydrophobicContact CB-CG1 4.42Å; L140-I161 HydrophobicContact CB-CG2 4.07Å; L140-I161 HydrophobicContact CD2-CG2 3.98Å; L140-V164 HydrophobicContact CD2-CG1 4.35Å; L140-L165 HydrophobicContact CD2-CD2 3.75Å; L140-L165 HydrophobicContact CD2-CG 3.81Å; L140-T187 HydrophobicContact CD1-CG2 4.06Å; L140-A190 HydrophobicContact CD1-CB 3.86Å; L140-A190 HydrophobicContact CD2-CB 4.07Å; L140-A190 HydrophobicContact CG-CB 4.14Å; L140-M191 HydrophobicContact CD1-CG 4.26Å; L140-V194 HydrophobicContact CD2-CG2 4.14Å; L140-V194 HydrophobicContact CG-CG2 4.22Å
141	E	97.1	Very high	94.5	Very high	52 Å²	52	23.5 Å²	23.5	24%	0.243	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-40.5	176.3	-76.7	-178.8	180	0	0	111.8	R137 A145 I161 K378	R137-E141 HydrophobicContact CG-CG 4.19Å; R137-E141 WeakPolarHBondContact O-CB 3.37Å; R137-E141 WeakPolarHBondContact O-CG 3.23Å; R137-E141 PolarHBondContact O-N 3.47Å; E141-A145 WeakPolarHBondContact O-CB 3.49Å; E141-A145 PolarHBondContact O-N 3.29Å; E141-I161 HydrophobicContact CB-CD1 4.39Å; E141-I161 HydrophobicContact CG-CD1 3.76Å; E141-K378 IonicContact OE2-NZ 3.52Å
142	F	96.7	Very high	94.5	Very high	7 Å²	7	24.4 Å²	24.4	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-47.5	176.4	-177.4	-103.1	0	0	0	111.9	D138 N139 L140 A145 L146 W371 I372 Q375 Y455 Y456	D138-F142 WeakPolarHBondContact O-CB 3.47Å; D138-F142 PolarHBondContact O-N 3.4Å; N139-F142 PolarHBondContact O-N 3.08Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 3.14Å; F142-A145 PolarHBondContact O-N 3.39Å; F142-L146 HydrophobicContact CD1-CD1 4.2Å; F142-L146 HydrophobicContact CD2-CD1 4.11Å; F142-L146 HydrophobicContact CE1-CD1 3.66Å; F142-L146 HydrophobicContact CE2-CD1 3.56Å; F142-L146 HydrophobicContact CE2-CG 4.47Å; F142-L146 HydrophobicContact CG-CD1 4.42Å; F142-L146 HydrophobicContact CZ-CD1 3.31Å; F142-L146 WeakPolarHBondContact O-CG 3.39Å; F142-L146 PolarHBondContact O-N 3.45Å; F142-W371 HydrophobicContact CD2-CB 4.43Å; F142-W371 HydrophobicContact CD2-CE3 4.43Å; F142-W371 HydrophobicContact CE2-CB 4.3Å; F142-I372 HydrophobicContact CZ-CG1 4.41Å; F142-Q375 HydrophobicContact CD2-CB 3.71Å; F142-Q375 HydrophobicContact CD2-CG 3.76Å; F142-Q375 HydrophobicContact CE2-CB 3.66Å; F142-Q375 HydrophobicContact CE2-CG 3.92Å; F142-Q375 HydrophobicContact CG-CG 4.19Å; F142-Q375 HydrophobicContact CZ-CG 4.47Å; F142-Y455 HydrophobicContact CD1-CD1 4.09Å; F142-Y455 HydrophobicContact CD1-CE1 4.1Å; F142-Y455 AromaticContact CE1-CD1 3.86Å; F142-Y455 HydrophobicContact CE1-CD1 3.86Å; F142-Y455 HydrophobicContact CE1-CE1 4.27Å; F142-Y456 HydrophobicContact CZ-CE1 4.26Å
143	S	96	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.2	-51.5	174.9	179.4	0	0	0	0	111.6	N139 L140 A145 L146 R147 M191 Y455	N139-S143 PolarHBondContact O-N 2.69Å; N139-S143 VanDerWaalsContact O-N 3.07Å; L140-S143 PolarHBondContact O-N 3.22Å; S143-A145 VanDerWaalsContact C-N 3.29Å; S143-A145 PolarHBondContact O-N 2.82Å; S143-L146 PolarHBondContact O-N 2.76Å; S143-R147 WeakPolarHBondContact O-CB 3.41Å; S143-R147 PolarHBondContact O-N 3.3Å; S143-M191 PolarHBondContact OG-O 3.25Å; S143-Y455 WeakPolarHBondContact CB-OH 3.19Å; S143-Y455 PolarHBondContact OG-OH 2.87Å
144	A	96.1	Very high	95	Very high	1 Å²	1	36 Å²	36	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-40.1	179.6	0	0	0	0	0	112.3	L140 L146 L148 K157 I161 V194	L140-A144 VanDerWaalsContact O-CB 3.27Å; L140-A144 WeakPolarHBondContact O-CB 3.43Å; L140-A144 PolarHBondContact O-N 3.32Å; A144-L146 VanDerWaalsContact C-N 3.31Å; A144-L146 PolarHBondContact O-N 3.18Å; A144-L148 HydrophobicContact CB-CD1 4.08Å; A144-L148 WeakPolarHBondContact O-CB 3.23Å; A144-L148 PolarHBondContact O-N 3.35Å; A144-K157 PolarHBondContact O-NZ 3.12Å; A144-I161 HydrophobicContact CB-CD1 3.85Å; A144-I161 HydrophobicContact CB-CG1 4.15Å; A144-V194 HydrophobicContact CB-CG1 3.66Å
145	A	95.9	Very high	95.1	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.033	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-37.5	-178.8	0	0	0	0	0	112.6	E141 F142 S143 H367 W371	E141-A145 WeakPolarHBondContact O-CB 3.49Å; E141-A145 PolarHBondContact O-N 3.29Å; F142-A145 PolarHBondContact O-N 3.39Å; S143-A145 VanDerWaalsContact C-N 3.29Å; S143-A145 PolarHBondContact O-N 2.82Å; A145-H367 PolarHBondContact O-CD2 2.86Å; A145-H367 PolarHBondContact O-NE2 3.43Å; A145-W371 HydrophobicContact CB-CD2 3.43Å; A145-W371 VanDerWaalsContact CB-CD2 3.43Å; A145-W371 HydrophobicContact CB-CE3 3.85Å; A145-W371 HydrophobicContact CB-CG 3.9Å; A145-W371 HydrophobicContact CB-CH2 3.9Å; A145-W371 HydrophobicContact CB-CZ2 3.51Å; A145-W371 HydrophobicContact CB-CZ3 4.06Å
146	L	95	Very high	95.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-93.7	-28.3	-170.5	-71.3	-175.4	0	0	0	114.3	F142 S143 A144 T363 Q368 W371 Y455 Y456	F142-L146 HydrophobicContact CD1-CD1 4.2Å; F142-L146 HydrophobicContact CD2-CD1 4.11Å; F142-L146 HydrophobicContact CE1-CD1 3.66Å; F142-L146 HydrophobicContact CE2-CD1 3.56Å; F142-L146 HydrophobicContact CE2-CG 4.47Å; F142-L146 HydrophobicContact CG-CD1 4.42Å; F142-L146 HydrophobicContact CZ-CD1 3.31Å; F142-L146 WeakPolarHBondContact O-CG 3.39Å; F142-L146 PolarHBondContact O-N 3.45Å; S143-L146 PolarHBondContact O-N 2.76Å; A144-L146 VanDerWaalsContact C-N 3.31Å; A144-L146 PolarHBondContact O-N 3.18Å; L146-T363 WeakPolarHBondContact O-CG2 3.42Å; L146-T363 PolarHBondContact O-OG1 3.29Å; L146-Q368 HydrophobicContact CD2-CB 4.21Å; L146-Q368 HydrophobicContact CD2-CG 4.11Å; L146-W371 HydrophobicContact CD2-CB 3.81Å; L146-W371 HydrophobicContact CD2-CG 4.35Å; L146-W371 HydrophobicContact CG-CB 4.27Å; L146-Y455 HydrophobicContact CB-CD1 4.37Å; L146-Y455 WeakPolarHBondContact CB-O 3.46Å; L146-Y455 HydrophobicContact CD1-CD1 4.09Å; L146-Y456 HydrophobicContact CD1-CD1 4Å
147	R	94	Very high	95	Very high	15 Å²	15	43.3 Å²	43.3	6%	0.057	22%	0.221	C	C	.	.	H	α-helix	trans	-107.7	-23.1	-173.1	-62.9	173.6	76.7	-174.9	14.1	114.1	S143 E192 T195 H197 S453 Y455	S143-R147 WeakPolarHBondContact O-CB 3.41Å; S143-R147 PolarHBondContact O-N 3.3Å; R147-E192 IonicContact CZ-OE1 3.94Å; R147-E192 IonicContact CZ-OE2 3.32Å; R147-E192 IonicContact NH1-OE1 3.07Å; R147-E192 PolarHBondContact NH1-OE1 2.81Å; R147-E192 IonicContact NH1-OE2 3.69Å; R147-E192 PolarHBondContact NH1-OE2 2.89Å; R147-E192 IonicContact NH2-OE1 3.36Å; R147-E192 IonicContact NH2-OE2 2.74Å; R147-E192 PolarHBondContact NH2-OE2 3.48Å; R147-T195 HydrophobicContact CB-CG2 3.37Å; R147-T195 HydrophobicContact CG-CG2 4.31Å; R147-H197 VanDerWaalsContact CZ-CE1 3.46Å; R147-H197 PolarHBondContact NH2-CE1 3.48Å; R147-H197 PolarHBondContact NH2-NE2 3.11Å; R147-H197 VanDerWaalsContact NH2-NE2 3.15Å; R147-S453 PolarHBondContact NE-O 2.95Å; R147-S453 PolarHBondContact NH2-O 3.49Å; R147-Y455 VanDerWaalsContact CD-CE2 3.49Å; R147-Y455 HydrophobicContact CG-CD1 4.45Å; R147-Y455 HydrophobicContact CG-CD2 4.25Å; R147-Y455 HydrophobicContact CG-CG 4.22Å
148	L	92.8	Very high	95	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.239	C	C	.	.	S	Bend	trans	-81.8	140.2	169.7	-65.8	173.3	0	0	0	110.6	A144 I152 K157 V194	A144-L148 HydrophobicContact CB-CD1 4.08Å; A144-L148 WeakPolarHBondContact O-CB 3.23Å; A144-L148 PolarHBondContact O-N 3.35Å; L148-I152 HydrophobicContact CB-CD1 4.23Å; L148-I152 HydrophobicContact CD2-CD1 4.18Å; L148-K157 HydrophobicContact CD1-CD 4.38Å; L148-K157 HydrophobicContact CD1-CG 3.96Å; L148-K157 PolarHBondContact O-NZ 3.4Å; L148-V194 HydrophobicContact CD1-CG1 4.3Å
149	P	90.7	Very high	95	Very high	33 Å²	33	52.3 Å²	52.3	21%	0.214	25%	0.253	C	S	.	.			trans	-48	147.1	174.6	-28.1	34.2	0	0	0	113.2	T151 I152 K157 V362	P149-T151 WeakPolarHBondContact CB-OG1 3.24Å; P149-T151 PolarHBondContact O-N 3.25Å; P149-I152 HydrophobicContact CB-CG1 4.39Å; P149-I152 PolarHBondContact O-N 2.9Å; P149-K157 PolarHBondContact O-NZ 2.59Å; P149-V362 HydrophobicContact CB-CG1 4.23Å; P149-V362 HydrophobicContact CG-CG1 3.83Å
150	V	90.4	Very high	95	Very high	78 Å²	78	54.2 Å²	54.2	47%	0.473	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.6	178.4	-173	0	0	0	0	111.5	I152 T363 P364	V150-I152 PolarHBondContact O-N 3.33Å; V150-T363 HydrophobicContact CG2-CG2 3.95Å; V150-P364 HydrophobicContact CG2-CG 4.32Å
151	T	92.2	Very high	95	Very high	129 Å²	129	54.4 Å²	54.4	79%	0.791	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23	174.7	52.3	0	0	0	0	113.2	P149 T153	P149-T151 WeakPolarHBondContact CB-OG1 3.24Å; P149-T151 PolarHBondContact O-N 3.25Å; T151-T153 PolarHBondContact O-N 3.47Å
152	I	92.8	Very high	95	Very high	36 Å²	36	54.9 Å²	54.9	19%	0.185	27%	0.265	C	S	.	.	S	Bend	trans	-74	125.2	176.7	-60.3	-173	0	0	0	109.8	L148 P149 V150 E156 K157	L148-I152 HydrophobicContact CB-CD1 4.23Å; L148-I152 HydrophobicContact CD2-CD1 4.18Å; P149-I152 HydrophobicContact CB-CG1 4.39Å; P149-I152 PolarHBondContact O-N 2.9Å; V150-I152 PolarHBondContact O-N 3.33Å; I152-E156 HydrophobicContact CG2-CB 3.77Å; I152-E156 HydrophobicContact CG2-CG 3.46Å; I152-E156 VanDerWaalsContact CG2-CG 3.46Å; I152-K157 HydrophobicContact CB-CG 4.4Å; I152-K157 HydrophobicContact CG2-CG 3.76Å; I152-K157 WeakPolarHBondContact O-CE 3.49Å
153	T	95.2	Very high	94.9	Very high	88 Å²	88	58.3 Å²	58.3	54%	0.54	28%	0.281	S	S	.	.			trans	-63.4	156.8	-178.7	68	0	0	0	0	112	T151 D155 E156 K157	T151-T153 PolarHBondContact O-N 3.47Å; T153-D155 VanDerWaalsContact C-N 3.28Å; T153-D155 PolarHBondContact O-N 3Å; T153-E156 PolarHBondContact O-N 3.48Å; T153-E156 WeakPolarHBondContact OG1-CB 3.48Å; T153-E156 PolarHBondContact OG1-N 3.3Å; T153-K157 WeakPolarHBondContact O-CG 3.47Å; T153-K157 PolarHBondContact O-N 3Å
154	R	94.5	Very high	94.8	Very high	205 Å²	205	58.8 Å²	58.8	77%	0.774	28%	0.284	S	S	*	.	H	α-helix	trans	-60.9	-38.2	178.6	-70.4	-176.7	178.6	173.7	2.9	112.5	K157 R158	R154-K157 PolarHBondContact O-N 3.2Å; R154-R158 WeakPolarHBondContact O-CB 3.22Å; R154-R158 PolarHBondContact O-N 3.13Å
155	D	96	Very high	94.8	Very high	114 Å²	114	58.8 Å²	58.8	61%	0.61	28%	0.283	S	S	*	.	H	α-helix	trans	-68.7	-38.8	-180	-61.8	-42.1	0	0	0	111.4	T153 R158 R159	T153-D155 VanDerWaalsContact C-N 3.28Å; T153-D155 PolarHBondContact O-N 3Å; D155-R158 PolarHBondContact O-N 3.3Å; D155-R158 IonicContact OD1-NH1 3.68Å; D155-R159 WeakPolarHBondContact O-CB 3.22Å; D155-R159 PolarHBondContact O-N 2.95Å
156	E	95.8	Very high	94.8	Very high	47 Å²	47	64.6 Å²	64.6	22%	0.22	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-42.7	173.9	176.1	56.5	-163.9	0	0	111.8	I152 T153 R158 R159 R160	I152-E156 HydrophobicContact CG2-CB 3.77Å; I152-E156 HydrophobicContact CG2-CG 3.46Å; I152-E156 VanDerWaalsContact CG2-CG 3.46Å; T153-E156 PolarHBondContact O-N 3.48Å; T153-E156 WeakPolarHBondContact OG1-CB 3.48Å; T153-E156 PolarHBondContact OG1-N 3.3Å; E156-R158 VanDerWaalsContact C-N 3.29Å; E156-R158 PolarHBondContact O-N 3.03Å; E156-R159 VanDerWaalsContact CD-NH2 3.27Å; E156-R159 PolarHBondContact O-N 3.2Å; E156-R159 IonicContact OE1-CZ 3.88Å; E156-R159 IonicContact OE1-NE 3.51Å; E156-R159 IonicContact OE1-NH2 3.08Å; E156-R159 PolarHBondContact OE1-NH2 3.22Å; E156-R159 IonicContact OE2-CZ 2.85Å; E156-R159 IonicContact OE2-NE 3.92Å; E156-R159 PolarHBondContact OE2-NE 2.86Å; E156-R159 IonicContact OE2-NH2 3.41Å; E156-R159 PolarHBondContact OE2-NH2 3.16Å; E156-R159 VanDerWaalsContact OE2-NH2 3.08Å; E156-R160 WeakPolarHBondContact O-CG 3.32Å; E156-R160 PolarHBondContact O-N 2.9Å; E156-R160 IonicContact OE1-CZ 2.63Å; E156-R160 IonicContact OE1-NE 3.03Å; E156-R160 PolarHBondContact OE1-NE 3.11Å; E156-R160 IonicContact OE1-NH2 3.55Å
157	K	96.1	Very high	94.6	Very high	25 Å²	25	66.1 Å²	66.1	11%	0.109	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-43	172.7	-66.4	-169	-176.3	-158.2	0	111.2	A144 L148 P149 I152 T153 R154 R160 I161	A144-K157 PolarHBondContact O-NZ 3.12Å; L148-K157 HydrophobicContact CD1-CD 4.38Å; L148-K157 HydrophobicContact CD1-CG 3.96Å; L148-K157 PolarHBondContact O-NZ 3.4Å; P149-K157 PolarHBondContact O-NZ 2.59Å; I152-K157 HydrophobicContact CB-CG 4.4Å; I152-K157 HydrophobicContact CG2-CG 3.76Å; I152-K157 WeakPolarHBondContact O-CE 3.49Å; T153-K157 WeakPolarHBondContact O-CG 3.47Å; T153-K157 PolarHBondContact O-N 3Å; R154-K157 PolarHBondContact O-N 3.2Å; K157-R160 PolarHBondContact O-N 3.01Å; K157-I161 VanDerWaalsContact O-CG1 3.26Å; K157-I161 WeakPolarHBondContact O-CG1 3.37Å; K157-I161 PolarHBondContact O-N 3.41Å; K157-I161 VanDerWaalsContact O-N 3.09Å
158	R	96.7	Very high	94.5	Very high	136 Å²	136	65.6 Å²	65.6	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-40.3	178.5	-173.5	179.5	-68.7	153.5	-2.9	112.1	R154 D155 E156 I161 N162	R154-R158 WeakPolarHBondContact O-CB 3.22Å; R154-R158 PolarHBondContact O-N 3.13Å; D155-R158 PolarHBondContact O-N 3.3Å; D155-R158 IonicContact OD1-NH1 3.68Å; E156-R158 VanDerWaalsContact C-N 3.29Å; E156-R158 PolarHBondContact O-N 3.03Å; R158-I161 PolarHBondContact O-N 2.96Å; R158-N162 PolarHBondContact O-N 3.29Å; R158-N162 PolarHBondContact O-ND2 3.45Å; R158-N162 PolarHBondContact O-OD1 3.11Å
159	R	96.9	Very high	94.5	Very high	117 Å²	117	70.7 Å²	70.7	44%	0.442	34%	0.34	S	S	.	.	H	α-helix	trans	-58.3	-52.3	175.5	-173.8	-174.8	67.8	96.5	-3.4	110.8	D155 E156 I161 N162 E163	D155-R159 WeakPolarHBondContact O-CB 3.22Å; D155-R159 PolarHBondContact O-N 2.95Å; E156-R159 VanDerWaalsContact CD-NH2 3.27Å; E156-R159 PolarHBondContact O-N 3.2Å; E156-R159 IonicContact OE1-CZ 3.88Å; E156-R159 IonicContact OE1-NE 3.51Å; E156-R159 IonicContact OE1-NH2 3.08Å; E156-R159 PolarHBondContact OE1-NH2 3.22Å; E156-R159 IonicContact OE2-CZ 2.85Å; E156-R159 IonicContact OE2-NE 3.92Å; E156-R159 PolarHBondContact OE2-NE 2.86Å; E156-R159 IonicContact OE2-NH2 3.41Å; E156-R159 PolarHBondContact OE2-NH2 3.16Å; E156-R159 VanDerWaalsContact OE2-NH2 3.08Å; R159-I161 VanDerWaalsContact C-N 3.31Å; R159-I161 PolarHBondContact O-N 3.45Å; R159-N162 PolarHBondContact O-N 3.26Å; R159-N162 VanDerWaalsContact O-N 3.09Å; R159-E163 WeakPolarHBondContact CG-OE1 3.34Å; R159-E163 IonicContact CZ-OE1 3.34Å; R159-E163 IonicContact NE-OE1 2.72Å; R159-E163 IonicContact NH1-OE1 3.63Å; R159-E163 PolarHBondContact NH1-OE1 3.43Å; R159-E163 IonicContact NH1-OE2 2.76Å; R159-E163 WeakPolarHBondContact O-CG 3.48Å; R159-E163 PolarHBondContact O-N 3.04Å
160	R	95.6	Very high	94.6	Very high	46 Å²	46	69.1 Å²	69.1	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-57	-43	177.2	-68.1	178.4	-177.9	-129.5	-5.6	112.7	E156 K157 E163 V164 E196	E156-R160 WeakPolarHBondContact O-CG 3.32Å; E156-R160 PolarHBondContact O-N 2.9Å; E156-R160 IonicContact OE1-CZ 2.63Å; E156-R160 IonicContact OE1-NE 3.03Å; E156-R160 PolarHBondContact OE1-NE 3.11Å; E156-R160 IonicContact OE1-NH2 3.55Å; K157-R160 PolarHBondContact O-N 3.01Å; R160-E163 PolarHBondContact O-N 3.33Å; R160-V164 WeakPolarHBondContact O-CG2 3.15Å; R160-V164 PolarHBondContact O-N 3.2Å; R160-E196 IonicContact CZ-OE2 3.77Å; R160-E196 IonicContact NH1-OE2 3.9Å; R160-E196 PolarHBondContact NH1-OE2 3.24Å; R160-E196 IonicContact NH2-OE2 3.61Å
161	I	97.3	Very high	94.8	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-61.2	-45.9	176.4	-69.7	166.7	0	0	0	110.8	L140 E141 A144 K157 R158 R159 E163 V164 L165 V194	L140-I161 HydrophobicContact CB-CG1 4.42Å; L140-I161 HydrophobicContact CB-CG2 4.07Å; L140-I161 HydrophobicContact CD2-CG2 3.98Å; E141-I161 HydrophobicContact CB-CD1 4.39Å; E141-I161 HydrophobicContact CG-CD1 3.76Å; A144-I161 HydrophobicContact CB-CD1 3.85Å; A144-I161 HydrophobicContact CB-CG1 4.15Å; K157-I161 VanDerWaalsContact O-CG1 3.26Å; K157-I161 WeakPolarHBondContact O-CG1 3.37Å; K157-I161 PolarHBondContact O-N 3.41Å; K157-I161 VanDerWaalsContact O-N 3.09Å; R158-I161 PolarHBondContact O-N 2.96Å; R159-I161 VanDerWaalsContact C-N 3.31Å; R159-I161 PolarHBondContact O-N 3.45Å; I161-E163 VanDerWaalsContact C-N 3.35Å; I161-E163 PolarHBondContact O-N 3.26Å; I161-V164 PolarHBondContact O-N 2.94Å; I161-L165 HydrophobicContact CG2-CD1 3.85Å; I161-L165 HydrophobicContact CG2-CG 4.32Å; I161-L165 WeakPolarHBondContact O-CB 3.28Å; I161-L165 VanDerWaalsContact O-CG 3.28Å; I161-L165 WeakPolarHBondContact O-CG 3.49Å; I161-L165 PolarHBondContact O-N 2.86Å; I161-V194 HydrophobicContact CG1-CG1 4.04Å; I161-V194 HydrophobicContact CG1-CG2 4.34Å
162	N	97.3	Very high	94.8	Very high	63 Å²	63	72 Å²	72	34%	0.337	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-40.8	179.8	-67.9	-14.9	0	0	0	111.9	R137 R158 R159 V164 L165 E166	R137-N162 PolarHBondContact NH1-OD1 2.8Å; R137-N162 PolarHBondContact NH2-OD1 3.02Å; R158-N162 PolarHBondContact O-N 3.29Å; R158-N162 PolarHBondContact O-ND2 3.45Å; R158-N162 PolarHBondContact O-OD1 3.11Å; R159-N162 PolarHBondContact O-N 3.26Å; R159-N162 VanDerWaalsContact O-N 3.09Å; N162-V164 PolarHBondContact O-N 2.84Å; N162-L165 PolarHBondContact O-N 3.27Å; N162-E166 WeakPolarHBondContact O-CB 3.41Å; N162-E166 PolarHBondContact O-N 3.18Å
163	E	94.9	Very high	94.9	Very high	79 Å²	79	72.7 Å²	72.7	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-44.4	175.7	-73.1	172.6	-170.9	0	0	111.7	R159 R160 I161 E166 L167	R159-E163 WeakPolarHBondContact CG-OE1 3.34Å; R159-E163 IonicContact CZ-OE1 3.34Å; R159-E163 IonicContact NE-OE1 2.72Å; R159-E163 IonicContact NH1-OE1 3.63Å; R159-E163 PolarHBondContact NH1-OE1 3.43Å; R159-E163 IonicContact NH1-OE2 2.76Å; R159-E163 WeakPolarHBondContact O-CG 3.48Å; R159-E163 PolarHBondContact O-N 3.04Å; R160-E163 PolarHBondContact O-N 3.33Å; I161-E163 VanDerWaalsContact C-N 3.35Å; I161-E163 PolarHBondContact O-N 3.26Å; E163-E166 PolarHBondContact O-N 2.92Å; E163-L167 WeakPolarHBondContact O-CB 3.27Å; E163-L167 PolarHBondContact O-N 2.93Å
164	V	95.1	Very high	94.8	Very high	10 Å²	10	70.5 Å²	70.5	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-67.8	-39.3	177.5	173.2	0	0	0	0	111.8	L140 R160 I161 N162 E166 L167 L168 A190 L193 V194	L140-V164 HydrophobicContact CD2-CG1 4.35Å; R160-V164 WeakPolarHBondContact O-CG2 3.15Å; R160-V164 PolarHBondContact O-N 3.2Å; I161-V164 PolarHBondContact O-N 2.94Å; N162-V164 PolarHBondContact O-N 2.84Å; V164-E166 VanDerWaalsContact C-N 3.3Å; V164-E166 PolarHBondContact O-N 3.26Å; V164-L167 PolarHBondContact O-N 3.48Å; V164-L168 HydrophobicContact CG1-CD1 4.19Å; V164-L168 PolarHBondContact O-N 3.21Å; V164-A190 HydrophobicContact CG1-CB 3.68Å; V164-L193 HydrophobicContact CG1-CB 4.12Å; V164-L193 HydrophobicContact CG2-CB 4.12Å; V164-V194 HydrophobicContact CB-CG2 3.95Å; V164-V194 HydrophobicContact CG1-CG2 4.09Å; V164-V194 HydrophobicContact CG2-CG2 3.8Å
165	L	96.2	Very high	94.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-39.8	175.6	-74.2	170.1	0	0	0	111.7	V136 L140 I161 N162 H169 L170 N171 Q174	V136-L165 HydrophobicContact CG1-CD2 3.95Å; L140-L165 HydrophobicContact CD2-CD2 3.75Å; L140-L165 HydrophobicContact CD2-CG 3.81Å; I161-L165 HydrophobicContact CG2-CD1 3.85Å; I161-L165 HydrophobicContact CG2-CG 4.32Å; I161-L165 WeakPolarHBondContact O-CB 3.28Å; I161-L165 VanDerWaalsContact O-CG 3.28Å; I161-L165 WeakPolarHBondContact O-CG 3.49Å; I161-L165 PolarHBondContact O-N 2.86Å; N162-L165 PolarHBondContact O-N 3.27Å; L165-H169 PolarHBondContact O-N 3.45Å; L165-L170 HydrophobicContact CB-CB 4.45Å; L165-L170 HydrophobicContact CD2-CB 3.58Å; L165-L170 HydrophobicContact CD2-CD1 4.22Å; L165-L170 WeakPolarHBondContact O-CA 3.42Å; L165-L170 PolarHBondContact O-N 2.94Å; L165-N171 WeakPolarHBondContact CB-OD1 3.42Å; L165-N171 PolarHBondContact O-N 2.88Å; L165-Q174 HydrophobicContact CD1-CB 4.08Å; L165-Q174 HydrophobicContact CD2-CB 4.19Å
166	E	94.5	Very high	94.8	Very high	126 Å²	126	64.9 Å²	64.9	59%	0.589	30%	0.298	S	S	*	.	H	α-helix	trans	-67.7	-46.1	175.2	-175.9	174.8	-173.8	0	0	111.6	N162 E163 V164 L168 H169 N171	N162-E166 WeakPolarHBondContact O-CB 3.41Å; N162-E166 PolarHBondContact O-N 3.18Å; E163-E166 PolarHBondContact O-N 2.92Å; V164-E166 VanDerWaalsContact C-N 3.3Å; V164-E166 PolarHBondContact O-N 3.26Å; E166-L168 VanDerWaalsContact C-N 3.28Å; E166-L168 PolarHBondContact O-N 3.26Å; E166-H169 PolarHBondContact O-N 2.78Å; E166-N171 WeakPolarHBondContact CA-ND2 3.12Å; E166-N171 PolarHBondContact N-OD1 3.15Å
167	L	91.2	Very high	94.7	Very high	32 Å²	32	65.7 Å²	65.7	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-58.7	-37.8	-177.5	-171.3	64.9	0	0	0	112.6	E163 V164 V220	E163-L167 WeakPolarHBondContact O-CB 3.27Å; E163-L167 PolarHBondContact O-N 2.93Å; V164-L167 PolarHBondContact O-N 3.48Å; L167-V220 HydrophobicContact CD1-CG1 4.24Å; L167-V220 HydrophobicContact CD1-CG2 3.85Å; L167-V220 HydrophobicContact CD2-CG1 3.53Å; L167-V220 HydrophobicContact CG-CB 4.21Å; L167-V220 HydrophobicContact CG-CG1 3.57Å; L167-V220 HydrophobicContact CG-CG2 3.67Å; L167-V220 WeakPolarHBondContact O-CG2 3.17Å
168	L	92.2	Very high	94.6	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.026	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	14.3	178.8	-69.7	170.3	0	0	0	113.8	V164 E166 L170 I189 A190 L193 V217 V220	V164-L168 HydrophobicContact CG1-CD1 4.19Å; V164-L168 PolarHBondContact O-N 3.21Å; E166-L168 VanDerWaalsContact C-N 3.28Å; E166-L168 PolarHBondContact O-N 3.26Å; L168-L170 HydrophobicContact CB-CD1 3.94Å; L168-L170 HydrophobicContact CB-CG 4.06Å; L168-L170 HydrophobicContact CD1-CD1 4.46Å; L168-L170 PolarHBondContact O-N 2.96Å; L168-I189 HydrophobicContact CD1-CB 4.44Å; L168-I189 HydrophobicContact CD1-CG2 4.2Å; L168-A190 HydrophobicContact CD1-CB 3.56Å; L168-L193 HydrophobicContact CD1-CD1 4Å; L168-L193 HydrophobicContact CG-CD1 4.45Å; L168-V217 HydrophobicContact CD2-CG2 4.31Å; L168-V220 HydrophobicContact CD2-CB 4.4Å; L168-V220 HydrophobicContact CD2-CG1 4.15Å; L168-V220 HydrophobicContact CD2-CG2 4.28Å
169	H	92.3	Very high	94.3	Very high	112 Å²	112	68 Å²	68	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	30.7	179.6	-56.4	-52	0	0	0	114.5	L165 E166 D216	L165-H169 PolarHBondContact O-N 3.45Å; E166-H169 PolarHBondContact O-N 2.78Å; H169-D216 IonicContact CD2-OD2 2.95Å; H169-D216 IonicContact NE2-OD2 3.69Å
170	L	94.2	Very high	94	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.308	C	S	.	.			trans	-90	-0.2	-179.8	-65.6	170.8	0	0	0	113.3	V136 L165 L168 K172 E173 Q174 L183 R186 A190	V136-L170 HydrophobicContact CG1-CB 4.47Å; V136-L170 HydrophobicContact CG1-CD1 4.07Å; L165-L170 HydrophobicContact CB-CB 4.45Å; L165-L170 HydrophobicContact CD2-CB 3.58Å; L165-L170 HydrophobicContact CD2-CD1 4.22Å; L165-L170 WeakPolarHBondContact O-CA 3.42Å; L165-L170 PolarHBondContact O-N 2.94Å; L168-L170 HydrophobicContact CB-CD1 3.94Å; L168-L170 HydrophobicContact CB-CG 4.06Å; L168-L170 HydrophobicContact CD1-CD1 4.46Å; L168-L170 PolarHBondContact O-N 2.96Å; L170-K172 VanDerWaalsContact C-N 3.28Å; L170-K172 PolarHBondContact O-N 2.88Å; L170-E173 CarbonylContact O-C 3.58Å; L170-E173 PolarHBondContact O-N 3.28Å; L170-Q174 PolarHBondContact O-N 3.39Å; L170-L183 HydrophobicContact CD2-CD1 3.37Å; L170-R186 HydrophobicContact CD1-CB 4.4Å; L170-R186 HydrophobicContact CD2-CB 3.96Å; L170-R186 HydrophobicContact CG-CB 4.49Å; L170-A190 HydrophobicContact CD1-CB 3.95Å
171	N	93.3	Very high	93.8	Very high	67 Å²	67	70.9 Å²	70.9	36%	0.358	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.4	-177.1	-78.4	-20.2	0	0	0	114	L165 E166 E173 Q174	L165-N171 WeakPolarHBondContact CB-OD1 3.42Å; L165-N171 PolarHBondContact O-N 2.88Å; E166-N171 WeakPolarHBondContact CA-ND2 3.12Å; E166-N171 PolarHBondContact N-OD1 3.15Å; N171-E173 VanDerWaalsContact C-N 3.35Å; N171-Q174 WeakPolarHBondContact O-CG 3.37Å; N171-Q174 PolarHBondContact O-NE2 2.85Å
172	K	93.4	Very high	93.5	Very high	201 Å²	201	73.2 Å²	73.2	87%	0.874	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-25.5	177.1	-65.1	-176.9	-179.9	179.5	0	112.4	L170	L170-K172 VanDerWaalsContact C-N 3.28Å; L170-K172 PolarHBondContact O-N 2.88Å
173	E	93.5	Very high	93.4	Very high	49 Å²	49	70.5 Å²	70.5	23%	0.229	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-0.6	-172.6	-60.8	165.7	137.5	0	0	112.7	L170 N171 N175 I176 L183 R186	L170-E173 CarbonylContact O-C 3.58Å; L170-E173 PolarHBondContact O-N 3.28Å; N171-E173 VanDerWaalsContact C-N 3.35Å; E173-N175 PolarHBondContact O-N 2.87Å; E173-N175 VanDerWaalsContact O-N 3.1Å; E173-I176 HydrophobicContact CB-CD1 4.24Å; E173-I176 HydrophobicContact CG-CD1 4.22Å; E173-I176 WeakPolarHBondContact O-CA 3.26Å; E173-I176 VanDerWaalsContact O-CB 3.3Å; E173-I176 WeakPolarHBondContact O-CB 3.38Å; E173-I176 PolarHBondContact O-N 2.69Å; E173-L183 HydrophobicContact CB-CD1 3.91Å; E173-L183 HydrophobicContact CB-CD2 4.32Å; E173-L183 HydrophobicContact CG-CD1 4.39Å; E173-L183 WeakPolarHBondContact OE2-CD1 3.42Å; E173-R186 IonicContact OE1-NH2 2.99Å; E173-R186 PolarHBondContact OE1-NH2 3.03Å; E173-R186 IonicContact OE2-CZ 2.67Å; E173-R186 VanDerWaalsContact OE2-CZ 3.32Å; E173-R186 IonicContact OE2-NH1 3.26Å; E173-R186 PolarHBondContact OE2-NH1 3.01Å; E173-R186 IonicContact OE2-NH2 3.38Å; E173-R186 PolarHBondContact OE2-NH2 2.95Å; E173-R186 VanDerWaalsContact OE2-NH2 3.09Å
174	Q	94.7	Very high	93.3	Very high	43 Å²	43	71.2 Å²	71.2	20%	0.201	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-34	-173.2	66.2	179.6	-62.7	0	0	113.6	T135 V136 R137 L165 L170 N171	T135-Q174 WeakPolarHBondContact CB-O 3.36Å; V136-Q174 PolarHBondContact N-O 3.36Å; R137-Q174 HydrophobicContact CB-CB 4.4Å; R137-Q174 VanDerWaalsContact CB-O 3.32Å; R137-Q174 WeakPolarHBondContact CB-O 3.49Å; R137-Q174 PolarHBondContact N-O 3.07Å; L165-Q174 HydrophobicContact CD1-CB 4.08Å; L165-Q174 HydrophobicContact CD2-CB 4.19Å; L170-Q174 PolarHBondContact O-N 3.39Å; N171-Q174 WeakPolarHBondContact O-CG 3.37Å; N171-Q174 PolarHBondContact O-NE2 2.85Å
175	N	94.9	Very high	93.3	Very high	114 Å²	114	70.9 Å²	70.9	61%	0.61	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	7.1	-179.3	-63.2	-32.6	0	0	0	112.3	T135 E173	T135-N175 VanDerWaalsContact CG2-O 3.26Å; T135-N175 WeakPolarHBondContact CG2-O 3.4Å; E173-N175 PolarHBondContact O-N 2.87Å; E173-N175 VanDerWaalsContact O-N 3.1Å
176	I	94.5	Very high	93.2	Very high	87 Å²	87	71.7 Å²	71.7	45%	0.446	33%	0.33	S	S	.	.	S	Bend	trans	-95.2	147.7	179.6	-55.4	-177.5	0	0	0	108.7	T135 V136 E173 L183	T135-I176 CarbonylContact C-O 3.55Å; T135-I176 VanDerWaalsContact CA-O 3.3Å; T135-I176 WeakPolarHBondContact CA-O 3.45Å; V136-I176 WeakPolarHBondContact CG2-O 3.48Å; V136-I176 PolarHBondContact N-O 2.95Å; E173-I176 HydrophobicContact CB-CD1 4.24Å; E173-I176 HydrophobicContact CG-CD1 4.22Å; E173-I176 WeakPolarHBondContact O-CA 3.26Å; E173-I176 VanDerWaalsContact O-CB 3.3Å; E173-I176 WeakPolarHBondContact O-CB 3.38Å; E173-I176 PolarHBondContact O-N 2.69Å; I176-L183 HydrophobicContact CG2-CD2 4.32Å
177	K	93.8	Very high	93.3	Very high	64 Å²	64	65.7 Å²	65.7	28%	0.278	30%	0.302	S	S	.	.			trans	-79	129.2	172.1	-59.1	-176.7	-176.5	-161.8	0	109.4	T133 V134 R179	T133-K177 VanDerWaalsContact O-CD 3.31Å; T133-K177 WeakPolarHBondContact O-CD 3.09Å; T133-K177 WeakPolarHBondContact O-CE 3.37Å; T133-K177 PolarHBondContact O-NZ 2.87Å; V134-K177 WeakPolarHBondContact O-CA 3.26Å; K177-R179 PolarHBondContact O-N 3.06Å
178	P	93.4	Very high	93.5	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.006	30%	0.295	C	S	.	.			trans	-73.5	88.8	-173.9	29.9	-33.7	0	0	0	111.1	V130 V134 V136 L183 R184	V130-P178 HydrophobicContact CG1-CG 3.71Å; V134-P178 VanDerWaalsContact O-CD 3.25Å; V134-P178 WeakPolarHBondContact O-CD 3.5Å; V136-P178 HydrophobicContact CG2-CB 4.26Å; P178-L183 HydrophobicContact CB-CD2 4.38Å; P178-L183 HydrophobicContact CB-CG 4.01Å; P178-R184 HydrophobicContact CB-CG 3.9Å; P178-R184 WeakPolarHBondContact O-CG 3.44Å
179	R	90.1	Very high	93.7	Very high	208 Å²	208	64.1 Å²	64.1	79%	0.785	29%	0.294	S	S	*	.			trans	-95.4	-35.2	-178.6	-68.6	-176.6	178.4	-175.9	-0.5	113.6	K177	K177-R179 PolarHBondContact O-N 3.06Å
180	S	92.2	Very high	93.9	Very high	60 Å²	60	58.8 Å²	58.8	42%	0.42	27%	0.269	S	S	.	.	S	Bend	trans	-76.1	151	176.6	63.4	0	0	0	0	110.8	E182 L183 R184	S180-E182 VanDerWaalsContact C-N 3.29Å; S180-E182 PolarHBondContact O-N 3.25Å; S180-L183 PolarHBondContact O-N 3.16Å; S180-L183 WeakPolarHBondContact OG-CB 3.42Å; S180-L183 PolarHBondContact OG-N 3.15Å; S180-R184 WeakPolarHBondContact O-CB 3.23Å; S180-R184 VanDerWaalsContact O-CG 3.32Å; S180-R184 WeakPolarHBondContact O-CG 3.19Å; S180-R184 PolarHBondContact O-N 3.27Å
181	K	90.2	Very high	94	Very high	163 Å²	163	59.2 Å²	59.2	71%	0.709	27%	0.271	S	S	*	.	H	α-helix	trans	-56.9	-45.9	175.8	-70.5	-173.6	177.8	-177.1	0	111.1	L183 R184 K185	K181-L183 PolarHBondContact O-N 3.29Å; K181-R184 WeakPolarHBondContact O-CB 3.45Å; K181-R184 PolarHBondContact O-N 3.45Å; K181-K185 PolarHBondContact O-N 3.04Å
182	E	91.8	Very high	94.1	Very high	53 Å²	53	56.1 Å²	56.1	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-48.2	179.8	-166.1	-151.7	121.7	0	0	112.8	S180 R184 K185 R186 L209 T213	S180-E182 VanDerWaalsContact C-N 3.29Å; S180-E182 PolarHBondContact O-N 3.25Å; E182-R184 VanDerWaalsContact C-N 3.3Å; E182-R184 PolarHBondContact O-N 3.21Å; E182-K185 PolarHBondContact O-N 2.65Å; E182-R186 PolarHBondContact O-N 2.97Å; E182-R186 IonicContact OE1-CZ 3.96Å; E182-R186 IonicContact OE1-NE 3.7Å; E182-R186 PolarHBondContact OE1-NE 3.12Å; E182-R186 IonicContact OE1-NH2 2.72Å; E182-R186 PolarHBondContact OE1-NH2 3.37Å; E182-L209 HydrophobicContact CB-CD2 4.05Å; E182-L209 HydrophobicContact CG-CD2 3.42Å; E182-L209 VanDerWaalsContact CG-CD2 3.42Å; E182-T213 HydrophobicContact CG-CG2 4.14Å; E182-T213 PolarHBondContact OE1-OG1 3.16Å
183	L	94	Very high	94.1	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-35.2	179.1	-174.2	55.8	0	0	0	111.4	V136 L170 E173 I176 P178 S180 K181 T187	V136-L183 HydrophobicContact CG2-CD1 4Å; V136-L183 HydrophobicContact CG2-CD2 4.29Å; V136-L183 HydrophobicContact CG2-CG 4.13Å; L170-L183 HydrophobicContact CD2-CD1 3.37Å; E173-L183 HydrophobicContact CB-CD1 3.91Å; E173-L183 HydrophobicContact CB-CD2 4.32Å; E173-L183 HydrophobicContact CG-CD1 4.39Å; E173-L183 WeakPolarHBondContact OE2-CD1 3.42Å; I176-L183 HydrophobicContact CG2-CD2 4.32Å; P178-L183 HydrophobicContact CB-CD2 4.38Å; P178-L183 HydrophobicContact CB-CG 4.01Å; S180-L183 PolarHBondContact O-N 3.16Å; S180-L183 WeakPolarHBondContact OG-CB 3.42Å; S180-L183 PolarHBondContact OG-N 3.15Å; K181-L183 PolarHBondContact O-N 3.29Å; L183-T187 VanDerWaalsContact O-CB 3.27Å; L183-T187 WeakPolarHBondContact O-CB 3.28Å; L183-T187 PolarHBondContact O-N 2.98Å; L183-T187 PolarHBondContact O-OG1 3Å
184	R	94.8	Very high	94.2	Very high	94 Å²	94	44.4 Å²	44.4	36%	0.355	20%	0.203	S	C	.	.	H	α-helix	trans	-63.6	-46.6	173	-74.7	175.8	63.6	-179.2	-0.8	111.6	D128 P178 S180 K181 E182 T187 S188	D128-R184 HydrophobicContact CB-CB 3.93Å; D128-R184 PolarHBondContact O-NH2 2.94Å; P178-R184 HydrophobicContact CB-CG 3.9Å; P178-R184 WeakPolarHBondContact O-CG 3.44Å; S180-R184 WeakPolarHBondContact O-CB 3.23Å; S180-R184 VanDerWaalsContact O-CG 3.32Å; S180-R184 WeakPolarHBondContact O-CG 3.19Å; S180-R184 PolarHBondContact O-N 3.27Å; K181-R184 WeakPolarHBondContact O-CB 3.45Å; K181-R184 PolarHBondContact O-N 3.45Å; E182-R184 VanDerWaalsContact C-N 3.3Å; E182-R184 PolarHBondContact O-N 3.21Å; R184-T187 PolarHBondContact O-N 3.31Å; R184-S188 WeakPolarHBondContact O-CB 3.32Å; R184-S188 PolarHBondContact O-N 2.89Å
185	K	94.4	Very high	94	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-61.7	-48.3	177.6	-179.3	69.8	76.1	171.9	0	111.8	Q126 D128 K181 E182 T187 S188 I189 D204 L209	Q126-K185 PolarHBondContact O-NZ 3.3Å; D128-K185 VanDerWaalsContact OD1-CA 3.28Å; D128-K185 WeakPolarHBondContact OD1-CA 3.47Å; D128-K185 WeakPolarHBondContact OD1-CD 3.21Å; D128-K185 WeakPolarHBondContact OD1-CE 3.49Å; D128-K185 IonicContact OD1-NZ 3.09Å; D128-K185 PolarHBondContact OD2-N 3.17Å; K181-K185 PolarHBondContact O-N 3.04Å; E182-K185 PolarHBondContact O-N 2.65Å; K185-T187 VanDerWaalsContact C-N 3.31Å; K185-T187 PolarHBondContact O-N 2.81Å; K185-S188 WeakPolarHBondContact O-CB 3.38Å; K185-S188 PolarHBondContact O-N 2.82Å; K185-I189 HydrophobicContact CD-CD1 4.35Å; K185-I189 HydrophobicContact CG-CD1 4.23Å; K185-I189 WeakPolarHBondContact O-CG1 3.28Å; K185-I189 PolarHBondContact O-N 3.23Å; K185-D204 PolarHBondContact NZ-O 2.9Å; K185-L209 HydrophobicContact CB-CD2 4.02Å; K185-L209 HydrophobicContact CG-CD1 4.25Å; K185-L209 HydrophobicContact CG-CD2 4.03Å; K185-L209 HydrophobicContact CG-CG 4.26Å
186	R	94.3	Very high	93.8	Very high	18 Å²	18	41.3 Å²	41.3	7%	0.068	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-40.7	174.8	-71	-167.8	-86.1	137.1	4.4	112.1	L170 E173 E182 A190 T213	L170-R186 HydrophobicContact CD1-CB 4.4Å; L170-R186 HydrophobicContact CD2-CB 3.96Å; L170-R186 HydrophobicContact CG-CB 4.49Å; E173-R186 IonicContact OE1-NH2 2.99Å; E173-R186 PolarHBondContact OE1-NH2 3.03Å; E173-R186 IonicContact OE2-CZ 2.67Å; E173-R186 VanDerWaalsContact OE2-CZ 3.32Å; E173-R186 IonicContact OE2-NH1 3.26Å; E173-R186 PolarHBondContact OE2-NH1 3.01Å; E173-R186 IonicContact OE2-NH2 3.38Å; E173-R186 PolarHBondContact OE2-NH2 2.95Å; E173-R186 VanDerWaalsContact OE2-NH2 3.09Å; E182-R186 PolarHBondContact O-N 2.97Å; E182-R186 IonicContact OE1-CZ 3.96Å; E182-R186 IonicContact OE1-NE 3.7Å; E182-R186 PolarHBondContact OE1-NE 3.12Å; E182-R186 IonicContact OE1-NH2 2.72Å; E182-R186 PolarHBondContact OE1-NH2 3.37Å; R186-A190 VanDerWaalsContact O-CB 3.28Å; R186-A190 WeakPolarHBondContact O-CB 3.42Å; R186-A190 PolarHBondContact O-N 3.48Å; R186-T213 HydrophobicContact CG-CG2 4.06Å
187	T	96.3	Very high	93.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.6	-40.2	176.1	-55.3	0	0	0	0	112.1	V130 V136 N139 L140 L183 R184 K185 A190 M191	V130-T187 HydrophobicContact CG1-CG2 3.66Å; V130-T187 HydrophobicContact CG2-CG2 4.43Å; V136-T187 HydrophobicContact CG1-CG2 4.1Å; V136-T187 WeakPolarHBondContact CG2-OG1 3.45Å; N139-T187 HydrophobicContact CB-CG2 4.04Å; L140-T187 HydrophobicContact CD1-CG2 4.06Å; L183-T187 VanDerWaalsContact O-CB 3.27Å; L183-T187 WeakPolarHBondContact O-CB 3.28Å; L183-T187 PolarHBondContact O-N 2.98Å; L183-T187 PolarHBondContact O-OG1 3Å; R184-T187 PolarHBondContact O-N 3.31Å; K185-T187 VanDerWaalsContact C-N 3.31Å; K185-T187 PolarHBondContact O-N 2.81Å; T187-A190 WeakPolarHBondContact O-CB 3.5Å; T187-A190 PolarHBondContact O-N 2.93Å; T187-M191 WeakPolarHBondContact O-CG 3.3Å; T187-M191 PolarHBondContact O-N 3.26Å
188	S	95.8	Very high	93.6	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-58.2	-49.9	176.4	-167.7	0	0	0	0	111.2	D128 R184 K185 A190 M191	D128-S188 WeakPolarHBondContact OD1-CB 3.43Å; R184-S188 WeakPolarHBondContact O-CB 3.32Å; R184-S188 PolarHBondContact O-N 2.89Å; K185-S188 WeakPolarHBondContact O-CB 3.38Å; K185-S188 PolarHBondContact O-N 2.82Å; S188-A190 PolarHBondContact O-N 2.81Å; S188-M191 PolarHBondContact O-N 3.49Å
189	I	95.5	Very high	93.7	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-45.7	175.5	-62.1	169.4	0	0	0	110.4	V124 L168 K185 M191 E192 L193 L202 P205 V217	V124-I189 HydrophobicContact CG1-CG1 4.04Å; V124-I189 HydrophobicContact CG2-CG1 4.4Å; L168-I189 HydrophobicContact CD1-CB 4.44Å; L168-I189 HydrophobicContact CD1-CG2 4.2Å; K185-I189 HydrophobicContact CD-CD1 4.35Å; K185-I189 HydrophobicContact CG-CD1 4.23Å; K185-I189 WeakPolarHBondContact O-CG1 3.28Å; K185-I189 PolarHBondContact O-N 3.23Å; I189-M191 VanDerWaalsContact C-N 3.31Å; I189-M191 PolarHBondContact O-N 2.98Å; I189-E192 PolarHBondContact O-N 3.1Å; I189-E192 VanDerWaalsContact O-N 3.12Å; I189-L193 HydrophobicContact CG2-CD1 3.86Å; I189-L193 HydrophobicContact CG2-CG 4.07Å; I189-L193 WeakPolarHBondContact O-CG 3.32Å; I189-L193 PolarHBondContact O-N 2.95Å; I189-L202 HydrophobicContact CD1-CD2 4.5Å; I189-L202 HydrophobicContact CG1-CD2 4.21Å; I189-L202 HydrophobicContact CG2-CD2 4.44Å; I189-P205 HydrophobicContact CD1-CB 4.26Å; I189-V217 HydrophobicContact CD1-CG1 3.72Å; I189-V217 HydrophobicContact CD1-CG2 4.45Å
190	A	96.1	Very high	94.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.6	-42.6	179.8	0	0	0	0	0	112.7	L140 V164 L168 L170 R186 T187 S188 E192 L193 V194	L140-A190 HydrophobicContact CD1-CB 3.86Å; L140-A190 HydrophobicContact CD2-CB 4.07Å; L140-A190 HydrophobicContact CG-CB 4.14Å; V164-A190 HydrophobicContact CG1-CB 3.68Å; L168-A190 HydrophobicContact CD1-CB 3.56Å; L170-A190 HydrophobicContact CD1-CB 3.95Å; R186-A190 VanDerWaalsContact O-CB 3.28Å; R186-A190 WeakPolarHBondContact O-CB 3.42Å; R186-A190 PolarHBondContact O-N 3.48Å; T187-A190 WeakPolarHBondContact O-CB 3.5Å; T187-A190 PolarHBondContact O-N 2.93Å; S188-A190 PolarHBondContact O-N 2.81Å; A190-E192 VanDerWaalsContact C-N 3.26Å; A190-E192 PolarHBondContact O-N 3.41Å; A190-L193 PolarHBondContact O-N 3.21Å; A190-L193 VanDerWaalsContact O-N 3.17Å; A190-V194 WeakPolarHBondContact O-CG2 3.49Å; A190-V194 PolarHBondContact O-N 3.3Å
191	M	96.4	Very high	94.3	Very high	9 Å²	9	23.4 Å²	23.4	4%	0.044	11%	0.106	C	C	.	.	H	α-helix	trans	-60.9	-32.8	178.9	-72.2	-171.3	-54.8	0	0	113.4	V130 N139 L140 S143 T187 S188 I189	V130-M191 HydrophobicContact CG2-CE 3.84Å; N139-M191 HydrophobicContact CB-CG 4.36Å; N139-M191 HydrophobicContact CB-SD 3.81Å; L140-M191 HydrophobicContact CD1-CG 4.26Å; S143-M191 PolarHBondContact OG-O 3.25Å; T187-M191 WeakPolarHBondContact O-CG 3.3Å; T187-M191 PolarHBondContact O-N 3.26Å; S188-M191 PolarHBondContact O-N 3.49Å; I189-M191 VanDerWaalsContact C-N 3.31Å; I189-M191 PolarHBondContact O-N 2.98Å
192	E	95.2	Very high	94.7	Very high	3 Å²	3	15.6 Å²	15.6	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-83.7	-24.4	176.6	-65.8	-57.1	125.6	0	0	113.1	G122 Y123 V124 R147 I189 A190 T195 H197 L200	G122-E192 WeakPolarHBondContact CA-OE2 3.5Å; Y123-E192 PolarHBondContact N-OE2 2.88Å; V124-E192 HydrophobicContact CG2-CB 3.92Å; V124-E192 HydrophobicContact CG2-CG 3.6Å; R147-E192 IonicContact CZ-OE1 3.94Å; R147-E192 IonicContact CZ-OE2 3.32Å; R147-E192 IonicContact NH1-OE1 3.07Å; R147-E192 PolarHBondContact NH1-OE1 2.81Å; R147-E192 IonicContact NH1-OE2 3.69Å; R147-E192 PolarHBondContact NH1-OE2 2.89Å; R147-E192 IonicContact NH2-OE1 3.36Å; R147-E192 IonicContact NH2-OE2 2.74Å; R147-E192 PolarHBondContact NH2-OE2 3.48Å; I189-E192 PolarHBondContact O-N 3.1Å; I189-E192 VanDerWaalsContact O-N 3.12Å; A190-E192 VanDerWaalsContact C-N 3.26Å; A190-E192 PolarHBondContact O-N 3.41Å; E192-T195 PolarHBondContact O-OG1 3.19Å; E192-H197 PolarHBondContact O-ND1 3.37Å; E192-H197 IonicContact OE2-CE1 3.27Å; E192-L200 HydrophobicContact CB-CD1 3.94Å
193	L	94.5	Very high	94.8	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.016	6%	0.063	C	C	.	.	H	α-helix	trans	-77.1	-31.4	178.5	-70.1	-176.8	0	0	0	113.1	V164 L168 I189 A190 T195 E196 L200 V220 M224	V164-L193 HydrophobicContact CG1-CB 4.12Å; V164-L193 HydrophobicContact CG2-CB 4.12Å; L168-L193 HydrophobicContact CD1-CD1 4Å; L168-L193 HydrophobicContact CG-CD1 4.45Å; I189-L193 HydrophobicContact CG2-CD1 3.86Å; I189-L193 HydrophobicContact CG2-CG 4.07Å; I189-L193 WeakPolarHBondContact O-CG 3.32Å; I189-L193 PolarHBondContact O-N 2.95Å; A190-L193 PolarHBondContact O-N 3.21Å; A190-L193 VanDerWaalsContact O-N 3.17Å; L193-T195 PolarHBondContact O-N 3.46Å; L193-E196 PolarHBondContact O-N 3.33Å; L193-L200 HydrophobicContact CD2-CD2 3.71Å; L193-V220 HydrophobicContact CD1-CG1 3.98Å; L193-M224 HydrophobicContact CD2-CE 3.91Å
194	V	94.7	Very high	94.8	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.006	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.6	-177.9	173.1	0	0	0	0	112.9	L140 A144 L148 I161 V164 A190	L140-V194 HydrophobicContact CD2-CG2 4.14Å; L140-V194 HydrophobicContact CG-CG2 4.22Å; A144-V194 HydrophobicContact CB-CG1 3.66Å; L148-V194 HydrophobicContact CD1-CG1 4.3Å; I161-V194 HydrophobicContact CG1-CG1 4.04Å; I161-V194 HydrophobicContact CG1-CG2 4.34Å; V164-V194 HydrophobicContact CB-CG2 3.95Å; V164-V194 HydrophobicContact CG1-CG2 4.09Å; V164-V194 HydrophobicContact CG2-CG2 3.8Å; A190-V194 WeakPolarHBondContact O-CG2 3.49Å; A190-V194 PolarHBondContact O-N 3.3Å
195	T	91.3	Very high	94.8	Very high	18 Å²	18	9.7 Å²	9.7	11%	0.11	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-12.2	-178.7	49.2	0	0	0	0	113.9	R147 E192 L193 H197	R147-T195 HydrophobicContact CB-CG2 3.37Å; R147-T195 HydrophobicContact CG-CG2 4.31Å; E192-T195 PolarHBondContact O-OG1 3.19Å; L193-T195 PolarHBondContact O-N 3.46Å; T195-H197 PolarHBondContact O-N 3.34Å; T195-H197 PolarHBondContact OG1-CE1 3.34Å; T195-H197 PolarHBondContact OG1-ND1 2.96Å; T195-H197 PolarHBondContact OG1-NE2 3.09Å
196	E	90.4	Very high	94.6	Very high	73 Å²	73	10.6 Å²	10.6	34%	0.341	6%	0.055	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	40.3	173.3	-60.9	-164.2	127.2	0	0	116.4	R160 L193 R229	R160-E196 IonicContact CZ-OE2 3.77Å; R160-E196 IonicContact NH1-OE2 3.9Å; R160-E196 PolarHBondContact NH1-OE2 3.24Å; R160-E196 IonicContact NH2-OE2 3.61Å; L193-E196 PolarHBondContact O-N 3.33Å; E196-R229 VanDerWaalsContact CG-NH2 3.27Å; E196-R229 IonicContact OE1-NH2 2.76Å; E196-R229 PolarHBondContact OE1-NH2 3.41Å
197	H	91.8	Very high	94.2	Very high	12 Å²	12	12.7 Å²	12.7	6%	0.056	7%	0.07	C	C	.	.			trans	-59.9	143.9	178.9	-48.9	103.2	0	0	0	112.7	G122 R147 E192 T195 I199	G122-H197 VanDerWaalsContact CA-CE1 3.48Å; G122-H197 WeakPolarHBondContact CA-CE1 3.34Å; G122-H197 VanDerWaalsContact CA-ND1 3.28Å; G122-H197 WeakPolarHBondContact CA-ND1 3.35Å; G122-H197 VanDerWaalsContact N-CG 3.28Å; G122-H197 PolarHBondContact N-ND1 2.98Å; R147-H197 VanDerWaalsContact CZ-CE1 3.46Å; R147-H197 PolarHBondContact NH2-CE1 3.48Å; R147-H197 PolarHBondContact NH2-NE2 3.11Å; R147-H197 VanDerWaalsContact NH2-NE2 3.15Å; E192-H197 PolarHBondContact O-ND1 3.37Å; E192-H197 IonicContact OE2-CE1 3.27Å; T195-H197 PolarHBondContact O-N 3.34Å; T195-H197 PolarHBondContact OG1-CE1 3.34Å; T195-H197 PolarHBondContact OG1-ND1 2.96Å; T195-H197 PolarHBondContact OG1-NE2 3.09Å; H197-I199 WeakPolarHBondContact CB-O 3.34Å
198	P	92.8	Very high	93.5	Very high	23 Å²	23	15.2 Å²	15.2	15%	0.149	10%	0.096	C	C	.	.	S	Bend	trans	-70.7	-31.6	174.7	26	-32.5	0	0	0	112.8	L31 A35 T120 T230	L31-P198 HydrophobicContact CB-CG 4.13Å; L31-P198 HydrophobicContact CD2-CB 4.44Å; L31-P198 HydrophobicContact CD2-CG 3.28Å; L31-P198 HydrophobicContact CG-CG 4.29Å; L31-P198 VanDerWaalsContact O-CB 3.31Å; L31-P198 WeakPolarHBondContact O-CB 3.48Å; A35-P198 HydrophobicContact CB-CB 4.19Å; T120-P198 WeakPolarHBondContact O-CD 3.1Å; P198-T230 PolarHBondContact O-N 2.77Å
199	I	95.9	Very high	93.2	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.3	172.4	-51.6	-178.2	0	0	0	109.1	A35 L37 I108 F117 S121 G122 H197 F201 T230 I232	A35-I199 HydrophobicContact CB-CD1 4.04Å; A35-I199 HydrophobicContact CB-CG1 3.76Å; L37-I199 HydrophobicContact CB-CD1 4.43Å; L37-I199 HydrophobicContact CD1-CD1 4.33Å; I108-I199 HydrophobicContact CD1-CD1 4.24Å; I108-I199 HydrophobicContact CG1-CD1 4.24Å; I108-I199 HydrophobicContact CG2-CD1 4.07Å; F117-I199 HydrophobicContact CE2-CD1 4.22Å; S121-I199 WeakPolarHBondContact CA-O 3.39Å; G122-I199 PolarHBondContact N-O 3.23Å; H197-I199 WeakPolarHBondContact CB-O 3.34Å; I199-F201 HydrophobicContact CB-CE2 4.46Å; I199-F201 HydrophobicContact CG2-CD2 4.17Å; I199-F201 HydrophobicContact CG2-CE1 4.32Å; I199-F201 HydrophobicContact CG2-CE2 3.5Å; I199-F201 VanDerWaalsContact CG2-CE2 3.5Å; I199-F201 HydrophobicContact CG2-CZ 3.59Å; I199-T230 WeakPolarHBondContact CA-O 3.14Å; I199-I232 HydrophobicContact CG2-CD1 4.2Å
200	L	97	Very high	92.9	Very high	8 Å²	8	20 Å²	20	4%	0.042	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.3	177.8	178.8	65	0	0	0	110.3	V124 E192 L193 L202 L221 T230 I231 I232	V124-L200 HydrophobicContact CG2-CD1 4.46Å; E192-L200 HydrophobicContact CB-CD1 3.94Å; L193-L200 HydrophobicContact CD2-CD2 3.71Å; L200-L202 HydrophobicContact CD2-CD1 3.91Å; L200-L202 HydrophobicContact CD2-CG 4.42Å; L200-L202 HydrophobicContact CG-CD1 3.76Å; L200-L202 HydrophobicContact CG-CG 4.22Å; L200-L221 HydrophobicContact CD2-CD2 4.08Å; L200-T230 PolarHBondContact N-O 2.77Å; L200-I231 HydrophobicContact CB-CG1 4.49Å; L200-I231 WeakPolarHBondContact O-CA 3.35Å; L200-I232 PolarHBondContact O-N 2.71Å
201	F	97.9	Very high	92.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.4	173.9	-59.7	-85.9	0	0	0	110.3	L37 L90 L93 A94 F117 G122 Y123 V124 I199 I232	L37-F201 HydrophobicContact CD1-CE1 4.16Å; L37-F201 HydrophobicContact CD1-CZ 3.68Å; L90-F201 HydrophobicContact CD1-CB 4.31Å; L90-F201 HydrophobicContact CD1-CD1 3.81Å; L90-F201 HydrophobicContact CG-CB 4.49Å; L90-F201 HydrophobicContact CG-CD1 4.43Å; L93-F201 HydrophobicContact CB-CE1 3.82Å; L93-F201 HydrophobicContact CB-CZ 4.4Å; A94-F201 HydrophobicContact CB-CB 4.29Å; A94-F201 HydrophobicContact CB-CD1 4.08Å; A94-F201 HydrophobicContact CB-CD2 3.68Å; A94-F201 HydrophobicContact CB-CE1 4.3Å; A94-F201 HydrophobicContact CB-CE2 3.94Å; A94-F201 HydrophobicContact CB-CG 3.75Å; A94-F201 HydrophobicContact CB-CZ 4.24Å; F117-F201 HydrophobicContact CE1-CE2 4.25Å; F117-F201 AromaticContact CZ-CE2 3.76Å; F117-F201 HydrophobicContact CZ-CE2 3.76Å; F117-F201 HydrophobicContact CZ-CZ 4.02Å; G122-F201 WeakPolarHBondContact O-CD2 3.45Å; G122-F201 PolarHBondContact O-N 3Å; Y123-F201 CarbonylContact C-O 3.52Å; Y123-F201 WeakPolarHBondContact CA-O 3.38Å; Y123-F201 HydrophobicContact CD2-CB 3.6Å; Y123-F201 HydrophobicContact CD2-CG 4.37Å; Y123-F201 HydrophobicContact CE2-CB 4.32Å; Y123-F201 HydrophobicContact CG-CB 4.41Å; V124-F201 PolarHBondContact N-O 3.46Å; I199-F201 HydrophobicContact CB-CE2 4.46Å; I199-F201 HydrophobicContact CG2-CD2 4.17Å; I199-F201 HydrophobicContact CG2-CE1 4.32Å; I199-F201 HydrophobicContact CG2-CE2 3.5Å; I199-F201 VanDerWaalsContact CG2-CE2 3.5Å; I199-F201 HydrophobicContact CG2-CZ 3.59Å; F201-I232 CarbonylContact C-O 3.58Å; F201-I232 WeakPolarHBondContact CA-O 3.5Å; F201-I232 HydrophobicContact CD1-CB 3.88Å; F201-I232 HydrophobicContact CD1-CD1 4.05Å; F201-I232 HydrophobicContact CD1-CG2 4.22Å; F201-I232 HydrophobicContact CE1-CB 4.18Å; F201-I232 HydrophobicContact CE1-CD1 3.45Å; F201-I232 VanDerWaalsContact CE1-CD1 3.45Å; F201-I232 HydrophobicContact CE1-CG1 4.37Å; F201-I232 HydrophobicContact CE1-CG2 4.47Å; F201-I232 HydrophobicContact CZ-CD1 4.07Å
202	L	97.4	Very high	92	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	119.6	173	-50	93.7	0	0	0	111.3	L90 V124 I189 L200 D204 P205 L221 I231 I232 F233 S234	L90-L202 WeakPolarHBondContact CD2-O 2.93Å; V124-L202 HydrophobicContact CB-CB 4.22Å; V124-L202 HydrophobicContact CB-CD2 4.26Å; V124-L202 HydrophobicContact CB-CG 4.15Å; V124-L202 HydrophobicContact CG2-CD2 3.99Å; V124-L202 HydrophobicContact CG2-CG 4.08Å; I189-L202 HydrophobicContact CD1-CD2 4.5Å; I189-L202 HydrophobicContact CG1-CD2 4.21Å; I189-L202 HydrophobicContact CG2-CD2 4.44Å; L200-L202 HydrophobicContact CD2-CD1 3.91Å; L200-L202 HydrophobicContact CD2-CG 4.42Å; L200-L202 HydrophobicContact CG-CD1 3.76Å; L200-L202 HydrophobicContact CG-CG 4.22Å; L202-D204 PolarHBondContact O-N 2.58Å; L202-P205 HydrophobicContact CB-CB 3.97Å; L202-P205 HydrophobicContact CB-CG 3.95Å; L202-P205 HydrophobicContact CD2-CB 3.85Å; L202-P205 HydrophobicContact CD2-CG 4.38Å; L202-L221 HydrophobicContact CD1-CD1 4.2Å; L202-L221 HydrophobicContact CD1-CD2 4.18Å; L202-L221 HydrophobicContact CD2-CD1 4.05Å; L202-L221 HydrophobicContact CD2-CD2 4.01Å; L202-I231 HydrophobicContact CD1-CG2 3.54Å; L202-I232 PolarHBondContact N-O 3Å; L202-F233 HydrophobicContact CB-CB 3.87Å; L202-F233 HydrophobicContact CD1-CB 4.11Å; L202-F233 CarbonylContact O-C 3.57Å; L202-F233 WeakPolarHBondContact O-CA 3.48Å; L202-F233 VanDerWaalsContact O-CB 3.26Å; L202-F233 WeakPolarHBondContact O-CB 3.4Å; L202-S234 PolarHBondContact O-N 2.7Å
203	D	95.3	Very high	91.7	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.053	18%	0.177	C	C	.	.	S	Bend	trans	-88.4	107.8	175.1	-164.3	17.6	0	0	0	109.5	S87 L90 V124 Q126 S234	S87-D203 WeakPolarHBondContact CB-OD1 3.5Å; S87-D203 PolarHBondContact OG-OD1 3.46Å; S87-D203 PolarHBondContact OG-OD2 2.68Å; L90-D203 HydrophobicContact CD2-CB 3.65Å; V124-D203 PolarHBondContact O-N 2.81Å; Q126-D203 VanDerWaalsContact CA-O 3.26Å; Q126-D203 WeakPolarHBondContact CA-O 3.43Å; Q126-D203 HydrophobicContact CB-CB 4.22Å; D203-S234 WeakPolarHBondContact CA-OG 3.28Å; D203-S234 PolarHBondContact OD1-OG 3.35Å
204	D	93.2	Very high	91.6	Very high	20 Å²	20	33.2 Å²	33.2	11%	0.107	18%	0.179	C	C	.	.	S	Bend	trans	45.5	68.5	-179.4	-155.4	12.4	0	0	0	112.5	Q126 K185 L202 T206 T207 S234	Q126-D204 HydrophobicContact CG-CB 4.26Å; K185-D204 PolarHBondContact NZ-O 2.9Å; L202-D204 PolarHBondContact O-N 2.58Å; D204-T206 PolarHBondContact O-N 3.32Å; D204-T206 PolarHBondContact OD1-OG1 2.88Å; D204-T207 VanDerWaalsContact CB-OG1 3.28Å; D204-T207 WeakPolarHBondContact CB-OG1 3.32Å; D204-T207 PolarHBondContact O-N 2.85Å; D204-T207 PolarHBondContact O-OG1 2.86Å; D204-T207 PolarHBondContact OD1-OG1 3.08Å; D204-T207 PolarHBondContact OD2-OG1 3.08Å; D204-S234 WeakPolarHBondContact CA-O 3.39Å; D204-S234 PolarHBondContact N-O 2.99Å; D204-S234 PolarHBondContact N-OG 2.85Å
205	P	93.8	Very high	91.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.9	-175.7	28.3	-33.1	0	0	0	113.1	I189 L202 L209 F233 S234	I189-P205 HydrophobicContact CD1-CB 4.26Å; L202-P205 HydrophobicContact CB-CB 3.97Å; L202-P205 HydrophobicContact CB-CG 3.95Å; L202-P205 HydrophobicContact CD2-CB 3.85Å; L202-P205 HydrophobicContact CD2-CG 4.38Å; P205-L209 WeakPolarHBondContact O-CD1 3.26Å; P205-F233 HydrophobicContact CG-CB 4.24Å; P205-F233 HydrophobicContact CG-CD2 4.3Å; P205-S234 VanDerWaalsContact CD-O 3.24Å; P205-S234 WeakPolarHBondContact CD-O 3.37Å
206	T	90.8	Very high	91.4	Very high	20 Å²	20	35.9 Å²	35.9	12%	0.123	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-10	-175.1	58.3	0	0	0	0	113.3	D204 G208 L209 T214 I218 I235	D204-T206 PolarHBondContact O-N 3.32Å; D204-T206 PolarHBondContact OD1-OG1 2.88Å; T206-G208 PolarHBondContact O-N 3.01Å; T206-L209 PolarHBondContact O-N 3.39Å; T206-T214 HydrophobicContact CG2-CG2 3.47Å; T206-T214 VanDerWaalsContact CG2-CG2 3.47Å; T206-I218 HydrophobicContact CG2-CD1 4.17Å; T206-I218 HydrophobicContact CG2-CG1 4.42Å; T206-I235 HydrophobicContact CG2-CD1 3.69Å; T206-I235 HydrophobicContact CG2-CG1 4.41Å
207	T	86.6	Confident	91.5	Very high	63 Å²	63	32.5 Å²	32.5	39%	0.387	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	129.9	-178.8	-23.3	0	0	0	0	111.5	D204 L209	D204-T207 VanDerWaalsContact CB-OG1 3.28Å; D204-T207 WeakPolarHBondContact CB-OG1 3.32Å; D204-T207 PolarHBondContact O-N 2.85Å; D204-T207 PolarHBondContact O-OG1 2.86Å; D204-T207 PolarHBondContact OD1-OG1 3.08Å; D204-T207 PolarHBondContact OD2-OG1 3.08Å; T207-L209 PolarHBondContact O-N 3.23Å
208	G	81.9	Confident	91.6	Very high	52 Å²	52	32 Å²	32	54%	0.536	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	13.3	175.2	0	0	0	0	0	114.7	T206	T206-G208 PolarHBondContact O-N 3.01Å
209	L	87.9	Confident	91.6	Very high	23 Å²	23	34.3 Å²	34.3	12%	0.12	19%	0.187	C	C	.	.			trans	-97.5	150.7	169.8	-58.8	-174.2	0	0	0	110.4	E182 K185 P205 T206 T207 T213 T214 V217	E182-L209 HydrophobicContact CB-CD2 4.05Å; E182-L209 HydrophobicContact CG-CD2 3.42Å; E182-L209 VanDerWaalsContact CG-CD2 3.42Å; K185-L209 HydrophobicContact CB-CD2 4.02Å; K185-L209 HydrophobicContact CG-CD1 4.25Å; K185-L209 HydrophobicContact CG-CD2 4.03Å; K185-L209 HydrophobicContact CG-CG 4.26Å; P205-L209 WeakPolarHBondContact O-CD1 3.26Å; T206-L209 PolarHBondContact O-N 3.39Å; T207-L209 PolarHBondContact O-N 3.23Å; L209-T213 HydrophobicContact CD1-CG2 4.39Å; L209-T213 HydrophobicContact CD2-CG2 4.25Å; L209-T214 WeakPolarHBondContact CB-OG1 3.11Å; L209-V217 HydrophobicContact CD1-CG2 4.05Å
210	D	89.2	Confident	91.5	Very high	81 Å²	81	34.8 Å²	34.8	43%	0.433	19%	0.189	S	C	.	.			trans	-73.8	167.3	166.4	76.8	-14.9	0	0	0	110.6	R212 T213 T214	D210-R212 VanDerWaalsContact C-N 3.29Å; D210-R212 PolarHBondContact O-N 3.43Å; D210-T213 PolarHBondContact O-N 3.31Å; D210-T213 WeakPolarHBondContact OD1-CA 3.19Å; D210-T213 WeakPolarHBondContact OD1-CB 3.4Å; D210-T213 PolarHBondContact OD1-N 2.87Å; D210-T213 PolarHBondContact OD1-OG1 3.01Å; D210-T214 VanDerWaalsContact O-CB 3.26Å; D210-T214 WeakPolarHBondContact O-CB 3.45Å; D210-T214 PolarHBondContact O-N 3.04Å; D210-T214 PolarHBondContact O-OG1 3.23Å
211	L	86.3	Confident	91.4	Very high	87 Å²	87	34.4 Å²	34.4	46%	0.455	19%	0.187	S	C	.	.	H	α-helix	trans	-62.3	-37.5	-175.2	179.2	57.9	0	0	0	112.9	T215 Q239	L211-T215 PolarHBondContact O-N 2.81Å; L211-T215 PolarHBondContact O-OG1 3.47Å; L211-Q239 HydrophobicContact CD1-CG 4.33Å
212	R	88.5	Confident	91.3	Very high	181 Å²	181	37.9 Å²	37.9	68%	0.683	20%	0.201	S	C	*	.	H	α-helix	trans	-66.5	-51.7	-178.9	-176.7	167.3	-179.7	-89.8	-8.4	110.7	D210 T214 T215 D216	D210-R212 VanDerWaalsContact C-N 3.29Å; D210-R212 PolarHBondContact O-N 3.43Å; R212-T214 VanDerWaalsContact C-N 3.3Å; R212-T214 PolarHBondContact O-N 3.14Å; R212-T215 WeakPolarHBondContact O-CB 3.47Å; R212-T215 PolarHBondContact O-N 2.91Å; R212-T215 VanDerWaalsContact O-N 3.16Å; R212-D216 PolarHBondContact O-N 3.49Å
213	T	89	Confident	91	Very high	14 Å²	14	45.5 Å²	45.5	9%	0.086	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-37	178.6	-52.7	0	0	0	0	111.4	E182 R186 L209 D210 T215 D216 V217	E182-T213 HydrophobicContact CG-CG2 4.14Å; E182-T213 PolarHBondContact OE1-OG1 3.16Å; R186-T213 HydrophobicContact CG-CG2 4.06Å; L209-T213 HydrophobicContact CD1-CG2 4.39Å; L209-T213 HydrophobicContact CD2-CG2 4.25Å; D210-T213 PolarHBondContact O-N 3.31Å; D210-T213 WeakPolarHBondContact OD1-CA 3.19Å; D210-T213 WeakPolarHBondContact OD1-CB 3.4Å; D210-T213 PolarHBondContact OD1-N 2.87Å; D210-T213 PolarHBondContact OD1-OG1 3.01Å; T213-T215 VanDerWaalsContact C-N 3.33Å; T213-T215 PolarHBondContact O-N 2.94Å; T213-D216 PolarHBondContact O-N 2.82Å; T213-V217 HydrophobicContact CG2-CG2 4.41Å; T213-V217 WeakPolarHBondContact O-CB 3.3Å; T213-V217 VanDerWaalsContact O-CG2 3.32Å; T213-V217 WeakPolarHBondContact O-CG2 3.33Å; T213-V217 PolarHBondContact O-N 3.25Å
214	T	91.3	Very high	90.8	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.067	23%	0.229	C	C	.	.	H	α-helix	trans	-57.1	-48.4	173.2	-60.9	0	0	0	0	111.2	T206 L209 D210 R212 D216 V217 I218 I242	T206-T214 HydrophobicContact CG2-CG2 3.47Å; T206-T214 VanDerWaalsContact CG2-CG2 3.47Å; L209-T214 WeakPolarHBondContact CB-OG1 3.11Å; D210-T214 VanDerWaalsContact O-CB 3.26Å; D210-T214 WeakPolarHBondContact O-CB 3.45Å; D210-T214 PolarHBondContact O-N 3.04Å; D210-T214 PolarHBondContact O-OG1 3.23Å; R212-T214 VanDerWaalsContact C-N 3.3Å; R212-T214 PolarHBondContact O-N 3.14Å; T214-D216 VanDerWaalsContact C-N 3.35Å; T214-D216 PolarHBondContact O-N 3.34Å; T214-V217 PolarHBondContact O-N 3.05Å; T214-I218 WeakPolarHBondContact O-CG1 3.32Å; T214-I218 PolarHBondContact O-N 2.78Å; T214-I242 HydrophobicContact CG2-CD1 3.46Å; T214-I242 VanDerWaalsContact CG2-CD1 3.46Å
215	T	91.2	Very high	90.8	Very high	36 Å²	36	44.9 Å²	44.9	22%	0.221	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-44.9	178.8	-56.6	0	0	0	0	110.9	L211 R212 T213 V217 I218 L219	L211-T215 PolarHBondContact O-N 2.81Å; L211-T215 PolarHBondContact O-OG1 3.47Å; R212-T215 WeakPolarHBondContact O-CB 3.47Å; R212-T215 PolarHBondContact O-N 2.91Å; R212-T215 VanDerWaalsContact O-N 3.16Å; T213-T215 VanDerWaalsContact C-N 3.33Å; T213-T215 PolarHBondContact O-N 2.94Å; T215-V217 PolarHBondContact O-N 3.29Å; T215-I218 PolarHBondContact O-N 3.5Å; T215-L219 HydrophobicContact CG2-CD1 4.03Å; T215-L219 HydrophobicContact CG2-CG 4.37Å; T215-L219 WeakPolarHBondContact O-CB 3.11Å; T215-L219 VanDerWaalsContact O-CG 3.26Å; T215-L219 WeakPolarHBondContact O-CG 3.3Å; T215-L219 PolarHBondContact O-N 3Å
216	D	90.4	Very high	90.8	Very high	39 Å²	39	52.3 Å²	52.3	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-46.2	178.1	-68.2	-19.2	0	0	0	111.4	H169 R212 T213 T214 I218 L219 V220	H169-D216 IonicContact CD2-OD2 2.95Å; H169-D216 IonicContact NE2-OD2 3.69Å; R212-D216 PolarHBondContact O-N 3.49Å; T213-D216 PolarHBondContact O-N 2.82Å; T214-D216 VanDerWaalsContact C-N 3.35Å; T214-D216 PolarHBondContact O-N 3.34Å; D216-I218 PolarHBondContact O-N 2.89Å; D216-L219 PolarHBondContact O-N 3.03Å; D216-V220 WeakPolarHBondContact O-CG2 3.42Å; D216-V220 PolarHBondContact O-N 3.26Å
217	V	93.1	Very high	90.8	Very high	2 Å²	2	58 Å²	58	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-47.7	176.7	168.3	0	0	0	0	111.3	L168 I189 L209 T213 T214 T215 L219 V220 L221	L168-V217 HydrophobicContact CD2-CG2 4.31Å; I189-V217 HydrophobicContact CD1-CG1 3.72Å; I189-V217 HydrophobicContact CD1-CG2 4.45Å; L209-V217 HydrophobicContact CD1-CG2 4.05Å; T213-V217 HydrophobicContact CG2-CG2 4.41Å; T213-V217 WeakPolarHBondContact O-CB 3.3Å; T213-V217 VanDerWaalsContact O-CG2 3.32Å; T213-V217 WeakPolarHBondContact O-CG2 3.33Å; T213-V217 PolarHBondContact O-N 3.25Å; T214-V217 PolarHBondContact O-N 3.05Å; T215-V217 PolarHBondContact O-N 3.29Å; V217-L219 VanDerWaalsContact C-N 3.33Å; V217-L219 PolarHBondContact O-N 3.37Å; V217-V220 WeakPolarHBondContact O-CB 3.43Å; V217-V220 PolarHBondContact O-N 3.44Å; V217-L221 HydrophobicContact CG1-CD1 4.41Å; V217-L221 WeakPolarHBondContact O-CG 3.26Å; V217-L221 PolarHBondContact O-N 3.16Å
218	I	94.6	Very high	91	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-38.9	178.6	-64.6	-65.7	0	0	0	111.3	T206 T214 T215 D216 V220 L221 R222 F233 I242 F245	T206-I218 HydrophobicContact CG2-CD1 4.17Å; T206-I218 HydrophobicContact CG2-CG1 4.42Å; T214-I218 WeakPolarHBondContact O-CG1 3.32Å; T214-I218 PolarHBondContact O-N 2.78Å; T215-I218 PolarHBondContact O-N 3.5Å; D216-I218 PolarHBondContact O-N 2.89Å; I218-V220 VanDerWaalsContact C-N 3.3Å; I218-V220 PolarHBondContact O-N 3.33Å; I218-L221 HydrophobicContact CD1-CD1 4.34Å; I218-L221 PolarHBondContact O-N 3.26Å; I218-R222 WeakPolarHBondContact O-CB 3.47Å; I218-R222 PolarHBondContact O-N 3.46Å; I218-F233 HydrophobicContact CD1-CE2 4.38Å; I218-I242 HydrophobicContact CD1-CG2 4.27Å; I218-I242 HydrophobicContact CG1-CG1 4.45Å; I218-I242 HydrophobicContact CG1-CG2 3.95Å; I218-I242 HydrophobicContact CG2-CG2 4.22Å; I218-F245 HydrophobicContact CG2-CB 4.42Å; I218-F245 HydrophobicContact CG2-CD2 3.88Å
219	L	93.3	Very high	91.6	Very high	73 Å²	73	55 Å²	55	38%	0.382	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-37.1	175.7	-74.1	173.4	0	0	0	112.1	T215 D216 V217 R222 R223 F245	T215-L219 HydrophobicContact CG2-CD1 4.03Å; T215-L219 HydrophobicContact CG2-CG 4.37Å; T215-L219 WeakPolarHBondContact O-CB 3.11Å; T215-L219 VanDerWaalsContact O-CG 3.26Å; T215-L219 WeakPolarHBondContact O-CG 3.3Å; T215-L219 PolarHBondContact O-N 3Å; D216-L219 PolarHBondContact O-N 3.03Å; V217-L219 VanDerWaalsContact C-N 3.33Å; V217-L219 PolarHBondContact O-N 3.37Å; L219-R222 PolarHBondContact O-N 3.21Å; L219-R223 WeakPolarHBondContact O-CB 3.44Å; L219-R223 PolarHBondContact O-N 2.94Å; L219-F245 HydrophobicContact CD2-CE2 3.85Å; L219-F245 HydrophobicContact CD2-CZ 3.8Å
220	V	93.4	Very high	92	Very high	10 Å²	10	53.9 Å²	53.9	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-49.8	172.6	166.1	0	0	0	0	110.8	L167 L168 L193 D216 V217 I218 R222 R223 M224	L167-V220 HydrophobicContact CD1-CG1 4.24Å; L167-V220 HydrophobicContact CD1-CG2 3.85Å; L167-V220 HydrophobicContact CD2-CG1 3.53Å; L167-V220 HydrophobicContact CG-CB 4.21Å; L167-V220 HydrophobicContact CG-CG1 3.57Å; L167-V220 HydrophobicContact CG-CG2 3.67Å; L167-V220 WeakPolarHBondContact O-CG2 3.17Å; L168-V220 HydrophobicContact CD2-CB 4.4Å; L168-V220 HydrophobicContact CD2-CG1 4.15Å; L168-V220 HydrophobicContact CD2-CG2 4.28Å; L193-V220 HydrophobicContact CD1-CG1 3.98Å; D216-V220 WeakPolarHBondContact O-CG2 3.42Å; D216-V220 PolarHBondContact O-N 3.26Å; V217-V220 WeakPolarHBondContact O-CB 3.43Å; V217-V220 PolarHBondContact O-N 3.44Å; I218-V220 VanDerWaalsContact C-N 3.3Å; I218-V220 PolarHBondContact O-N 3.33Å; V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 3.24Å; V220-R223 PolarHBondContact O-N 2.92Å; V220-R223 VanDerWaalsContact O-N 3.14Å; V220-M224 WeakPolarHBondContact O-CG 3.25Å; V220-M224 PolarHBondContact O-N 2.97Å
221	L	95.1	Very high	92.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.7	-43.3	176.4	-63.6	178	0	0	0	110.8	L75 L200 L202 V217 I218 R223 M224 S225 I231	L75-L221 HydrophobicContact CD2-CB 3.9Å; L200-L221 HydrophobicContact CD2-CD2 4.08Å; L202-L221 HydrophobicContact CD1-CD1 4.2Å; L202-L221 HydrophobicContact CD1-CD2 4.18Å; L202-L221 HydrophobicContact CD2-CD1 4.05Å; L202-L221 HydrophobicContact CD2-CD2 4.01Å; V217-L221 HydrophobicContact CG1-CD1 4.41Å; V217-L221 WeakPolarHBondContact O-CG 3.26Å; V217-L221 PolarHBondContact O-N 3.16Å; I218-L221 HydrophobicContact CD1-CD1 4.34Å; I218-L221 PolarHBondContact O-N 3.26Å; L221-R223 VanDerWaalsContact C-N 3.33Å; L221-R223 PolarHBondContact O-N 2.7Å; L221-M224 CarbonylContact O-C 3.56Å; L221-M224 WeakPolarHBondContact O-CA 3.45Å; L221-M224 WeakPolarHBondContact O-CB 3.41Å; L221-M224 PolarHBondContact O-N 3.17Å; L221-M224 VanDerWaalsContact O-N 3.07Å; L221-S225 PolarHBondContact O-N 3.31Å; L221-I231 HydrophobicContact CB-CD1 4.02Å; L221-I231 HydrophobicContact CD2-CD1 4.25Å; L221-I231 HydrophobicContact CD2-CG2 4.35Å; L221-I231 WeakPolarHBondContact O-CD1 3.19Å
222	R	94.6	Very high	93	Very high	73 Å²	73	46 Å²	46	28%	0.275	21%	0.206	S	C	.	.	H	α-helix	trans	-59.2	-42.1	175.2	-168.4	172.5	-165.9	-157	2.3	113.1	L75 I218 L219 V220 M224 S225 K226 F245	L75-R222 VanDerWaalsContact CD1-CA 3.47Å; L75-R222 HydrophobicContact CD1-CB 3.53Å; L75-R222 HydrophobicContact CD1-CG 3.73Å; I218-R222 WeakPolarHBondContact O-CB 3.47Å; I218-R222 PolarHBondContact O-N 3.46Å; L219-R222 PolarHBondContact O-N 3.21Å; V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 3.24Å; R222-M224 PolarHBondContact O-N 2.79Å; R222-S225 PolarHBondContact O-N 3.39Å; R222-S225 PolarHBondContact O-OG 3.45Å; R222-K226 WeakPolarHBondContact O-CG 3.41Å; R222-K226 PolarHBondContact O-N 2.79Å; R222-K226 VanDerWaalsContact O-N 3.14Å; R222-F245 VanDerWaalsContact CZ-CD1 3.41Å
223	R	92.3	Very high	93.4	Very high	160 Å²	160	37.3 Å²	37.3	60%	0.604	17%	0.174	S	C	*	.	H	α-helix	trans	-65.5	-34.2	177.6	-170.3	-178.5	-73.6	168.8	-4.1	110.9	L219 V220 L221	L219-R223 WeakPolarHBondContact O-CB 3.44Å; L219-R223 PolarHBondContact O-N 2.94Å; V220-R223 PolarHBondContact O-N 2.92Å; V220-R223 VanDerWaalsContact O-N 3.14Å; L221-R223 VanDerWaalsContact C-N 3.33Å; L221-R223 PolarHBondContact O-N 2.7Å
224	M	90.3	Very high	93.8	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.049	17%	0.171	C	C	.	.	H	α-helix	trans	-73.7	-39.7	176.9	-66.5	-65.8	-104.2	0	0	112.2	L193 V220 L221 R222 K226 K227 I231	L193-M224 HydrophobicContact CD2-CE 3.91Å; V220-M224 WeakPolarHBondContact O-CG 3.25Å; V220-M224 PolarHBondContact O-N 2.97Å; L221-M224 CarbonylContact O-C 3.56Å; L221-M224 WeakPolarHBondContact O-CA 3.45Å; L221-M224 WeakPolarHBondContact O-CB 3.41Å; L221-M224 PolarHBondContact O-N 3.17Å; L221-M224 VanDerWaalsContact O-N 3.07Å; R222-M224 PolarHBondContact O-N 2.79Å; M224-K226 VanDerWaalsContact C-N 3.33Å; M224-K226 PolarHBondContact O-N 2.86Å; M224-K227 WeakPolarHBondContact O-CB 3.14Å; M224-K227 PolarHBondContact O-N 3.21Å; M224-K227 VanDerWaalsContact O-N 3.1Å; M224-K227 HydrophobicContact SD-CD 4.46Å; M224-I231 HydrophobicContact CB-CD1 3.93Å
225	S	93.4	Very high	93.9	Very high	7 Å²	7	36.3 Å²	36.3	5%	0.049	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-39.6	176.7	69.1	0	0	0	0	111.8	G74 L221 R222 K227 G228 R229	G74-S225 VanDerWaalsContact C-CB 3.49Å; L221-S225 PolarHBondContact O-N 3.31Å; R222-S225 PolarHBondContact O-N 3.39Å; R222-S225 PolarHBondContact O-OG 3.45Å; S225-K227 PolarHBondContact O-N 3.07Å; S225-G228 PolarHBondContact O-N 3.36Å; S225-R229 WeakPolarHBondContact CA-O 3.48Å; S225-R229 PolarHBondContact O-N 2.69Å
226	K	92.8	Very high	93.7	Very high	157 Å²	157	36.4 Å²	36.4	68%	0.683	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-14.4	173.4	-75.2	-173.5	176.2	-164.5	0	115	R222 M224	R222-K226 WeakPolarHBondContact O-CG 3.41Å; R222-K226 PolarHBondContact O-N 2.79Å; R222-K226 VanDerWaalsContact O-N 3.14Å; M224-K226 VanDerWaalsContact C-N 3.33Å; M224-K226 PolarHBondContact O-N 2.86Å
227	K	90.8	Very high	93.5	Very high	140 Å²	140	39.7 Å²	39.7	61%	0.609	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	16.8	171.9	-62.9	-179.7	176.9	-177.5	0	112.7	M224 S225	M224-K227 WeakPolarHBondContact O-CB 3.14Å; M224-K227 PolarHBondContact O-N 3.21Å; M224-K227 VanDerWaalsContact O-N 3.1Å; M224-K227 HydrophobicContact SD-CD 4.46Å; S225-K227 PolarHBondContact O-N 3.07Å
228	G	92	Very high	93.5	Very high	22 Å²	22	39.8 Å²	39.8	23%	0.227	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	19.5	-179.9	0	0	0	0	0	114.4	S225	S225-G228 PolarHBondContact O-N 3.36Å
229	R	94	Very high	93.3	Very high	29 Å²	29	44.2 Å²	44.2	11%	0.109	20%	0.202	C	C	.	.			trans	-95.5	144.4	179.6	-60.8	-173.1	-175.9	-172.7	10.4	112	G74 E196 S225	G74-R229 PolarHBondContact N-O 3.39Å; E196-R229 VanDerWaalsContact CG-NH2 3.27Å; E196-R229 IonicContact OE1-NH2 2.76Å; E196-R229 PolarHBondContact OE1-NH2 3.41Å; S225-R229 WeakPolarHBondContact CA-O 3.48Å; S225-R229 PolarHBondContact O-N 2.69Å
230	T	97.1	Very high	93.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	107.4	175.5	-59.9	0	0	0	0	109	A35 M71 P73 P198 I199 L200 I232	A35-T230 WeakPolarHBondContact O-CB 3.44Å; A35-T230 PolarHBondContact O-OG1 3.02Å; M71-T230 HydrophobicContact CB-CG2 4.43Å; P73-T230 VanDerWaalsContact CA-OG1 3.25Å; P73-T230 WeakPolarHBondContact CA-OG1 3.19Å; P198-T230 PolarHBondContact O-N 2.77Å; I199-T230 WeakPolarHBondContact CA-O 3.14Å; L200-T230 PolarHBondContact N-O 2.77Å; T230-I232 HydrophobicContact CG2-CD1 4.07Å; T230-I232 HydrophobicContact CG2-CG1 4.05Å
231	I	97.6	Very high	93.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.5	179.5	-56	-177.8	0	0	0	107.7	G74 L75 N76 L200 L202 L221 M224 F233	G74-I231 PolarHBondContact O-N 3.22Å; L75-I231 HydrophobicContact CD2-CG2 4.36Å; N76-I231 WeakPolarHBondContact CB-O 3.41Å; N76-I231 PolarHBondContact N-O 3.47Å; N76-I231 PolarHBondContact ND2-O 3.37Å; N76-I231 VanDerWaalsContact ND2-O 3.12Å; L200-I231 HydrophobicContact CB-CG1 4.49Å; L200-I231 WeakPolarHBondContact O-CA 3.35Å; L202-I231 HydrophobicContact CD1-CG2 3.54Å; L221-I231 HydrophobicContact CB-CD1 4.02Å; L221-I231 HydrophobicContact CD2-CD1 4.25Å; L221-I231 HydrophobicContact CD2-CG2 4.35Å; L221-I231 WeakPolarHBondContact O-CD1 3.19Å; M224-I231 HydrophobicContact CB-CD1 3.93Å; I231-F233 HydrophobicContact CG2-CD1 4.12Å
232	I	98.3	Very high	93	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.9	-177.8	-55	165.1	0	0	0	107.1	L37 M71 N76 I78 L90 I199 L200 F201 L202 T230	L37-I232 HydrophobicContact CB-CD1 4.48Å; L37-I232 HydrophobicContact CD1-CD1 4.05Å; L37-I232 HydrophobicContact CD2-CD1 4.41Å; M71-I232 HydrophobicContact CB-CD1 4.09Å; M71-I232 HydrophobicContact CB-CG1 4.24Å; M71-I232 HydrophobicContact CE-CG2 3.95Å; M71-I232 HydrophobicContact CG-CD1 4.44Å; M71-I232 HydrophobicContact CG-CG1 4.46Å; M71-I232 HydrophobicContact SD-CB 4.1Å; M71-I232 HydrophobicContact SD-CD1 3.49Å; M71-I232 WeakPolarHBondContact SD-CD1 3.39Å; M71-I232 HydrophobicContact SD-CG1 3.54Å; M71-I232 VanDerWaalsContact SD-CG1 3.54Å; M71-I232 HydrophobicContact SD-CG2 3.41Å; M71-I232 WeakPolarHBondContact SD-CG2 3.31Å; N76-I232 HydrophobicContact CB-CG1 4.19Å; N76-I232 WeakPolarHBondContact O-CA 3.34Å; I78-I232 HydrophobicContact CD1-CG2 3.98Å; I78-I232 HydrophobicContact CG1-CG2 4.4Å; L90-I232 HydrophobicContact CD1-CB 4.36Å; L90-I232 HydrophobicContact CD1-CG2 3.64Å; I199-I232 HydrophobicContact CG2-CD1 4.2Å; L200-I232 PolarHBondContact O-N 2.71Å; F201-I232 CarbonylContact C-O 3.58Å; F201-I232 WeakPolarHBondContact CA-O 3.5Å; F201-I232 HydrophobicContact CD1-CB 3.88Å; F201-I232 HydrophobicContact CD1-CD1 4.05Å; F201-I232 HydrophobicContact CD1-CG2 4.22Å; F201-I232 HydrophobicContact CE1-CB 4.18Å; F201-I232 HydrophobicContact CE1-CD1 3.45Å; F201-I232 VanDerWaalsContact CE1-CD1 3.45Å; F201-I232 HydrophobicContact CE1-CG1 4.37Å; F201-I232 HydrophobicContact CE1-CG2 4.47Å; F201-I232 HydrophobicContact CZ-CD1 4.07Å; L202-I232 PolarHBondContact N-O 3Å; T230-I232 HydrophobicContact CG2-CD1 4.07Å; T230-I232 HydrophobicContact CG2-CG1 4.05Å
233	F	97.6	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.8	-178.2	60	-77.5	0	0	0	112.2	L75 N76 A77 I78 L202 P205 I218 I231 I235 F246	L75-F233 HydrophobicContact CB-CE1 4.15Å; L75-F233 HydrophobicContact CD2-CD1 4.13Å; L75-F233 HydrophobicContact CD2-CE1 3.32Å; L75-F233 HydrophobicContact CD2-CZ 3.9Å; L75-F233 HydrophobicContact CG-CE1 4.35Å; N76-F233 WeakPolarHBondContact O-CD1 3.46Å; N76-F233 PolarHBondContact O-N 3.33Å; A77-F233 CarbonylContact C-O 3.59Å; A77-F233 WeakPolarHBondContact CA-O 3.38Å; A77-F233 HydrophobicContact CB-CE1 4.42Å; A77-F233 HydrophobicContact CB-CE2 4.06Å; A77-F233 HydrophobicContact CB-CZ 3.86Å; I78-F233 PolarHBondContact N-O 3.39Å; L202-F233 HydrophobicContact CB-CB 3.87Å; L202-F233 HydrophobicContact CD1-CB 4.11Å; L202-F233 CarbonylContact O-C 3.57Å; L202-F233 WeakPolarHBondContact O-CA 3.48Å; L202-F233 VanDerWaalsContact O-CB 3.26Å; L202-F233 WeakPolarHBondContact O-CB 3.4Å; P205-F233 HydrophobicContact CG-CB 4.24Å; P205-F233 HydrophobicContact CG-CD2 4.3Å; I218-F233 HydrophobicContact CD1-CE2 4.38Å; I231-F233 HydrophobicContact CG2-CD1 4.12Å; F233-I235 HydrophobicContact CD2-CB 4.12Å; F233-I235 HydrophobicContact CD2-CG2 4.44Å; F233-I235 HydrophobicContact CE2-CB 4.16Å; F233-I235 HydrophobicContact CE2-CD1 4.22Å; F233-I235 HydrophobicContact CE2-CG2 4.13Å; F233-F246 HydrophobicContact CE2-CD1 4.43Å; F233-F246 AromaticContact CE2-CE1 3.76Å; F233-F246 HydrophobicContact CE2-CE1 3.76Å; F233-F246 HydrophobicContact CE2-CZ 4.06Å; F233-F246 AromaticContact CZ-CD1 3.72Å; F233-F246 HydrophobicContact CZ-CD1 3.72Å; F233-F246 AromaticContact CZ-CE1 3.47Å; F233-F246 HydrophobicContact CZ-CE1 3.47Å; F233-F246 VanDerWaalsContact CZ-CE1 3.47Å; F233-F246 HydrophobicContact CZ-CZ 4.16Å
234	S	96.5	Very high	93	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	142.3	166.1	61	0	0	0	0	108.7	I78 L202 D203 D204 P205	I78-S234 WeakPolarHBondContact O-CA 3.39Å; L202-S234 PolarHBondContact O-N 2.7Å; D203-S234 WeakPolarHBondContact CA-OG 3.28Å; D203-S234 PolarHBondContact OD1-OG 3.35Å; D204-S234 WeakPolarHBondContact CA-O 3.39Å; D204-S234 PolarHBondContact N-O 2.99Å; D204-S234 PolarHBondContact N-OG 2.85Å; P205-S234 VanDerWaalsContact CD-O 3.24Å; P205-S234 WeakPolarHBondContact CD-O 3.37Å
235	I	93.9	Very high	93.2	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.206	C	C	.	.			trans	-144.2	143.3	174.5	-168.2	157.9	0	0	0	110.6	A77 I78 M79 R86 T206 F233 P238 I242 F246	A77-I235 HydrophobicContact CB-CG2 4.43Å; I78-I235 PolarHBondContact O-N 3.16Å; M79-I235 HydrophobicContact CG-CG2 3.62Å; M79-I235 HydrophobicContact SD-CG2 4.24Å; R86-I235 PolarHBondContact NH1-O 3.22Å; T206-I235 HydrophobicContact CG2-CD1 3.69Å; T206-I235 HydrophobicContact CG2-CG1 4.41Å; F233-I235 HydrophobicContact CD2-CB 4.12Å; F233-I235 HydrophobicContact CD2-CG2 4.44Å; F233-I235 HydrophobicContact CE2-CB 4.16Å; F233-I235 HydrophobicContact CE2-CD1 4.22Å; F233-I235 HydrophobicContact CE2-CG2 4.13Å; I235-P238 HydrophobicContact CD1-CB 3.81Å; I235-P238 HydrophobicContact CD1-CG 4.5Å; I235-P238 HydrophobicContact CG1-CB 4.15Å; I235-P238 HydrophobicContact CG1-CG 4.46Å; I235-P238 HydrophobicContact CG2-CG 4.12Å; I235-I242 HydrophobicContact CD1-CG2 4.14Å; I235-F246 HydrophobicContact CD1-CZ 4.29Å; I235-F246 HydrophobicContact CG2-CE2 4.26Å; I235-F246 HydrophobicContact CG2-CZ 4.05Å
236	N	87	Confident	93.3	Very high	37 Å²	37	43.8 Å²	43.8	20%	0.198	20%	0.204	C	C	.	.	S	Bend	trans	-105.8	124.9	175.5	-162.6	50.9	0	0	0	111.1	Q82 R86	Q82-N236 PolarHBondContact NE2-ND2 3.48Å; R86-N236 VanDerWaalsContact NH1-CA 3.31Å; R86-N236 PolarHBondContact NH1-OD1 3.46Å; R86-N236 PolarHBondContact NH2-OD1 2.84Å; R86-N236 VanDerWaalsContact NH2-OD1 3.12Å
237	Q	86.7	Confident	93.5	Very high	108 Å²	108	39.8 Å²	39.8	51%	0.505	19%	0.19	S	C	.	.	S	Bend	trans	43.2	59.5	172.4	-68.9	173.6	-39.6	0	0	114.2	L288	Q237-L288 HydrophobicContact CB-CD1 4.22Å; Q237-L288 HydrophobicContact CG-CD1 3.31Å
238	P	92.1	Very high	93.8	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.032	17%	0.166	C	C	.	.			trans	-68.1	142.6	179.1	27.9	-33.1	0	0	0	111.5	M79 I235 I242 F246 N282 A284	M79-P238 HydrophobicContact CE-CG 4.09Å; M79-P238 HydrophobicContact SD-CG 3.69Å; I235-P238 HydrophobicContact CD1-CB 3.81Å; I235-P238 HydrophobicContact CD1-CG 4.5Å; I235-P238 HydrophobicContact CG1-CB 4.15Å; I235-P238 HydrophobicContact CG1-CG 4.46Å; I235-P238 HydrophobicContact CG2-CG 4.12Å; P238-I242 HydrophobicContact CB-CB 4.29Å; P238-I242 HydrophobicContact CB-CG2 3.98Å; P238-F246 HydrophobicContact CB-CE2 4.46Å; P238-F246 HydrophobicContact CB-CZ 4.1Å; P238-F246 HydrophobicContact CG-CE2 3.93Å; P238-F246 HydrophobicContact CG-CZ 4.05Å; P238-N282 PolarHBondContact O-ND2 2.84Å; P238-A284 HydrophobicContact CG-CB 3.8Å; P238-A284 WeakPolarHBondContact O-CB 2.93Å
239	Q	90.9	Very high	94.1	Very high	92 Å²	92	32.7 Å²	32.7	43%	0.43	16%	0.155	S	C	.	.			trans	-62.7	153.7	168.3	-64.4	-169.7	-3.3	0	0	111.2	L211 S241 I242 F243	L211-Q239 HydrophobicContact CD1-CG 4.33Å; Q239-S241 PolarHBondContact O-N 3.47Å; Q239-S241 VanDerWaalsContact O-N 3.12Å; Q239-I242 WeakPolarHBondContact O-CA 3.45Å; Q239-I242 WeakPolarHBondContact O-CB 3.49Å; Q239-I242 PolarHBondContact O-N 2.86Å; Q239-F243 PolarHBondContact O-N 2.82Å
240	Y	91.3	Very high	94.3	Very high	138 Å²	138	31.3 Å²	31.3	54%	0.541	15%	0.15	S	C	.	.	H	α-helix	trans	-53.4	-36.2	177.3	178.5	-109.2	0	0	0	113.5	I242 F243 K244 N282 P283	Y240-I242 PolarHBondContact O-N 2.85Å; Y240-F243 HydrophobicContact CD2-CD1 4.46Å; Y240-F243 PolarHBondContact O-N 2.95Å; Y240-K244 PolarHBondContact O-N 2.94Å; Y240-K244 VanDerWaalsContact O-N 3.13Å; Y240-N282 PolarHBondContact N-OD1 3.03Å; Y240-P283 HydrophobicContact CD2-CG 4.06Å; Y240-P283 HydrophobicContact CE2-CG 4.24Å
241	S	90.3	Very high	94.3	Very high	39 Å²	39	31.3 Å²	31.3	27%	0.273	15%	0.15	S	C	.	.	H	α-helix	trans	-58.6	-28.3	176.9	57.8	0	0	0	0	113.5	Q239 K244 F245	Q239-S241 PolarHBondContact O-N 3.47Å; Q239-S241 VanDerWaalsContact O-N 3.12Å; S241-K244 VanDerWaalsContact O-CE 3.26Å; S241-K244 WeakPolarHBondContact O-CE 3.43Å; S241-K244 WeakPolarHBondContact O-CG 3.36Å; S241-F245 WeakPolarHBondContact O-CD2 3.27Å; S241-F245 WeakPolarHBondContact O-CE2 3.36Å
242	I	93.1	Very high	94.1	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-91.8	-46.1	176.3	-68.1	163.8	0	0	0	110	T214 I218 I235 P238 Q239 Y240 K244 F245 F246	T214-I242 HydrophobicContact CG2-CD1 3.46Å; T214-I242 VanDerWaalsContact CG2-CD1 3.46Å; I218-I242 HydrophobicContact CD1-CG2 4.27Å; I218-I242 HydrophobicContact CG1-CG1 4.45Å; I218-I242 HydrophobicContact CG1-CG2 3.95Å; I218-I242 HydrophobicContact CG2-CG2 4.22Å; I235-I242 HydrophobicContact CD1-CG2 4.14Å; P238-I242 HydrophobicContact CB-CB 4.29Å; P238-I242 HydrophobicContact CB-CG2 3.98Å; Q239-I242 WeakPolarHBondContact O-CA 3.45Å; Q239-I242 WeakPolarHBondContact O-CB 3.49Å; Q239-I242 PolarHBondContact O-N 2.86Å; Y240-I242 PolarHBondContact O-N 2.85Å; I242-K244 VanDerWaalsContact C-N 3.25Å; I242-K244 PolarHBondContact O-N 3.29Å; I242-F245 WeakPolarHBondContact O-CB 3.45Å; I242-F245 PolarHBondContact O-N 3.47Å; I242-F246 HydrophobicContact CG2-CE1 3.71Å; I242-F246 HydrophobicContact CG2-CZ 3.76Å
243	F	94.3	Very high	93.9	Very high	13 Å²	13	31.3 Å²	31.3	6%	0.057	15%	0.149	C	C	.	.	H	α-helix	trans	-53.1	-41.1	-177.6	176.7	-95.8	0	0	0	112.8	Q239 Y240 F245 F246 L249 A263 P283 A284 F287	Q239-F243 PolarHBondContact O-N 2.82Å; Y240-F243 HydrophobicContact CD2-CD1 4.46Å; Y240-F243 PolarHBondContact O-N 2.95Å; F243-F245 PolarHBondContact O-N 3.01Å; F243-F246 HydrophobicContact CB-CE2 4.4Å; F243-F246 AromaticContact CD2-CD2 3.72Å; F243-F246 HydrophobicContact CD2-CD2 3.72Å; F243-F246 AromaticContact CD2-CE2 3.83Å; F243-F246 HydrophobicContact CD2-CE2 3.83Å; F243-F246 HydrophobicContact CE2-CD2 4.17Å; F243-F246 HydrophobicContact CG-CD2 4.41Å; F243-F246 WeakPolarHBondContact O-CB 3.37Å; F243-F246 WeakPolarHBondContact O-CG 3.26Å; F243-F246 PolarHBondContact O-N 3.36Å; F243-L249 HydrophobicContact CE2-CD2 4.05Å; F243-L249 HydrophobicContact CZ-CD2 4.5Å; F243-A263 HydrophobicContact CZ-CB 4.38Å; F243-P283 HydrophobicContact CD1-CB 4.35Å; F243-P283 HydrophobicContact CD1-CG 4.48Å; F243-P283 HydrophobicContact CE1-CB 4.04Å; F243-P283 HydrophobicContact CE1-CG 4.42Å; F243-P283 HydrophobicContact CZ-CB 4.39Å; F243-A284 HydrophobicContact CD2-CB 4.11Å; F243-A284 HydrophobicContact CG-CB 4.5Å; F243-F287 HydrophobicContact CE2-CD2 4.43Å; F243-F287 AromaticContact CE2-CE2 3.89Å; F243-F287 HydrophobicContact CE2-CE2 3.89Å; F243-F287 AromaticContact CZ-CE2 3.7Å; F243-F287 HydrophobicContact CZ-CE2 3.7Å; F243-F287 HydrophobicContact CZ-CZ 4.47Å
244	K	93.3	Very high	93.5	Very high	106 Å²	106	33.1 Å²	33.1	46%	0.461	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-11.6	179.5	72.1	-178.1	-177.3	-178.9	0	115	Y240 S241 I242	Y240-K244 PolarHBondContact O-N 2.94Å; Y240-K244 VanDerWaalsContact O-N 3.13Å; S241-K244 VanDerWaalsContact O-CE 3.26Å; S241-K244 WeakPolarHBondContact O-CE 3.43Å; S241-K244 WeakPolarHBondContact O-CG 3.36Å; I242-K244 VanDerWaalsContact C-N 3.25Å; I242-K244 PolarHBondContact O-N 3.29Å
245	F	94.1	Very high	93.3	Very high	24 Å²	24	33.1 Å²	33.1	11%	0.105	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.5	178.8	-61.7	-40.4	0	0	0	113.8	L75 I218 L219 R222 S241 I242 F243	L75-F245 HydrophobicContact CD1-CB 4.39Å; L75-F245 WeakPolarHBondContact CD1-O 3.46Å; I218-F245 HydrophobicContact CG2-CB 4.42Å; I218-F245 HydrophobicContact CG2-CD2 3.88Å; L219-F245 HydrophobicContact CD2-CE2 3.85Å; L219-F245 HydrophobicContact CD2-CZ 3.8Å; R222-F245 VanDerWaalsContact CZ-CD1 3.41Å; S241-F245 WeakPolarHBondContact O-CD2 3.27Å; S241-F245 WeakPolarHBondContact O-CE2 3.36Å; I242-F245 WeakPolarHBondContact O-CB 3.45Å; I242-F245 PolarHBondContact O-N 3.47Å; F243-F245 PolarHBondContact O-N 3.01Å
246	F	96.2	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.			trans	-74.5	132.3	-179.6	-55.8	-15.3	0	0	0	109.9	A77 M79 F233 I235 P238 I242 F243 A263 Q264	A77-F246 HydrophobicContact CB-CB 4.38Å; A77-F246 HydrophobicContact CB-CD1 4.16Å; A77-F246 HydrophobicContact CB-CD2 3.5Å; A77-F246 VanDerWaalsContact CB-CD2 3.5Å; A77-F246 HydrophobicContact CB-CE1 4.34Å; A77-F246 HydrophobicContact CB-CE2 3.67Å; A77-F246 HydrophobicContact CB-CG 3.76Å; A77-F246 HydrophobicContact CB-CZ 4.1Å; M79-F246 HydrophobicContact SD-CE2 4.23Å; F233-F246 HydrophobicContact CE2-CD1 4.43Å; F233-F246 AromaticContact CE2-CE1 3.76Å; F233-F246 HydrophobicContact CE2-CE1 3.76Å; F233-F246 HydrophobicContact CE2-CZ 4.06Å; F233-F246 AromaticContact CZ-CD1 3.72Å; F233-F246 HydrophobicContact CZ-CD1 3.72Å; F233-F246 AromaticContact CZ-CE1 3.47Å; F233-F246 HydrophobicContact CZ-CE1 3.47Å; F233-F246 VanDerWaalsContact CZ-CE1 3.47Å; F233-F246 HydrophobicContact CZ-CZ 4.16Å; I235-F246 HydrophobicContact CD1-CZ 4.29Å; I235-F246 HydrophobicContact CG2-CE2 4.26Å; I235-F246 HydrophobicContact CG2-CZ 4.05Å; P238-F246 HydrophobicContact CB-CE2 4.46Å; P238-F246 HydrophobicContact CB-CZ 4.1Å; P238-F246 HydrophobicContact CG-CE2 3.93Å; P238-F246 HydrophobicContact CG-CZ 4.05Å; I242-F246 HydrophobicContact CG2-CE1 3.71Å; I242-F246 HydrophobicContact CG2-CZ 3.76Å; F243-F246 HydrophobicContact CB-CE2 4.4Å; F243-F246 AromaticContact CD2-CD2 3.72Å; F243-F246 HydrophobicContact CD2-CD2 3.72Å; F243-F246 AromaticContact CD2-CE2 3.83Å; F243-F246 HydrophobicContact CD2-CE2 3.83Å; F243-F246 HydrophobicContact CE2-CD2 4.17Å; F243-F246 HydrophobicContact CG-CD2 4.41Å; F243-F246 WeakPolarHBondContact O-CB 3.37Å; F243-F246 WeakPolarHBondContact O-CG 3.26Å; F243-F246 PolarHBondContact O-N 3.36Å; F246-A263 HydrophobicContact CB-CB 3.72Å; F246-A263 WeakPolarHBondContact O-CB 3.5Å; F246-Q264 PolarHBondContact O-NE2 3.21Å
247	D	96.9	Very high	93.8	Very high	73 Å²	73	34.9 Å²	34.9	39%	0.39	17%	0.169	S	C	.	.	S	Bend	trans	-86.3	-38.4	174.6	-59.5	-54.5	0	0	0	109.6	G74 L75 A263	G74-D247 VanDerWaalsContact CA-OD2 3.22Å; G74-D247 WeakPolarHBondContact CA-OD2 3.46Å; L75-D247 PolarHBondContact N-OD2 2.66Å; L75-D247 PolarHBondContact O-N 2.94Å; D247-A263 PolarHBondContact O-N 3.08Å
248	S	97.2	Very high	94.2	Very high	13 Å²	13	29.8 Å²	29.8	9%	0.091	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.4	174.4	177.6	0	0	0	0	111.6	L75 N76 A77 G261	L75-S248 PolarHBondContact O-N 3.39Å; N76-S248 WeakPolarHBondContact OD1-CB 3.47Å; A77-S248 PolarHBondContact N-O 3.18Å; S248-G261 WeakPolarHBondContact CA-O 3.47Å; S248-G261 PolarHBondContact OG-O 2.95Å
249	L	97.7	Very high	94.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.4	175.3	-177.9	68.9	0	0	0	110.1	A77 M79 F243 L251 F259 H260 G261 A263 A266 F287	A77-L249 HydrophobicContact CB-CD1 4.21Å; M79-L249 HydrophobicContact CB-CD1 4.08Å; M79-L249 HydrophobicContact CG-CD1 3.97Å; M79-L249 HydrophobicContact SD-CD1 3.67Å; F243-L249 HydrophobicContact CE2-CD2 4.05Å; F243-L249 HydrophobicContact CZ-CD2 4.5Å; L249-L251 HydrophobicContact CD2-CD1 4.11Å; L249-L251 HydrophobicContact CD2-CD2 4.36Å; L249-L251 HydrophobicContact CD2-CG 4.05Å; L249-L251 HydrophobicContact CG-CG 4.18Å; L249-F259 HydrophobicContact CB-CD1 4.49Å; L249-F259 HydrophobicContact CB-CE1 4.21Å; L249-F259 HydrophobicContact CD2-CD1 4.38Å; L249-F259 HydrophobicContact CD2-CE1 4.5Å; L249-F259 HydrophobicContact CG-CD1 4.49Å; L249-H260 WeakPolarHBondContact O-CA 3.33Å; L249-G261 PolarHBondContact N-O 3.47Å; L249-G261 PolarHBondContact O-N 2.93Å; L249-A263 HydrophobicContact CB-CB 3.92Å; L249-A266 HydrophobicContact CD2-CB 3.87Å; L249-F287 HydrophobicContact CD2-CD2 3.94Å; L249-F287 HydrophobicContact CD2-CE2 3.92Å
250	T	97.7	Very high	94.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.1	168.8	-52.1	0	0	0	0	108.6	A77 I78 M79 L89 V252 F259 H260	A77-T250 PolarHBondContact O-N 3.27Å; I78-T250 CarbonylContact C-O 3.57Å; I78-T250 WeakPolarHBondContact CA-O 3.42Å; M79-T250 PolarHBondContact N-O 3.16Å; L89-T250 HydrophobicContact CD2-CG2 4.49Å; T250-V252 HydrophobicContact CG2-CG2 3.84Å; T250-F259 CarbonylContact C-O 3.58Å; T250-F259 WeakPolarHBondContact CA-O 3.24Å; T250-H260 HydrophobicContact CG2-CB 4.29Å; T250-H260 PolarHBondContact OG1-ND1 3.01Å
251	L	96.9	Very high	94.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.9	175.2	-69.5	169	0	0	0	109.3	M79 L249 V257 M258 F259 F270 F287 I291	M79-L251 HydrophobicContact CB-CD2 3.54Å; M79-L251 CarbonylContact O-C 3.59Å; M79-L251 WeakPolarHBondContact O-CA 3.32Å; L249-L251 HydrophobicContact CD2-CD1 4.11Å; L249-L251 HydrophobicContact CD2-CD2 4.36Å; L249-L251 HydrophobicContact CD2-CG 4.05Å; L249-L251 HydrophobicContact CG-CG 4.18Å; L251-V257 CarbonylContact O-C 3.55Å; L251-V257 WeakPolarHBondContact O-CA 3.44Å; L251-M258 HydrophobicContact CB-CB 4.2Å; L251-M258 PolarHBondContact O-N 2.93Å; L251-F259 HydrophobicContact CB-CB 4.19Å; L251-F259 HydrophobicContact CD1-CB 4Å; L251-F259 HydrophobicContact CG-CB 4.41Å; L251-F259 PolarHBondContact N-O 3.36Å; L251-F270 HydrophobicContact CD1-CE2 3.52Å; L251-F270 HydrophobicContact CD1-CZ 3.73Å; L251-F287 HydrophobicContact CD1-CB 3.87Å; L251-F287 HydrophobicContact CD1-CD2 4.32Å; L251-F287 HydrophobicContact CD1-CG 4.06Å; L251-F287 HydrophobicContact CD2-CB 4.26Å; L251-I291 HydrophobicContact CB-CD1 3.77Å; L251-I291 HydrophobicContact CD1-CD1 3.99Å; L251-I291 HydrophobicContact CD2-CD1 3.91Å; L251-I291 HydrophobicContact CG-CD1 4.1Å
252	V	95.1	Very high	95.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133	-177.9	-172.5	0	0	0	0	109.2	I67 I78 M79 G80 P81 L89 T250 K256 V257	I67-V252 HydrophobicContact CD1-CG1 4.33Å; I78-V252 HydrophobicContact CG2-CG2 4.05Å; M79-V252 PolarHBondContact O-N 3.11Å; G80-V252 WeakPolarHBondContact CA-O 3.31Å; P81-V252 WeakPolarHBondContact CD-O 3.15Å; L89-V252 HydrophobicContact CD2-CG2 3.74Å; T250-V252 HydrophobicContact CG2-CG2 3.84Å; V252-K256 CarbonylContact C-O 3.5Å; V252-K256 VanDerWaalsContact CA-O 3.28Å; V252-K256 WeakPolarHBondContact CA-O 3.36Å; V252-K256 WeakPolarHBondContact CG1-O 3.43Å; V252-V257 HydrophobicContact CG2-CG2 4.47Å
253	A	92.9	Very high	95.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	143.8	172.9	0	0	0	0	0	110.4	P81 G255 K256 M258 I291 T322	P81-A253 HydrophobicContact CG-CB 3.81Å; A253-G255 PolarHBondContact O-N 3.26Å; A253-G255 VanDerWaalsContact O-N 3.08Å; A253-K256 PolarHBondContact N-O 3.25Å; A253-K256 PolarHBondContact O-N 2.8Å; A253-M258 HydrophobicContact CB-CE 4.29Å; A253-M258 HydrophobicContact CB-CG 4.34Å; A253-M258 WeakPolarHBondContact O-CE 3.5Å; A253-I291 HydrophobicContact CB-CG2 3.31Å; A253-T322 HydrophobicContact CB-CG2 3.61Å
254	S	90.6	Very high	95.3	Very high	39 Å²	39	24.2 Å²	24.2	27%	0.273	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	35	-178.1	-55.8	0	0	0	0	112.5	D83 K256 T322	D83-S254 PolarHBondContact OD2-N 3.36Å; S254-K256 VanDerWaalsContact C-N 3.29Å; S254-K256 PolarHBondContact O-N 3.17Å; S254-T322 PolarHBondContact OG-OG1 3.45Å
255	G	92.2	Very high	95.4	Very high	2 Å²	2	22.6 Å²	22.6	2%	0.021	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	13	-178.7	0	0	0	0	0	116	R63 L64 S65 A253	R63-G255 WeakPolarHBondContact O-CA 3.26Å; L64-G255 CarbonylContact C-O 3.41Å; L64-G255 WeakPolarHBondContact CA-O 3.21Å; S65-G255 PolarHBondContact N-O 2.85Å; S65-G255 PolarHBondContact OG-O 2.92Å; A253-G255 PolarHBondContact O-N 3.26Å; A253-G255 VanDerWaalsContact O-N 3.08Å
256	K	94.7	Very high	95.5	Very high	63 Å²	63	21.5 Å²	21.5	27%	0.274	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.4	-179.6	-70.4	176.3	-176.5	177.3	0	111.2	S65 V252 A253 S254 M258 A326	S65-K256 WeakPolarHBondContact OG-CE 3.17Å; S65-K256 WeakPolarHBondContact OG-CG 3.46Å; V252-K256 CarbonylContact C-O 3.5Å; V252-K256 VanDerWaalsContact CA-O 3.28Å; V252-K256 WeakPolarHBondContact CA-O 3.36Å; V252-K256 WeakPolarHBondContact CG1-O 3.43Å; A253-K256 PolarHBondContact N-O 3.25Å; A253-K256 PolarHBondContact O-N 2.8Å; S254-K256 VanDerWaalsContact C-N 3.29Å; S254-K256 PolarHBondContact O-N 3.17Å; K256-M258 HydrophobicContact CB-CE 3.52Å; K256-M258 WeakPolarHBondContact O-CE 3.26Å; K256-A326 HydrophobicContact CB-CB 4.03Å; K256-A326 HydrophobicContact CD-CB 3.99Å
257	V	95.5	Very high	95.3	Very high	13 Å²	13	23.1 Å²	23.1	8%	0.079	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	127	174.2	177	0	0	0	0	110	I67 L251 V252 F259 H260 Y329	I67-V257 HydrophobicContact CB-CG2 4.16Å; I67-V257 HydrophobicContact CD1-CG2 4.33Å; I67-V257 HydrophobicContact CG1-CG2 4Å; I67-V257 HydrophobicContact CG2-CG2 3.57Å; L251-V257 CarbonylContact O-C 3.55Å; L251-V257 WeakPolarHBondContact O-CA 3.44Å; V252-V257 HydrophobicContact CG2-CG2 4.47Å; V257-F259 WeakPolarHBondContact CG1-O 3.5Å; V257-H260 HydrophobicContact CG1-CB 3.92Å; V257-Y329 HydrophobicContact CB-CD1 4.33Å; V257-Y329 HydrophobicContact CB-CE1 4.34Å; V257-Y329 HydrophobicContact CG1-CD1 3.81Å; V257-Y329 HydrophobicContact CG1-CE1 3.61Å
258	M	94.4	Very high	95.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-25.3	174.7	-54	-58.6	134.7	0	0	112.1	L251 A253 K256 Y269 I291 T322 L325 A326 Y329	L251-M258 HydrophobicContact CB-CB 4.2Å; L251-M258 PolarHBondContact O-N 2.93Å; A253-M258 HydrophobicContact CB-CE 4.29Å; A253-M258 HydrophobicContact CB-CG 4.34Å; A253-M258 WeakPolarHBondContact O-CE 3.5Å; K256-M258 HydrophobicContact CB-CE 3.52Å; K256-M258 WeakPolarHBondContact O-CE 3.26Å; M258-Y269 PolarHBondContact O-OH 3.26Å; M258-I291 HydrophobicContact CB-CD1 4.19Å; M258-I291 HydrophobicContact CB-CG1 4.35Å; M258-I291 HydrophobicContact CG-CD1 4.2Å; M258-I291 HydrophobicContact CG-CG1 4.16Å; M258-T322 HydrophobicContact CE-CG2 4.21Å; M258-T322 WeakPolarHBondContact CE-O 3.5Å; M258-T322 HydrophobicContact SD-CG2 4.46Å; M258-L325 HydrophobicContact CB-CB 4.44Å; M258-L325 HydrophobicContact CG-CB 4.41Å; M258-L325 HydrophobicContact SD-CB 3.43Å; M258-L325 WeakPolarHBondContact SD-CB 3.3Å; M258-L325 HydrophobicContact SD-CD1 4.45Å; M258-A326 HydrophobicContact CE-CB 3.89Å; M258-A326 HydrophobicContact SD-CB 4.16Å; M258-Y329 WeakPolarHBondContact O-CB 3.35Å
259	F	96.6	Very high	95	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	140.8	176.2	173.8	-95.1	0	0	0	109.3	L249 T250 L251 V257 P262 A266 Y269 F270 L334	L249-F259 HydrophobicContact CB-CD1 4.49Å; L249-F259 HydrophobicContact CB-CE1 4.21Å; L249-F259 HydrophobicContact CD2-CD1 4.38Å; L249-F259 HydrophobicContact CD2-CE1 4.5Å; L249-F259 HydrophobicContact CG-CD1 4.49Å; T250-F259 CarbonylContact C-O 3.58Å; T250-F259 WeakPolarHBondContact CA-O 3.24Å; L251-F259 HydrophobicContact CB-CB 4.19Å; L251-F259 HydrophobicContact CD1-CB 4Å; L251-F259 HydrophobicContact CG-CB 4.41Å; L251-F259 PolarHBondContact N-O 3.36Å; V257-F259 WeakPolarHBondContact CG1-O 3.5Å; F259-P262 WeakPolarHBondContact CZ-O 3.45Å; F259-A266 HydrophobicContact CD1-CB 4.07Å; F259-A266 HydrophobicContact CE1-CB 3.58Å; F259-A266 HydrophobicContact CE2-CB 4.28Å; F259-A266 HydrophobicContact CZ-CB 3.69Å; F259-Y269 HydrophobicContact CB-CD1 4.45Å; F259-Y269 HydrophobicContact CB-CE1 4.28Å; F259-Y269 AromaticContact CD2-CD1 3.5Å; F259-Y269 HydrophobicContact CD2-CD1 3.5Å; F259-Y269 VanDerWaalsContact CD2-CD1 3.5Å; F259-Y269 HydrophobicContact CD2-CD2 4.39Å; F259-Y269 AromaticContact CD2-CE1 3.95Å; F259-Y269 HydrophobicContact CD2-CE1 3.95Å; F259-Y269 AromaticContact CD2-CG 3.74Å; F259-Y269 HydrophobicContact CD2-CG 3.74Å; F259-Y269 HydrophobicContact CE2-CD1 4.17Å; F259-Y269 AromaticContact CE2-CG 4Å; F259-Y269 HydrophobicContact CE2-CG 4Å; F259-Y269 HydrophobicContact CG-CD1 4.33Å; F259-F270 HydrophobicContact CB-CE2 4.38Å; F259-F270 HydrophobicContact CB-CZ 4.42Å; F259-L334 HydrophobicContact CE2-CD1 4.06Å
260	H	97.3	Very high	94.8	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.023	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	127.3	166.4	169.6	83.1	0	0	0	109.2	G69 I70 L249 T250 V257 Y329	G69-H260 VanDerWaalsContact CA-NE2 3.34Å; G69-H260 WeakPolarHBondContact CA-NE2 3.49Å; I70-H260 PolarHBondContact N-CE1 3.29Å; I70-H260 PolarHBondContact N-NE2 2.95Å; I70-H260 PolarHBondContact O-CE1 2.99Å; I70-H260 PolarHBondContact O-NE2 2.72Å; L249-H260 WeakPolarHBondContact O-CA 3.33Å; T250-H260 HydrophobicContact CG2-CB 4.29Å; T250-H260 PolarHBondContact OG1-ND1 3.01Å; V257-H260 HydrophobicContact CG1-CB 3.92Å; H260-Y329 HydrophobicContact CB-CE1 4.45Å; H260-Y329 WeakPolarHBondContact CB-OH 3.08Å; H260-Y329 PolarHBondContact O-OH 3.45Å; H260-Y329 VanDerWaalsContact O-OH 3.06Å
261	G	96.6	Very high	94.5	Very high	9 Å²	9	32.8 Å²	32.8	9%	0.093	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-162.7	-176.7	0	0	0	0	0	112.8	S248 L249	S248-G261 WeakPolarHBondContact CA-O 3.47Å; S248-G261 PolarHBondContact OG-O 2.95Å; L249-G261 PolarHBondContact N-O 3.47Å; L249-G261 PolarHBondContact O-N 2.93Å
262	P	96.8	Very high	94.1	Very high	53 Å²	53	37.4 Å²	37.4	34%	0.344	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	139.1	171.5	-23.2	35.7	0	0	0	111.4	F259 Q264 D265	F259-P262 WeakPolarHBondContact CZ-O 3.45Å; P262-Q264 PolarHBondContact O-N 3.18Å; P262-D265 HydrophobicContact CB-CB 4.37Å; P262-D265 WeakPolarHBondContact CG-OD2 3.28Å; P262-D265 PolarHBondContact O-N 2.95Å
263	A	95.9	Very high	93.7	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.3	-176.6	0	0	0	0	0	112.6	F243 F246 D247 L249 A266	F243-A263 HydrophobicContact CZ-CB 4.38Å; F246-A263 HydrophobicContact CB-CB 3.72Å; F246-A263 WeakPolarHBondContact O-CB 3.5Å; D247-A263 PolarHBondContact O-N 3.08Å; L249-A263 HydrophobicContact CB-CB 3.92Å; A263-A266 WeakPolarHBondContact O-CB 3.45Å
264	Q	93.5	Very high	93.5	Very high	108 Å²	108	41.5 Å²	41.5	51%	0.505	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.5	-178.6	-65.4	70.1	25.2	0	0	111.8	F246 P262	F246-Q264 PolarHBondContact O-NE2 3.21Å; P262-Q264 PolarHBondContact O-N 3.18Å
265	D	94.9	Very high	93.4	Very high	72 Å²	72	41.9 Å²	41.9	39%	0.385	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-17.2	-176.9	-58.9	-8.9	0	0	0	112.3	P262 L267 E268 Y269	P262-D265 HydrophobicContact CB-CB 4.37Å; P262-D265 WeakPolarHBondContact CG-OD2 3.28Å; P262-D265 PolarHBondContact O-N 2.95Å; D265-L267 PolarHBondContact O-N 3Å; D265-E268 PolarHBondContact O-N 2.86Å; D265-E268 VanDerWaalsContact O-N 3.14Å; D265-Y269 PolarHBondContact O-N 2.7Å
266	A	95	Very high	93.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.1	-39.3	-178.2	0	0	0	0	0	112.4	L249 F259 A263 Y269 F270 F287	L249-A266 HydrophobicContact CD2-CB 3.87Å; F259-A266 HydrophobicContact CD1-CB 4.07Å; F259-A266 HydrophobicContact CE1-CB 3.58Å; F259-A266 HydrophobicContact CE2-CB 4.28Å; F259-A266 HydrophobicContact CZ-CB 3.69Å; A263-A266 WeakPolarHBondContact O-CB 3.45Å; A266-Y269 WeakPolarHBondContact O-CB 3.13Å; A266-Y269 PolarHBondContact O-N 3.3Å; A266-F270 WeakPolarHBondContact O-CD2 3.37Å; A266-F270 PolarHBondContact O-N 2.99Å; A266-F270 VanDerWaalsContact O-N 3.15Å; A266-F287 HydrophobicContact CB-CE1 4.28Å; A266-F287 HydrophobicContact CB-CE2 3.87Å; A266-F287 HydrophobicContact CB-CZ 3.6Å
267	L	93.5	Very high	92.7	Very high	34 Å²	34	47.9 Å²	47.9	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-41.6	-179	-169.6	62.7	0	0	0	112.3	D265 R271 Y277 F286 F287	D265-L267 PolarHBondContact O-N 3Å; L267-R271 VanDerWaalsContact CD2-NH2 3.3Å; L267-R271 WeakPolarHBondContact O-CG 3.41Å; L267-R271 PolarHBondContact O-N 3.35Å; L267-R271 VanDerWaalsContact O-N 3.11Å; L267-Y277 HydrophobicContact CD1-CD1 3.95Å; L267-Y277 HydrophobicContact CD1-CD2 3.63Å; L267-Y277 HydrophobicContact CD1-CE1 4.21Å; L267-Y277 HydrophobicContact CD1-CE2 3.99Å; L267-Y277 HydrophobicContact CD1-CG 3.6Å; L267-Y277 HydrophobicContact CD2-CD1 4.03Å; L267-Y277 HydrophobicContact CD2-CE1 3.79Å; L267-Y277 HydrophobicContact CG-CD1 4.39Å; L267-Y277 HydrophobicContact CG-CG 4.47Å; L267-F286 HydrophobicContact CD1-CD1 4.12Å; L267-F286 HydrophobicContact CD1-CE1 4.17Å; L267-F287 HydrophobicContact CB-CZ 4.21Å; L267-F287 HydrophobicContact CD1-CE1 4.06Å; L267-F287 HydrophobicContact CD1-CZ 4.28Å
268	E	92.7	Very high	92.2	Very high	144 Å²	144	53.2 Å²	53.2	67%	0.673	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-40.4	177.1	-174.6	170.2	-176.9	0	0	111.1	D265 F270 R271 S272	D265-E268 PolarHBondContact O-N 2.86Å; D265-E268 VanDerWaalsContact O-N 3.14Å; E268-F270 PolarHBondContact O-N 3.39Å; E268-R271 PolarHBondContact O-N 2.92Å; E268-S272 WeakPolarHBondContact O-CB 3.45Å; E268-S272 PolarHBondContact O-N 2.66Å
269	Y	94.8	Very high	91.6	Very high	16 Å²	16	57.6 Å²	57.6	6%	0.063	32%	0.316	C	S	.	.	H	α-helix	trans	-54.5	-53.6	174.1	169.9	-101.1	0	0	0	111.9	M258 F259 D265 A266 R271 S272 A273 Y329 L334	M258-Y269 PolarHBondContact O-OH 3.26Å; F259-Y269 HydrophobicContact CB-CD1 4.45Å; F259-Y269 HydrophobicContact CB-CE1 4.28Å; F259-Y269 AromaticContact CD2-CD1 3.5Å; F259-Y269 HydrophobicContact CD2-CD1 3.5Å; F259-Y269 VanDerWaalsContact CD2-CD1 3.5Å; F259-Y269 HydrophobicContact CD2-CD2 4.39Å; F259-Y269 AromaticContact CD2-CE1 3.95Å; F259-Y269 HydrophobicContact CD2-CE1 3.95Å; F259-Y269 AromaticContact CD2-CG 3.74Å; F259-Y269 HydrophobicContact CD2-CG 3.74Å; F259-Y269 HydrophobicContact CE2-CD1 4.17Å; F259-Y269 AromaticContact CE2-CG 4Å; F259-Y269 HydrophobicContact CE2-CG 4Å; F259-Y269 HydrophobicContact CG-CD1 4.33Å; D265-Y269 PolarHBondContact O-N 2.7Å; A266-Y269 WeakPolarHBondContact O-CB 3.13Å; A266-Y269 PolarHBondContact O-N 3.3Å; Y269-R271 VanDerWaalsContact C-N 3.34Å; Y269-R271 PolarHBondContact O-N 3.42Å; Y269-S272 PolarHBondContact O-N 3.02Å; Y269-S272 PolarHBondContact O-OG 3.24Å; Y269-A273 PolarHBondContact O-N 2.95Å; Y269-A273 VanDerWaalsContact O-N 3.08Å; Y269-Y329 VanDerWaalsContact OH-CA 3.23Å; Y269-Y329 WeakPolarHBondContact OH-CA 3.26Å; Y269-Y329 WeakPolarHBondContact OH-CB 3.45Å; Y269-Y329 PolarHBondContact OH-N 2.91Å; Y269-L334 HydrophobicContact CD2-CD1 4.04Å
270	F	92.9	Very high	90.9	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-67.5	-31.5	-179.9	-76.7	-74.1	0	0	0	113.4	L251 F259 A266 E268 A273 G274 Y275 F286 F287 V290 L325	L251-F270 HydrophobicContact CD1-CE2 3.52Å; L251-F270 HydrophobicContact CD1-CZ 3.73Å; F259-F270 HydrophobicContact CB-CE2 4.38Å; F259-F270 HydrophobicContact CB-CZ 4.42Å; A266-F270 WeakPolarHBondContact O-CD2 3.37Å; A266-F270 PolarHBondContact O-N 2.99Å; A266-F270 VanDerWaalsContact O-N 3.15Å; E268-F270 PolarHBondContact O-N 3.39Å; F270-A273 WeakPolarHBondContact O-CB 3.35Å; F270-A273 PolarHBondContact O-N 3.36Å; F270-G274 PolarHBondContact O-N 3.39Å; F270-Y275 HydrophobicContact CD1-CD2 4.17Å; F270-Y275 WeakPolarHBondContact O-CB 3.46Å; F270-Y275 PolarHBondContact O-N 3.06Å; F270-Y275 VanDerWaalsContact O-N 3.11Å; F270-F286 HydrophobicContact CB-CE1 3.81Å; F270-F286 HydrophobicContact CB-CZ 4.22Å; F270-F286 HydrophobicContact CG-CE1 4.4Å; F270-F287 AromaticContact CD2-CD1 3.37Å; F270-F287 HydrophobicContact CD2-CD1 3.37Å; F270-F287 AromaticContact CD2-CE1 3.53Å; F270-F287 HydrophobicContact CD2-CE1 3.53Å; F270-F287 HydrophobicContact CD2-CG 4.35Å; F270-F287 AromaticContact CE2-CD1 3.63Å; F270-F287 HydrophobicContact CE2-CD1 3.63Å; F270-F287 HydrophobicContact CE2-CE1 4.1Å; F270-F287 HydrophobicContact CE2-CG 4.19Å; F270-F287 HydrophobicContact CG-CD1 4.22Å; F270-F287 HydrophobicContact CG-CE1 4.42Å; F270-V290 HydrophobicContact CD1-CG1 3.99Å; F270-V290 HydrophobicContact CE1-CG1 3.92Å; F270-L325 HydrophobicContact CE1-CD2 4.17Å
271	R	91.2	Very high	90.5	Very high	129 Å²	129	68.9 Å²	68.9	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-65.5	-43.1	172.2	-73.5	-179.1	-166	173.6	5	111.9	L267 E268 Y269 A273 G274	L267-R271 VanDerWaalsContact CD2-NH2 3.3Å; L267-R271 WeakPolarHBondContact O-CG 3.41Å; L267-R271 PolarHBondContact O-N 3.35Å; L267-R271 VanDerWaalsContact O-N 3.11Å; E268-R271 PolarHBondContact O-N 2.92Å; Y269-R271 VanDerWaalsContact C-N 3.34Å; Y269-R271 PolarHBondContact O-N 3.42Å; R271-A273 PolarHBondContact O-N 3.5Å; R271-G274 PolarHBondContact O-N 3.29Å
272	S	89.6	Confident	90.2	Very high	97 Å²	97	69.7 Å²	69.7	68%	0.678	37%	0.373	S	S	*	.	H	α-helix	trans	-63.5	-27.1	176.6	76.6	0	0	0	0	112.5	E268 Y269 G274	E268-S272 WeakPolarHBondContact O-CB 3.45Å; E268-S272 PolarHBondContact O-N 2.66Å; Y269-S272 PolarHBondContact O-N 3.02Å; Y269-S272 PolarHBondContact O-OG 3.24Å; S272-G274 PolarHBondContact O-N 3.34Å
273	A	86.7	Confident	90	Very high	28 Å²	28	67.5 Å²	67.5	23%	0.231	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.1	173.2	0	0	0	0	0	114.5	Y269 F270 R271 Y275 M328	Y269-A273 PolarHBondContact O-N 2.95Å; Y269-A273 VanDerWaalsContact O-N 3.08Å; F270-A273 WeakPolarHBondContact O-CB 3.35Å; F270-A273 PolarHBondContact O-N 3.36Å; R271-A273 PolarHBondContact O-N 3.5Å; A273-Y275 HydrophobicContact CB-CD2 3.93Å; A273-Y275 HydrophobicContact CB-CE2 4.13Å; A273-M328 HydrophobicContact CB-CE 3.99Å; A273-M328 HydrophobicContact CB-SD 3.28Å; A273-M328 WeakPolarHBondContact CB-SD 3.36Å
274	G	87.3	Confident	89.9	Confident	59 Å²	59	67.5 Å²	67.5	61%	0.608	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.5	10.5	178	0	0	0	0	0	115.2	F270 R271 S272	F270-G274 PolarHBondContact O-N 3.39Å; R271-G274 PolarHBondContact O-N 3.29Å; S272-G274 PolarHBondContact O-N 3.34Å
275	Y	89.3	Confident	89.8	Confident	47 Å²	47	65 Å²	65	18%	0.184	35%	0.349	C	S	.	.			trans	-89.6	119	174.7	-62.8	-84	0	0	0	110.9	F270 A273 V290 L325	F270-Y275 HydrophobicContact CD1-CD2 4.17Å; F270-Y275 WeakPolarHBondContact O-CB 3.46Å; F270-Y275 PolarHBondContact O-N 3.06Å; F270-Y275 VanDerWaalsContact O-N 3.11Å; A273-Y275 HydrophobicContact CB-CD2 3.93Å; A273-Y275 HydrophobicContact CB-CE2 4.13Å; Y275-V290 HydrophobicContact CD1-CG1 3.96Å; Y275-V290 HydrophobicContact CD1-CG2 3.82Å; Y275-V290 HydrophobicContact CD2-CG1 4.2Å; Y275-V290 HydrophobicContact CE1-CG1 3.73Å; Y275-V290 HydrophobicContact CE1-CG2 4.34Å; Y275-V290 HydrophobicContact CE2-CG1 3.99Å; Y275-V290 HydrophobicContact CG-CG1 4.19Å; Y275-V290 HydrophobicContact CG-CG2 4.05Å; Y275-L325 HydrophobicContact CE2-CD2 3.84Å
276	N	85.6	Confident	89.7	Confident	148 Å²	148	61.8 Å²	61.8	79%	0.791	33%	0.332	S	S	*	.			trans	-75.2	127.1	178.8	-70.6	-28.7	0	0	0	110.7	F286	N276-F286 WeakPolarHBondContact O-CE2 3.26Å
277	Y	86.7	Confident	89.7	Confident	42 Å²	42	61.8 Å²	61.8	17%	0.165	33%	0.332	C	S	.	.			trans	-111.5	126.5	176.3	169.3	-96.4	0	0	0	110.8	L267 N281 P283 F286	L267-Y277 HydrophobicContact CD1-CD1 3.95Å; L267-Y277 HydrophobicContact CD1-CD2 3.63Å; L267-Y277 HydrophobicContact CD1-CE1 4.21Å; L267-Y277 HydrophobicContact CD1-CE2 3.99Å; L267-Y277 HydrophobicContact CD1-CG 3.6Å; L267-Y277 HydrophobicContact CD2-CD1 4.03Å; L267-Y277 HydrophobicContact CD2-CE1 3.79Å; L267-Y277 HydrophobicContact CG-CD1 4.39Å; L267-Y277 HydrophobicContact CG-CG 4.47Å; Y277-N281 HydrophobicContact CE2-CB 4.22Å; Y277-N281 WeakPolarHBondContact CE2-O 3.24Å; Y277-N281 VanDerWaalsContact CZ-O 3.32Å; Y277-N281 PolarHBondContact OH-O 3.1Å; Y277-P283 HydrophobicContact CE2-CG 4.38Å; Y277-F286 HydrophobicContact CD2-CB 4.01Å; Y277-F286 AromaticContact CD2-CD1 3.92Å; Y277-F286 HydrophobicContact CD2-CD1 3.92Å; Y277-F286 HydrophobicContact CD2-CD2 4.06Å; Y277-F286 HydrophobicContact CD2-CE1 4.42Å; Y277-F286 AromaticContact CD2-CG 3.73Å; Y277-F286 HydrophobicContact CD2-CG 3.73Å; Y277-F286 HydrophobicContact CE2-CB 4.26Å; Y277-F286 HydrophobicContact CE2-CG 4.45Å
278	E	85	Confident	89.6	Confident	126 Å²	126	60.3 Å²	60.3	59%	0.589	32%	0.324	S	S	*	.			trans	-87	130.9	172.9	-61.2	177.5	167.9	0	0	110.4	H280 N281	E278-H280 PolarHBondContact O-N 3.23Å; E278-N281 PolarHBondContact O-N 2.86Å; E278-N281 PolarHBondContact OE2-ND2 2.86Å
279	S	82	Confident	89.4	Confident	91 Å²	91	56.9 Å²	56.9	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.3	-171.6	66.9	0	0	0	0	116
280	H	82.1	Confident	89.2	Confident	171 Å²	171	56.2 Å²	56.2	79%	0.792	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-13.5	-179.2	-47.9	-50.8	0	0	0	112.9	E278	E278-H280 PolarHBondContact O-N 3.23Å
281	N	87.5	Confident	89	Confident	71 Å²	71	56.2 Å²	56.2	38%	0.38	31%	0.308	S	S	.	.	S	Bend	trans	-84.4	146.3	-175.8	-66.2	-12.7	0	0	0	110.6	Y277 E278 P283	Y277-N281 HydrophobicContact CE2-CB 4.22Å; Y277-N281 WeakPolarHBondContact CE2-O 3.24Å; Y277-N281 VanDerWaalsContact CZ-O 3.32Å; Y277-N281 PolarHBondContact OH-O 3.1Å; E278-N281 PolarHBondContact O-N 2.86Å; E278-N281 PolarHBondContact OE2-ND2 2.86Å; N281-P283 WeakPolarHBondContact O-CD 3.02Å
282	N	91.4	Very high	88.7	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.144	30%	0.301	C	S	.	.			trans	-66.7	123	173.2	179.3	12.5	0	0	0	109.2	P238 Y240 A284 D285 F286	P238-N282 PolarHBondContact O-ND2 2.84Å; Y240-N282 PolarHBondContact N-OD1 3.03Å; N282-A284 PolarHBondContact O-N 3.47Å; N282-A284 PolarHBondContact OD1-N 3.18Å; N282-D285 HydrophobicContact CB-CB 4.14Å; N282-D285 WeakPolarHBondContact CB-OD2 3.26Å; N282-D285 PolarHBondContact ND2-OD2 3.25Å; N282-D285 PolarHBondContact O-N 3.45Å; N282-D285 VanDerWaalsContact O-N 3.08Å; N282-F286 PolarHBondContact O-N 3.41Å
283	P	93.3	Very high	88.1	Confident	7 Å²	7	49.3 Å²	49.3	5%	0.045	28%	0.277	C	S	.	.	H	α-helix	trans	-54.2	-38	178.7	-25.9	33.7	0	0	0	113	Y240 F243 Y277 N281 D285 F286 F287	Y240-P283 HydrophobicContact CD2-CG 4.06Å; Y240-P283 HydrophobicContact CE2-CG 4.24Å; F243-P283 HydrophobicContact CD1-CB 4.35Å; F243-P283 HydrophobicContact CD1-CG 4.48Å; F243-P283 HydrophobicContact CE1-CB 4.04Å; F243-P283 HydrophobicContact CE1-CG 4.42Å; F243-P283 HydrophobicContact CZ-CB 4.39Å; Y277-P283 HydrophobicContact CE2-CG 4.38Å; N281-P283 WeakPolarHBondContact O-CD 3.02Å; P283-D285 PolarHBondContact O-N 3.49Å; P283-F286 WeakPolarHBondContact O-CB 3.46Å; P283-F286 PolarHBondContact O-N 3.23Å; P283-F287 HydrophobicContact CB-CE2 4.06Å; P283-F287 HydrophobicContact CB-CZ 4.06Å; P283-F287 WeakPolarHBondContact O-CD2 3.38Å; P283-F287 WeakPolarHBondContact O-CE2 3.31Å; P283-F287 WeakPolarHBondContact O-CG 3.39Å; P283-F287 PolarHBondContact O-N 3.21Å
284	A	93.1	Very high	86.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-42	178.8	0	0	0	0	0	112.6	M79 P238 F243 N282 L288	M79-A284 HydrophobicContact CE-CB 3.74Å; M79-A284 HydrophobicContact SD-CB 4.46Å; P238-A284 HydrophobicContact CG-CB 3.8Å; P238-A284 WeakPolarHBondContact O-CB 2.93Å; F243-A284 HydrophobicContact CD2-CB 4.11Å; F243-A284 HydrophobicContact CG-CB 4.5Å; N282-A284 PolarHBondContact O-N 3.47Å; N282-A284 PolarHBondContact OD1-N 3.18Å; A284-L288 WeakPolarHBondContact O-CG 3.34Å; A284-L288 PolarHBondContact O-N 2.83Å
285	D	92	Very high	85.3	Confident	56 Å²	56	50.7 Å²	50.7	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-71	-43.2	178.4	-61.3	-30.2	0	0	0	110	N282 P283 F287 L288 D289	N282-D285 HydrophobicContact CB-CB 4.14Å; N282-D285 WeakPolarHBondContact CB-OD2 3.26Å; N282-D285 PolarHBondContact ND2-OD2 3.25Å; N282-D285 PolarHBondContact O-N 3.45Å; N282-D285 VanDerWaalsContact O-N 3.08Å; P283-D285 PolarHBondContact O-N 3.49Å; D285-F287 PolarHBondContact O-N 3.3Å; D285-L288 PolarHBondContact O-N 3.04Å; D285-L288 VanDerWaalsContact O-N 3.1Å; D285-D289 VanDerWaalsContact O-CG 3.31Å; D285-D289 PolarHBondContact O-N 3.17Å
286	F	93.1	Very high	83.2	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-53.8	-47.4	173.6	167	-103.1	0	0	0	112.7	L267 F270 N276 Y277 N282 P283 L288 D289 V290 F295	L267-F286 HydrophobicContact CD1-CD1 4.12Å; L267-F286 HydrophobicContact CD1-CE1 4.17Å; F270-F286 HydrophobicContact CB-CE1 3.81Å; F270-F286 HydrophobicContact CB-CZ 4.22Å; F270-F286 HydrophobicContact CG-CE1 4.4Å; N276-F286 WeakPolarHBondContact O-CE2 3.26Å; Y277-F286 HydrophobicContact CD2-CB 4.01Å; Y277-F286 AromaticContact CD2-CD1 3.92Å; Y277-F286 HydrophobicContact CD2-CD1 3.92Å; Y277-F286 HydrophobicContact CD2-CD2 4.06Å; Y277-F286 HydrophobicContact CD2-CE1 4.42Å; Y277-F286 AromaticContact CD2-CG 3.73Å; Y277-F286 HydrophobicContact CD2-CG 3.73Å; Y277-F286 HydrophobicContact CE2-CB 4.26Å; Y277-F286 HydrophobicContact CE2-CG 4.45Å; N282-F286 PolarHBondContact O-N 3.41Å; P283-F286 WeakPolarHBondContact O-CB 3.46Å; P283-F286 PolarHBondContact O-N 3.23Å; F286-L288 VanDerWaalsContact C-N 3.31Å; F286-L288 PolarHBondContact O-N 3.43Å; F286-D289 PolarHBondContact O-N 3.2Å; F286-V290 HydrophobicContact CD2-CG2 4.27Å; F286-V290 HydrophobicContact CE1-CG2 4.34Å; F286-V290 HydrophobicContact CE2-CG2 3.85Å; F286-V290 HydrophobicContact CZ-CG2 3.9Å; F286-V290 WeakPolarHBondContact O-CG2 3.33Å; F286-V290 PolarHBondContact O-N 3.48Å; F286-F295 AromaticContact CD2-CE2 3.85Å; F286-F295 HydrophobicContact CD2-CE2 3.85Å; F286-F295 AromaticContact CD2-CZ 3.6Å; F286-F295 HydrophobicContact CD2-CZ 3.6Å; F286-F295 HydrophobicContact CE2-CE2 4.07Å; F286-F295 AromaticContact CE2-CZ 3.95Å; F286-F295 HydrophobicContact CE2-CZ 3.95Å
287	F	93.8	Very high	81	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-40.1	178.5	-58.4	-34.5	0	0	0	112.3	F243 L249 L251 A266 L267 F270 P283 D285 V290 I291	F243-F287 HydrophobicContact CE2-CD2 4.43Å; F243-F287 AromaticContact CE2-CE2 3.89Å; F243-F287 HydrophobicContact CE2-CE2 3.89Å; F243-F287 AromaticContact CZ-CE2 3.7Å; F243-F287 HydrophobicContact CZ-CE2 3.7Å; F243-F287 HydrophobicContact CZ-CZ 4.47Å; L249-F287 HydrophobicContact CD2-CD2 3.94Å; L249-F287 HydrophobicContact CD2-CE2 3.92Å; L251-F287 HydrophobicContact CD1-CB 3.87Å; L251-F287 HydrophobicContact CD1-CD2 4.32Å; L251-F287 HydrophobicContact CD1-CG 4.06Å; L251-F287 HydrophobicContact CD2-CB 4.26Å; A266-F287 HydrophobicContact CB-CE1 4.28Å; A266-F287 HydrophobicContact CB-CE2 3.87Å; A266-F287 HydrophobicContact CB-CZ 3.6Å; L267-F287 HydrophobicContact CB-CZ 4.21Å; L267-F287 HydrophobicContact CD1-CE1 4.06Å; L267-F287 HydrophobicContact CD1-CZ 4.28Å; F270-F287 AromaticContact CD2-CD1 3.37Å; F270-F287 HydrophobicContact CD2-CD1 3.37Å; F270-F287 AromaticContact CD2-CE1 3.53Å; F270-F287 HydrophobicContact CD2-CE1 3.53Å; F270-F287 HydrophobicContact CD2-CG 4.35Å; F270-F287 AromaticContact CE2-CD1 3.63Å; F270-F287 HydrophobicContact CE2-CD1 3.63Å; F270-F287 HydrophobicContact CE2-CE1 4.1Å; F270-F287 HydrophobicContact CE2-CG 4.19Å; F270-F287 HydrophobicContact CG-CD1 4.22Å; F270-F287 HydrophobicContact CG-CE1 4.42Å; P283-F287 HydrophobicContact CB-CE2 4.06Å; P283-F287 HydrophobicContact CB-CZ 4.06Å; P283-F287 WeakPolarHBondContact O-CD2 3.38Å; P283-F287 WeakPolarHBondContact O-CE2 3.31Å; P283-F287 WeakPolarHBondContact O-CG 3.39Å; P283-F287 PolarHBondContact O-N 3.21Å; D285-F287 PolarHBondContact O-N 3.3Å; F287-V290 PolarHBondContact O-N 3.1Å; F287-I291 WeakPolarHBondContact O-CB 3.41Å; F287-I291 WeakPolarHBondContact O-CD1 3.42Å; F287-I291 WeakPolarHBondContact O-CG1 3.14Å; F287-I291 PolarHBondContact O-N 3.27Å
288	L	91.6	Very high	78.7	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-69.9	-38.4	179.3	-68.8	172	0	0	0	111.5	M79 G80 Q237 A284 D285 F286 I291 N292	M79-L288 HydrophobicContact CE-CD1 3.91Å; M79-L288 HydrophobicContact CE-CD2 4.42Å; M79-L288 HydrophobicContact CE-CG 4.02Å; G80-L288 WeakPolarHBondContact O-CD2 3.44Å; Q237-L288 HydrophobicContact CB-CD1 4.22Å; Q237-L288 HydrophobicContact CG-CD1 3.31Å; A284-L288 WeakPolarHBondContact O-CG 3.34Å; A284-L288 PolarHBondContact O-N 2.83Å; D285-L288 PolarHBondContact O-N 3.04Å; D285-L288 VanDerWaalsContact O-N 3.1Å; F286-L288 VanDerWaalsContact C-N 3.31Å; F286-L288 PolarHBondContact O-N 3.43Å; L288-I291 PolarHBondContact O-N 3.4Å; L288-N292 VanDerWaalsContact O-CB 3.28Å; L288-N292 WeakPolarHBondContact O-CB 3.32Å; L288-N292 PolarHBondContact O-N 3.3Å; L288-N292 PolarHBondContact O-ND2 2.87Å
289	D	89.3	Confident	76.2	Confident	72 Å²	72	56.7 Å²	56.7	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-64.5	-40.9	175.4	-70.4	-18.5	0	0	0	111.6	D285 F286 N292 G293 G294 F295	D285-D289 VanDerWaalsContact O-CG 3.31Å; D285-D289 PolarHBondContact O-N 3.17Å; F286-D289 PolarHBondContact O-N 3.2Å; D289-N292 PolarHBondContact O-N 3.08Å; D289-G293 PolarHBondContact O-N 2.67Å; D289-G294 PolarHBondContact O-N 3.48Å; D289-F295 HydrophobicContact CB-CD2 4.19Å; D289-F295 HydrophobicContact CB-CE2 3.48Å; D289-F295 VanDerWaalsContact CB-CE2 3.48Å; D289-F295 HydrophobicContact CB-CZ 4.11Å
290	V	89.9	Confident	73.8	Confident	2 Å²	2	59 Å²	59	1%	0.012	32%	0.323	C	S	.	.	H	α-helix	trans	-59.8	-47.8	172.8	170.8	0	0	0	0	110.9	F270 Y275 F286 F287 N292 G293 F295 V321 L325	F270-V290 HydrophobicContact CD1-CG1 3.99Å; F270-V290 HydrophobicContact CE1-CG1 3.92Å; Y275-V290 HydrophobicContact CD1-CG1 3.96Å; Y275-V290 HydrophobicContact CD1-CG2 3.82Å; Y275-V290 HydrophobicContact CD2-CG1 4.2Å; Y275-V290 HydrophobicContact CE1-CG1 3.73Å; Y275-V290 HydrophobicContact CE1-CG2 4.34Å; Y275-V290 HydrophobicContact CE2-CG1 3.99Å; Y275-V290 HydrophobicContact CG-CG1 4.19Å; Y275-V290 HydrophobicContact CG-CG2 4.05Å; F286-V290 HydrophobicContact CD2-CG2 4.27Å; F286-V290 HydrophobicContact CE1-CG2 4.34Å; F286-V290 HydrophobicContact CE2-CG2 3.85Å; F286-V290 HydrophobicContact CZ-CG2 3.9Å; F286-V290 WeakPolarHBondContact O-CG2 3.33Å; F286-V290 PolarHBondContact O-N 3.48Å; F287-V290 PolarHBondContact O-N 3.1Å; V290-N292 VanDerWaalsContact C-N 3.34Å; V290-N292 PolarHBondContact O-N 3.47Å; V290-G293 PolarHBondContact O-N 3.04Å; V290-F295 HydrophobicContact CB-CD2 4.31Å; V290-F295 HydrophobicContact CB-CE2 4.46Å; V290-F295 HydrophobicContact CG2-CD2 3.55Å; V290-F295 HydrophobicContact CG2-CE2 3.55Å; V290-V321 WeakPolarHBondContact O-CG1 3.32Å; V290-L325 HydrophobicContact CG1-CD1 3.96Å; V290-L325 HydrophobicContact CG1-CD2 4.33Å
291	I	89.4	Confident	71.4	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-69.2	-32.3	-177.3	-70.6	169.3	0	0	0	112.4	P81 L251 A253 M258 F287 L288 G293 T322 L325	P81-I291 HydrophobicContact CG-CG2 4.48Å; L251-I291 HydrophobicContact CB-CD1 3.77Å; L251-I291 HydrophobicContact CD1-CD1 3.99Å; L251-I291 HydrophobicContact CD2-CD1 3.91Å; L251-I291 HydrophobicContact CG-CD1 4.1Å; A253-I291 HydrophobicContact CB-CG2 3.31Å; M258-I291 HydrophobicContact CB-CD1 4.19Å; M258-I291 HydrophobicContact CB-CG1 4.35Å; M258-I291 HydrophobicContact CG-CD1 4.2Å; M258-I291 HydrophobicContact CG-CG1 4.16Å; F287-I291 WeakPolarHBondContact O-CB 3.41Å; F287-I291 WeakPolarHBondContact O-CD1 3.42Å; F287-I291 WeakPolarHBondContact O-CG1 3.14Å; F287-I291 PolarHBondContact O-N 3.27Å; L288-I291 PolarHBondContact O-N 3.4Å; I291-G293 VanDerWaalsContact C-N 3.28Å; I291-T322 HydrophobicContact CG2-CG2 4.32Å; I291-L325 HydrophobicContact CG1-CD1 4.26Å
292	N	84.8	Confident	69	Low	65 Å²	65	62.2 Å²	62.2	35%	0.348	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.9	176.8	-70.5	-23.3	0	0	0	113.5	P81 L288 D289 V290 Q318	P81-N292 WeakPolarHBondContact CB-OD1 3.37Å; L288-N292 VanDerWaalsContact O-CB 3.28Å; L288-N292 WeakPolarHBondContact O-CB 3.32Å; L288-N292 PolarHBondContact O-N 3.3Å; L288-N292 PolarHBondContact O-ND2 2.87Å; D289-N292 PolarHBondContact O-N 3.08Å; V290-N292 VanDerWaalsContact C-N 3.34Å; V290-N292 PolarHBondContact O-N 3.47Å; N292-Q318 PolarHBondContact OD1-NE2 3.2Å
293	G	75.7	Confident	66.5	Low	17 Å²	17	70.4 Å²	70.4	18%	0.175	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	13.3	-179.3	0	0	0	0	0	114.9	D289 V290 I291 F295 S296	D289-G293 PolarHBondContact O-N 2.67Å; V290-G293 PolarHBondContact O-N 3.04Å; I291-G293 VanDerWaalsContact C-N 3.28Å; G293-F295 VanDerWaalsContact C-N 3.26Å; G293-F295 PolarHBondContact O-N 3.41Å; G293-S296 PolarHBondContact O-N 3.19Å
294	G	61.2	Low	63.9	Low	36 Å²	36	78.6 Å²	78.6	37%	0.371	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-61.3	-27.1	-175.1	0	0	0	0	0	115	D289 S296	D289-G294 PolarHBondContact O-N 3.48Å; G294-S296 VanDerWaalsContact C-N 3.33Å; G294-S296 PolarHBondContact O-N 3.36Å
295	F	54.6	Low	61.2	Low	79 Å²	79	81.8 Å²	81.8	35%	0.346	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-82	-3.2	-177.7	-69.5	-79.4	0	0	0	115.1	F286 D289 V290 G293 N297	F286-F295 AromaticContact CD2-CE2 3.85Å; F286-F295 HydrophobicContact CD2-CE2 3.85Å; F286-F295 AromaticContact CD2-CZ 3.6Å; F286-F295 HydrophobicContact CD2-CZ 3.6Å; F286-F295 HydrophobicContact CE2-CE2 4.07Å; F286-F295 AromaticContact CE2-CZ 3.95Å; F286-F295 HydrophobicContact CE2-CZ 3.95Å; D289-F295 HydrophobicContact CB-CD2 4.19Å; D289-F295 HydrophobicContact CB-CE2 3.48Å; D289-F295 VanDerWaalsContact CB-CE2 3.48Å; D289-F295 HydrophobicContact CB-CZ 4.11Å; V290-F295 HydrophobicContact CB-CD2 4.31Å; V290-F295 HydrophobicContact CB-CE2 4.46Å; V290-F295 HydrophobicContact CG2-CD2 3.55Å; V290-F295 HydrophobicContact CG2-CE2 3.55Å; G293-F295 VanDerWaalsContact C-N 3.26Å; G293-F295 PolarHBondContact O-N 3.41Å; F295-N297 VanDerWaalsContact C-N 3.29Å
296	S	45.5	Very low	58.9	Low	86 Å²	86	86.7 Å²	86.7	60%	0.601	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-82.3	-7.9	173.9	-153.1	0	0	0	0	113.3	G293 G294 I298	G293-S296 PolarHBondContact O-N 3.19Å; G294-S296 VanDerWaalsContact C-N 3.33Å; G294-S296 PolarHBondContact O-N 3.36Å; S296-I298 PolarHBondContact O-N 2.95Å
297	N	38.8	Very low	57	Low	109 Å²	109	94.3 Å²	94.3	58%	0.583	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-76.6	4.2	-177	-72.9	-8.1	0	0	0	114.8	F295 L299	F295-N297 VanDerWaalsContact C-N 3.29Å; N297-L299 VanDerWaalsContact C-N 3.29Å
298	I	38.1	Very low	55.2	Low	147 Å²	147	100.8 Å²	100.8	75%	0.754	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-86.1	-2.3	177.3	-60.8	175.1	0	0	0	111.7	S296	S296-I298 PolarHBondContact O-N 2.95Å
299	L	32.4	Very low	53.5	Low	148 Å²	148	106.2 Å²	106.2	78%	0.775	58%	0.579	S	S	*	*	S	Bend	trans	-119.4	-8	-175.9	-81.5	166.8	0	0	0	117.7	N297	N297-L299 VanDerWaalsContact C-N 3.29Å
300	D	32	Very low	52	Low	140 Å²	140	109.1 Å²	109.1	75%	0.749	59%	0.588	S	S	*	*			trans	-132.7	133.3	177.3	-72.7	-48	0	0	0	113.4
301	T	32.9	Very low	50.5	Low	127 Å²	127	117.4 Å²	117.4	78%	0.779	62%	0.621	S	S	*	*			trans	-83	159.1	-164.5	-46.3	0	0	0	0	111
302	E	35.3	Very low	49.3	Very low	182 Å²	182	124.2 Å²	124.2	85%	0.85	65%	0.652	S	S	*	*			trans	-13.9	123.5	165	-56.7	177.2	171.7	0	0	116.1
303	E	40.2	Very low	48.5	Very low	199 Å²	199	126 Å²	126	93%	0.93	66%	0.658	S	S	*	*			trans	-158.7	128.2	147.3	-112.6	169.4	-152.8	0	0	112.7
304	D	37.8	Very low	48	Very low	178 Å²	178	129.4 Å²	129.4	95%	0.952	67%	0.672	S	S	*	*			trans	-76	126	173.1	-88.2	-42.3	0	0	0	110.5
305	G	38	Very low	48.4	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	68%	0.683	S	S	*	*			trans	174.3	128.4	169.8	0	0	0	0	0	114.7
306	H	43.2	Very low	49.3	Very low	159 Å²	159	136 Å²	136	74%	0.736	69%	0.693	S	S	*	*			trans	27.5	116	169.4	-86.8	-70.3	0	0	0	120.5	D308 D309	H306-D308 VanDerWaalsContact C-N 3.33Å; H306-D308 PolarHBondContact O-N 2.99Å; H306-D309 PolarHBondContact O-N 3.29Å
307	E	53.6	Low	50.5	Low	164 Å²	164	137 Å²	137	77%	0.766	68%	0.683	S	S	*	*	H	α-helix	trans	-58	-31.8	-178.4	-74.8	-174.7	151.5	0	0	115.3	Y311	E307-Y311 WeakPolarHBondContact O-CD2 3.5Å
308	D	54.4	Low	52.1	Low	137 Å²	137	133.5 Å²	133.5	73%	0.733	66%	0.664	S	S	*	*	H	α-helix	trans	-74.4	-40.5	-175.5	-73.4	-28.9	0	0	0	113	H306 K310 Y311	H306-D308 VanDerWaalsContact C-N 3.33Å; H306-D308 PolarHBondContact O-N 2.99Å; D308-K310 VanDerWaalsContact C-N 3.28Å; D308-K310 PolarHBondContact O-N 3.14Å; D308-Y311 PolarHBondContact O-N 3.35Å
309	D	56.9	Low	53.9	Low	116 Å²	116	133 Å²	133	62%	0.62	65%	0.653	S	S	*	*	H	α-helix	trans	-68.1	-31.1	178.1	-77	-23.6	0	0	0	111.7	H306 Y311 E312 E313	H306-D309 PolarHBondContact O-N 3.29Å; D309-Y311 VanDerWaalsContact C-N 3.32Å; D309-Y311 PolarHBondContact O-N 3.37Å; D309-E312 PolarHBondContact O-N 3.27Å; D309-E313 WeakPolarHBondContact O-CB 3.28Å; D309-E313 PolarHBondContact O-N 3.27Å
310	K	57.9	Low	56.3	Low	134 Å²	134	132 Å²	132	58%	0.583	64%	0.644	S	S	*	*	H	α-helix	trans	-64.4	-35	179.5	-166.1	173.1	-175.3	169.3	0	112.6	D308 L314	D308-K310 VanDerWaalsContact C-N 3.28Å; D308-K310 PolarHBondContact O-N 3.14Å; K310-L314 HydrophobicContact CG-CD1 4.19Å; K310-L314 VanDerWaalsContact O-CB 3.29Å; K310-L314 WeakPolarHBondContact O-CB 3.01Å; K310-L314 WeakPolarHBondContact O-CD1 3.4Å; K310-L314 WeakPolarHBondContact O-CG 3.46Å; K310-L314 PolarHBondContact O-N 2.77Å
311	Y	58.2	Low	58.8	Low	176 Å²	176	127 Å²	127	69%	0.69	62%	0.619	S	S	*	*	H	α-helix	trans	-70	-41.2	177.3	-87.8	-78.8	0	0	0	112.1	E307 D308 D309 L314 F315	E307-Y311 WeakPolarHBondContact O-CD2 3.5Å; D308-Y311 PolarHBondContact O-N 3.35Å; D309-Y311 VanDerWaalsContact C-N 3.32Å; D309-Y311 PolarHBondContact O-N 3.37Å; Y311-L314 PolarHBondContact O-N 2.89Å; Y311-F315 WeakPolarHBondContact O-CB 3.49Å; Y311-F315 PolarHBondContact O-N 3.39Å
312	E	64.4	Low	61.4	Low	143 Å²	143	121 Å²	121	67%	0.668	58%	0.582	S	S	*	*	H	α-helix	trans	-68.7	-40.9	179.6	-161.7	156	-159.2	0	0	110.8	D309 F315 E316	D309-E312 PolarHBondContact O-N 3.27Å; E312-F315 PolarHBondContact O-N 3.42Å; E312-E316 PolarHBondContact O-N 3.15Å
313	E	66.5	Low	63.9	Low	101 Å²	101	113.3 Å²	113.3	47%	0.472	55%	0.551	S	S	.	*	H	α-helix	trans	-64.6	-42.4	174.6	-162.7	-173	178.2	0	0	112.6	D309 F315 E316 R317	D309-E313 WeakPolarHBondContact O-CB 3.28Å; D309-E313 PolarHBondContact O-N 3.27Å; E313-F315 VanDerWaalsContact C-N 3.31Å; E313-F315 PolarHBondContact O-N 2.91Å; E313-E316 PolarHBondContact O-N 3.21Å; E313-R317 WeakPolarHBondContact O-CB 3.46Å; E313-R317 VanDerWaalsContact O-CG 3.26Å; E313-R317 WeakPolarHBondContact O-CG 3.24Å; E313-R317 PolarHBondContact O-N 2.97Å; E313-R317 IonicContact OE1-CZ 2.77Å; E313-R317 IonicContact OE1-NE 3.95Å; E313-R317 PolarHBondContact OE1-NE 3.14Å; E313-R317 IonicContact OE1-NH2 3.02Å; E313-R317 PolarHBondContact OE1-NH2 3.22Å
314	L	67.1	Low	66.3	Low	89 Å²	89	110.5 Å²	110.5	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-39.9	174.1	-81.7	165.7	0	0	0	111.9	K310 Y311 R317 Q318	K310-L314 HydrophobicContact CG-CD1 4.19Å; K310-L314 VanDerWaalsContact O-CB 3.29Å; K310-L314 WeakPolarHBondContact O-CB 3.01Å; K310-L314 WeakPolarHBondContact O-CD1 3.4Å; K310-L314 WeakPolarHBondContact O-CG 3.46Å; K310-L314 PolarHBondContact O-N 2.77Å; Y311-L314 PolarHBondContact O-N 2.89Å; L314-R317 PolarHBondContact O-N 2.86Å; L314-Q318 WeakPolarHBondContact O-CB 3.45Å; L314-Q318 PolarHBondContact O-N 3.06Å
315	F	68.4	Low	68.8	Low	137 Å²	137	102 Å²	102	60%	0.601	49%	0.491	S	S	*	.	H	α-helix	trans	-68.6	-44.1	179.7	-166.5	-94.1	0	0	0	112.1	Y311 E312 E313 Q318 Y319	Y311-F315 WeakPolarHBondContact O-CB 3.49Å; Y311-F315 PolarHBondContact O-N 3.39Å; E312-F315 PolarHBondContact O-N 3.42Å; E313-F315 VanDerWaalsContact C-N 3.31Å; E313-F315 PolarHBondContact O-N 2.91Å; F315-Q318 PolarHBondContact O-N 2.95Å; F315-Y319 WeakPolarHBondContact O-CB 3.36Å; F315-Y319 PolarHBondContact O-N 3.5Å
316	E	73	Confident	71.4	Confident	117 Å²	117	99.4 Å²	99.4	55%	0.547	46%	0.462	S	S	.	.	H	α-helix	trans	-55.9	-49.8	171.5	-88.6	-91.2	157.3	0	0	111.3	E312 E313 Q318 Y319 Q320	E312-E316 PolarHBondContact O-N 3.15Å; E313-E316 PolarHBondContact O-N 3.21Å; E316-Q318 PolarHBondContact O-N 3.36Å; E316-Y319 WeakPolarHBondContact O-CB 3.37Å; E316-Y319 PolarHBondContact O-N 3.34Å; E316-Q320 WeakPolarHBondContact O-CG 3.44Å; E316-Q320 PolarHBondContact O-N 2.98Å
317	R	71.7	Confident	73.8	Confident	106 Å²	106	96.8 Å²	96.8	40%	0.4	45%	0.454	S	S	.	.	H	α-helix	trans	-59.8	-47.1	177.5	-73.6	174.1	-175.6	-157.4	3	111.6	E313 L314 Y319 Q320 V321	E313-R317 WeakPolarHBondContact O-CB 3.46Å; E313-R317 VanDerWaalsContact O-CG 3.26Å; E313-R317 WeakPolarHBondContact O-CG 3.24Å; E313-R317 PolarHBondContact O-N 2.97Å; E313-R317 IonicContact OE1-CZ 2.77Å; E313-R317 IonicContact OE1-NE 3.95Å; E313-R317 PolarHBondContact OE1-NE 3.14Å; E313-R317 IonicContact OE1-NH2 3.02Å; E313-R317 PolarHBondContact OE1-NH2 3.22Å; L314-R317 PolarHBondContact O-N 2.86Å; R317-Y319 VanDerWaalsContact C-N 3.3Å; R317-Y319 PolarHBondContact O-N 2.84Å; R317-Q320 PolarHBondContact O-N 2.96Å; R317-V321 WeakPolarHBondContact O-CG2 3.26Å; R317-V321 PolarHBondContact O-N 3.1Å
318	Q	71.7	Confident	75.7	Confident	37 Å²	37	91.7 Å²	91.7	17%	0.173	43%	0.431	C	S	.	.	H	α-helix	trans	-60.1	-41.2	176.9	-173.4	177.6	15.8	0	0	111.3	N292 L314 F315 E316 V321 T322	N292-Q318 PolarHBondContact OD1-NE2 3.2Å; L314-Q318 WeakPolarHBondContact O-CB 3.45Å; L314-Q318 PolarHBondContact O-N 3.06Å; F315-Q318 PolarHBondContact O-N 2.95Å; E316-Q318 PolarHBondContact O-N 3.36Å; Q318-V321 PolarHBondContact O-N 3.42Å; Q318-T322 HydrophobicContact CG-CG2 4.35Å; Q318-T322 WeakPolarHBondContact O-CB 3.43Å; Q318-T322 VanDerWaalsContact O-CG2 3.26Å; Q318-T322 WeakPolarHBondContact O-CG2 3.33Å; Q318-T322 PolarHBondContact O-N 2.82Å; Q318-T322 PolarHBondContact O-OG1 3.47Å
319	Y	76.8	Confident	77.6	Confident	135 Å²	135	85.5 Å²	85.5	53%	0.529	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-40.8	177.6	-170.7	-100.7	0	0	0	112.5	F315 E316 R317 T322 G323	F315-Y319 WeakPolarHBondContact O-CB 3.36Å; F315-Y319 PolarHBondContact O-N 3.5Å; E316-Y319 WeakPolarHBondContact O-CB 3.37Å; E316-Y319 PolarHBondContact O-N 3.34Å; R317-Y319 VanDerWaalsContact C-N 3.3Å; R317-Y319 PolarHBondContact O-N 2.84Å; Y319-T322 WeakPolarHBondContact CA-OG1 3.43Å; Y319-T322 PolarHBondContact O-OG1 3.16Å; Y319-G323 PolarHBondContact O-N 2.96Å
320	Q	82.1	Confident	79.3	Confident	128 Å²	128	82.2 Å²	82.2	60%	0.598	39%	0.387	S	S	*	.	H	α-helix	trans	-66.1	-46.2	176	-68.9	-179.9	13.7	0	0	112.2	E316 R317 G323 K324	E316-Q320 WeakPolarHBondContact O-CG 3.44Å; E316-Q320 PolarHBondContact O-N 2.98Å; R317-Q320 PolarHBondContact O-N 2.96Å; Q320-G323 PolarHBondContact O-N 2.56Å; Q320-K324 PolarHBondContact O-N 3.37Å
321	V	85.4	Confident	80.9	Confident	35 Å²	35	83.9 Å²	83.9	21%	0.212	40%	0.396	C	S	.	.	H	α-helix	trans	-61.9	-47	178.3	172.2	0	0	0	0	110.8	V290 R317 Q318 G323 K324 L325	V290-V321 WeakPolarHBondContact O-CG1 3.32Å; R317-V321 WeakPolarHBondContact O-CG2 3.26Å; R317-V321 PolarHBondContact O-N 3.1Å; Q318-V321 PolarHBondContact O-N 3.42Å; V321-G323 VanDerWaalsContact C-N 3.33Å; V321-G323 PolarHBondContact O-N 2.86Å; V321-K324 PolarHBondContact O-N 3.32Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.35Å; V321-L325 WeakPolarHBondContact O-CB 3.34Å; V321-L325 WeakPolarHBondContact O-CG 3.47Å; V321-L325 PolarHBondContact O-N 3.49Å
322	T	85.8	Confident	82.6	Confident	2 Å²	2	76 Å²	76	1%	0.012	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-37.6	177.3	50.8	0	0	0	0	112.1	A253 S254 M258 I291 Q318 Y319 A326	A253-T322 HydrophobicContact CB-CG2 3.61Å; S254-T322 PolarHBondContact OG-OG1 3.45Å; M258-T322 HydrophobicContact CE-CG2 4.21Å; M258-T322 WeakPolarHBondContact CE-O 3.5Å; M258-T322 HydrophobicContact SD-CG2 4.46Å; I291-T322 HydrophobicContact CG2-CG2 4.32Å; Q318-T322 HydrophobicContact CG-CG2 4.35Å; Q318-T322 WeakPolarHBondContact O-CB 3.43Å; Q318-T322 VanDerWaalsContact O-CG2 3.26Å; Q318-T322 WeakPolarHBondContact O-CG2 3.33Å; Q318-T322 PolarHBondContact O-N 2.82Å; Q318-T322 PolarHBondContact O-OG1 3.47Å; Y319-T322 WeakPolarHBondContact CA-OG1 3.43Å; Y319-T322 PolarHBondContact O-OG1 3.16Å; T322-A326 VanDerWaalsContact O-CB 3.26Å; T322-A326 WeakPolarHBondContact O-CB 3.28Å; T322-A326 PolarHBondContact O-N 3.31Å
323	G	88.1	Confident	84	Confident	19 Å²	19	74 Å²	74	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-45.2	172.5	0	0	0	0	0	113.2	Y319 Q320 V321 N327	Y319-G323 PolarHBondContact O-N 2.96Å; Q320-G323 PolarHBondContact O-N 2.56Å; V321-G323 VanDerWaalsContact C-N 3.33Å; V321-G323 PolarHBondContact O-N 2.86Å; G323-N327 PolarHBondContact O-N 3.43Å
324	K	90.4	Very high	85.2	Confident	140 Å²	140	70.7 Å²	70.7	61%	0.609	35%	0.352	S	S	*	.	H	α-helix	trans	-65.3	-46.7	178.1	-173.3	-179.7	178.6	-176.4	0	112	Q320 V321 N327 M328	Q320-K324 PolarHBondContact O-N 3.37Å; V321-K324 PolarHBondContact O-N 3.32Å; K324-N327 PolarHBondContact O-N 2.83Å; K324-M328 PolarHBondContact O-N 2.95Å
325	L	92.3	Very high	86.4	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-40.6	179.6	-74	173.2	0	0	0	112.2	M258 F270 Y275 V290 I291 V321 N327 M328 Y329	M258-L325 HydrophobicContact CB-CB 4.44Å; M258-L325 HydrophobicContact CG-CB 4.41Å; M258-L325 HydrophobicContact SD-CB 3.43Å; M258-L325 WeakPolarHBondContact SD-CB 3.3Å; M258-L325 HydrophobicContact SD-CD1 4.45Å; F270-L325 HydrophobicContact CE1-CD2 4.17Å; Y275-L325 HydrophobicContact CE2-CD2 3.84Å; V290-L325 HydrophobicContact CG1-CD1 3.96Å; V290-L325 HydrophobicContact CG1-CD2 4.33Å; I291-L325 HydrophobicContact CG1-CD1 4.26Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.35Å; V321-L325 WeakPolarHBondContact O-CB 3.34Å; V321-L325 WeakPolarHBondContact O-CG 3.47Å; V321-L325 PolarHBondContact O-N 3.49Å; L325-N327 PolarHBondContact O-N 2.98Å; L325-M328 WeakPolarHBondContact O-CB 3.28Å; L325-M328 PolarHBondContact O-N 3.37Å; L325-Y329 PolarHBondContact O-N 3.27Å
326	A	92.2	Very high	87.6	Confident	12 Å²	12	65.2 Å²	65.2	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-42.3	176	0	0	0	0	0	112.1	K256 M258 T322 Y329 A330	K256-A326 HydrophobicContact CB-CB 4.03Å; K256-A326 HydrophobicContact CD-CB 3.99Å; M258-A326 HydrophobicContact CE-CB 3.89Å; M258-A326 HydrophobicContact SD-CB 4.16Å; T322-A326 VanDerWaalsContact O-CB 3.26Å; T322-A326 WeakPolarHBondContact O-CB 3.28Å; T322-A326 PolarHBondContact O-N 3.31Å; A326-Y329 PolarHBondContact O-N 2.88Å; A326-A330 WeakPolarHBondContact O-CB 3.31Å; A326-A330 PolarHBondContact O-N 3Å
327	N	92.9	Very high	88.5	Confident	105 Å²	105	65.6 Å²	65.6	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-65.9	-39.7	176.4	-75.2	-16.3	0	0	0	112	G323 K324 L325 A330 Q331	G323-N327 PolarHBondContact O-N 3.43Å; K324-N327 PolarHBondContact O-N 2.83Å; L325-N327 PolarHBondContact O-N 2.98Å; N327-A330 PolarHBondContact O-N 3.39Å; N327-Q331 WeakPolarHBondContact O-CG 3.46Å; N327-Q331 PolarHBondContact O-N 3.18Å; N327-Q331 VanDerWaalsContact O-N 3.15Å
328	M	92.6	Very high	89.6	Confident	56 Å²	56	61.5 Å²	61.5	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-44	175.6	-175.6	-178	-78.6	0	0	111.4	A273 K324 L325 Q331 S332	A273-M328 HydrophobicContact CB-CE 3.99Å; A273-M328 HydrophobicContact CB-SD 3.28Å; A273-M328 WeakPolarHBondContact CB-SD 3.36Å; K324-M328 PolarHBondContact O-N 2.95Å; L325-M328 WeakPolarHBondContact O-CB 3.28Å; L325-M328 PolarHBondContact O-N 3.37Å; M328-Q331 PolarHBondContact O-N 2.61Å; M328-S332 PolarHBondContact O-N 2.95Å; M328-S332 VanDerWaalsContact O-N 3.16Å
329	Y	94.8	Very high	90.5	Very high	7 Å²	7	64.8 Å²	64.8	3%	0.027	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-44.7	175.4	179.1	-113.4	0	0	0	111.8	V257 M258 H260 Y269 L325 A326 Q331 S332 L334 Y335	V257-Y329 HydrophobicContact CB-CD1 4.33Å; V257-Y329 HydrophobicContact CB-CE1 4.34Å; V257-Y329 HydrophobicContact CG1-CD1 3.81Å; V257-Y329 HydrophobicContact CG1-CE1 3.61Å; M258-Y329 WeakPolarHBondContact O-CB 3.35Å; H260-Y329 HydrophobicContact CB-CE1 4.45Å; H260-Y329 WeakPolarHBondContact CB-OH 3.08Å; H260-Y329 PolarHBondContact O-OH 3.45Å; H260-Y329 VanDerWaalsContact O-OH 3.06Å; Y269-Y329 VanDerWaalsContact OH-CA 3.23Å; Y269-Y329 WeakPolarHBondContact OH-CA 3.26Å; Y269-Y329 WeakPolarHBondContact OH-CB 3.45Å; Y269-Y329 PolarHBondContact OH-N 2.91Å; L325-Y329 PolarHBondContact O-N 3.27Å; A326-Y329 PolarHBondContact O-N 2.88Å; Y329-Q331 PolarHBondContact O-N 2.97Å; Y329-Q331 VanDerWaalsContact O-N 3.16Å; Y329-S332 VanDerWaalsContact O-CB 3.26Å; Y329-S332 WeakPolarHBondContact O-CB 3.25Å; Y329-S332 PolarHBondContact O-N 3.42Å; Y329-S332 PolarHBondContact O-OG 2.92Å; Y329-L334 HydrophobicContact CE2-CB 4.34Å; Y329-Y335 HydrophobicContact CD1-CD2 4.25Å; Y329-Y335 AromaticContact CE1-CD2 3.67Å; Y329-Y335 HydrophobicContact CE1-CD2 3.67Å; Y329-Y335 HydrophobicContact CE1-CG 4.38Å; Y329-Y335 WeakPolarHBondContact O-CB 3.15Å
330	A	92.5	Very high	91.3	Very high	48 Å²	48	61.3 Å²	61.3	40%	0.397	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-23.5	178.6	0	0	0	0	0	113.9	A326 N327 Y335	A326-A330 WeakPolarHBondContact O-CB 3.31Å; A326-A330 PolarHBondContact O-N 3Å; N327-A330 PolarHBondContact O-N 3.39Å; A330-Y335 WeakPolarHBondContact O-CD1 3.32Å
331	Q	92.9	Very high	91.7	Very high	168 Å²	168	58 Å²	58	79%	0.785	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-4.7	175.7	-66.4	175.3	6.5	0	0	113.3	N327 M328 Y329	N327-Q331 WeakPolarHBondContact O-CG 3.46Å; N327-Q331 PolarHBondContact O-N 3.18Å; N327-Q331 VanDerWaalsContact O-N 3.15Å; M328-Q331 PolarHBondContact O-N 2.61Å; Y329-Q331 PolarHBondContact O-N 2.97Å; Y329-Q331 VanDerWaalsContact O-N 3.16Å
332	S	93.5	Very high	92	Very high	12 Å²	12	56.5 Å²	56.5	8%	0.084	31%	0.307	C	S	.	.	S	Bend	trans	-75.9	152.8	-176.5	75.6	0	0	0	0	112.5	M328 Y329 L334 Y335 S336	M328-S332 PolarHBondContact O-N 2.95Å; M328-S332 VanDerWaalsContact O-N 3.16Å; Y329-S332 VanDerWaalsContact O-CB 3.26Å; Y329-S332 WeakPolarHBondContact O-CB 3.25Å; Y329-S332 PolarHBondContact O-N 3.42Å; Y329-S332 PolarHBondContact O-OG 2.92Å; S332-L334 PolarHBondContact O-N 2.96Å; S332-Y335 PolarHBondContact O-N 3.42Å; S332-Y335 PolarHBondContact OG-N 3.3Å; S332-S336 PolarHBondContact O-N 3.05Å
333	P	92.5	Very high	92.1	Very high	100 Å²	100	60.9 Å²	60.9	65%	0.649	33%	0.33	S	S	*	.	H	α-helix	trans	-59.8	-36.5	174	23.5	-33.1	0	0	0	112	Y335 S336 E337	P333-Y335 VanDerWaalsContact C-N 3.33Å; P333-Y335 PolarHBondContact O-N 3.36Å; P333-S336 WeakPolarHBondContact CA-OG 3.49Å; P333-S336 PolarHBondContact O-N 3.08Å; P333-S336 VanDerWaalsContact O-N 3.11Å; P333-S336 PolarHBondContact O-OG 3.16Å; P333-E337 PolarHBondContact O-N 3.15Å
334	L	92.1	Very high	92	Very high	32 Å²	32	66.4 Å²	66.4	17%	0.168	35%	0.351	C	S	.	.	H	α-helix	trans	-54.9	-44.6	176	-84.8	142.3	0	0	0	112.9	F259 Y269 Y329 S332 T338	F259-L334 HydrophobicContact CE2-CD1 4.06Å; Y269-L334 HydrophobicContact CD2-CD1 4.04Å; Y329-L334 HydrophobicContact CE2-CB 4.34Å; S332-L334 PolarHBondContact O-N 2.96Å; L334-T338 WeakPolarHBondContact O-CB 3.47Å; L334-T338 PolarHBondContact O-N 3.18Å; L334-T338 PolarHBondContact O-OG1 3.05Å
335	Y	93.3	Very high	91.6	Very high	40 Å²	40	61.5 Å²	61.5	16%	0.157	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-42.6	176.7	176.9	-99.7	0	0	0	111.5	Y329 A330 S332 P333 E337 T338 R339	Y329-Y335 HydrophobicContact CD1-CD2 4.25Å; Y329-Y335 AromaticContact CE1-CD2 3.67Å; Y329-Y335 HydrophobicContact CE1-CD2 3.67Å; Y329-Y335 HydrophobicContact CE1-CG 4.38Å; Y329-Y335 WeakPolarHBondContact O-CB 3.15Å; A330-Y335 WeakPolarHBondContact O-CD1 3.32Å; S332-Y335 PolarHBondContact O-N 3.42Å; S332-Y335 PolarHBondContact OG-N 3.3Å; P333-Y335 VanDerWaalsContact C-N 3.33Å; P333-Y335 PolarHBondContact O-N 3.36Å; Y335-E337 PolarHBondContact O-N 3.18Å; Y335-T338 PolarHBondContact O-N 2.78Å; Y335-R339 VanDerWaalsContact O-CB 3.22Å; Y335-R339 WeakPolarHBondContact O-CB 3.4Å; Y335-R339 PolarHBondContact O-N 2.76Å; Y335-R339 PolarHBondContact OH-NH1 3.26Å
336	S	92.8	Very high	91	Very high	70 Å²	70	63.8 Å²	63.8	49%	0.49	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-39.4	178.9	72.4	0	0	0	0	112.8	S332 P333 R339 A340	S332-S336 PolarHBondContact O-N 3.05Å; P333-S336 WeakPolarHBondContact CA-OG 3.49Å; P333-S336 PolarHBondContact O-N 3.08Å; P333-S336 VanDerWaalsContact O-N 3.11Å; P333-S336 PolarHBondContact O-OG 3.16Å; S336-R339 PolarHBondContact O-N 3.21Å; S336-A340 WeakPolarHBondContact O-CB 3.36Å; S336-A340 PolarHBondContact O-N 3.12Å
337	E	93	Very high	89.7	Confident	126 Å²	126	65.8 Å²	65.8	59%	0.589	37%	0.365	S	S	*	.	H	α-helix	trans	-67.6	-48	176.6	-175.6	179.3	-175.7	0	0	111.1	P333 Y335 R339 A340 I341	P333-E337 PolarHBondContact O-N 3.15Å; Y335-E337 PolarHBondContact O-N 3.18Å; E337-R339 PolarHBondContact O-N 3.13Å; E337-A340 PolarHBondContact O-N 3.04Å; E337-I341 HydrophobicContact CG-CD1 4.47Å; E337-I341 WeakPolarHBondContact O-CG1 3.17Å; E337-I341 PolarHBondContact O-N 2.91Å; E337-I341 VanDerWaalsContact O-N 3.13Å
338	T	93	Very high	88.4	Confident	19 Å²	19	66.9 Å²	66.9	12%	0.117	37%	0.366	C	S	.	.	H	α-helix	trans	-57.1	-43.4	175.7	-57.5	0	0	0	0	110.4	I70 L334 Y335 I341 L342	I70-T338 HydrophobicContact CD1-CG2 4.31Å; I70-T338 HydrophobicContact CG1-CG2 4.23Å; L334-T338 WeakPolarHBondContact O-CB 3.47Å; L334-T338 PolarHBondContact O-N 3.18Å; L334-T338 PolarHBondContact O-OG1 3.05Å; Y335-T338 PolarHBondContact O-N 2.78Å; T338-I341 PolarHBondContact O-N 3.45Å; T338-L342 HydrophobicContact CG2-CD1 4.05Å; T338-L342 HydrophobicContact CG2-CG 4.41Å; T338-L342 WeakPolarHBondContact O-CB 3.24Å; T338-L342 VanDerWaalsContact O-CG 3.24Å; T338-L342 WeakPolarHBondContact O-CG 3.47Å; T338-L342 PolarHBondContact O-N 2.87Å
339	R	92	Very high	86.7	Confident	107 Å²	107	66.5 Å²	66.5	40%	0.404	36%	0.364	S	S	.	.	H	α-helix	trans	-66.2	-39.6	179.3	-168.8	166.5	-178.1	176	-2.7	112.8	Y335 S336 E337 I341 L342 D343	Y335-R339 VanDerWaalsContact O-CB 3.22Å; Y335-R339 WeakPolarHBondContact O-CB 3.4Å; Y335-R339 PolarHBondContact O-N 2.76Å; Y335-R339 PolarHBondContact OH-NH1 3.26Å; S336-R339 PolarHBondContact O-N 3.21Å; E337-R339 PolarHBondContact O-N 3.13Å; R339-I341 VanDerWaalsContact C-N 3.32Å; R339-I341 PolarHBondContact O-N 2.97Å; R339-L342 WeakPolarHBondContact O-CB 3.48Å; R339-L342 PolarHBondContact O-N 3.48Å; R339-D343 VanDerWaalsContact O-CG 3.31Å; R339-D343 PolarHBondContact O-N 3.12Å
340	A	92.2	Very high	84.7	Confident	61 Å²	61	75.4 Å²	75.4	50%	0.504	40%	0.403	S	S	.	.	H	α-helix	trans	-60.2	-42	175	0	0	0	0	0	112	S336 E337 D343 Q344	S336-A340 WeakPolarHBondContact O-CB 3.36Å; S336-A340 PolarHBondContact O-N 3.12Å; E337-A340 PolarHBondContact O-N 3.04Å; A340-D343 PolarHBondContact O-N 2.85Å; A340-Q344 PolarHBondContact O-N 2.88Å
341	I	91.4	Very high	82.5	Confident	60 Å²	60	80.7 Å²	80.7	31%	0.308	42%	0.424	S	S	.	.	H	α-helix	trans	-66.7	-42	175.9	-59.5	166.7	0	0	0	110.7	I70 E337 T338 R339 Q344 L345	I70-I341 HydrophobicContact CD1-CB 3.73Å; I70-I341 HydrophobicContact CD1-CG2 3.41Å; I70-I341 VanDerWaalsContact CD1-CG2 3.41Å; E337-I341 HydrophobicContact CG-CD1 4.47Å; E337-I341 WeakPolarHBondContact O-CG1 3.17Å; E337-I341 PolarHBondContact O-N 2.91Å; E337-I341 VanDerWaalsContact O-N 3.13Å; T338-I341 PolarHBondContact O-N 3.45Å; R339-I341 VanDerWaalsContact C-N 3.32Å; R339-I341 PolarHBondContact O-N 2.97Å; I341-Q344 WeakPolarHBondContact O-CB 3.17Å; I341-Q344 PolarHBondContact O-N 3.44Å; I341-L345 HydrophobicContact CG2-CD1 4.46Å; I341-L345 WeakPolarHBondContact O-CG 3.3Å; I341-L345 PolarHBondContact O-N 3.23Å
342	L	90.9	Very high	80.2	Confident	3 Å²	3	78.3 Å²	78.3	2%	0.016	41%	0.413	C	S	.	.	H	α-helix	trans	-60.9	-44.6	176.7	-74.5	173.3	0	0	0	111.9	H40 I70 T338 R339 Q344 L345 L346	H40-L342 VanDerWaalsContact CE1-CB 3.49Å; H40-L342 WeakPolarHBondContact CE1-CB 3.5Å; H40-L342 WeakPolarHBondContact CE1-CD2 3.13Å; H40-L342 PolarHBondContact CE1-O 2.62Å; H40-L342 WeakPolarHBondContact NE2-CD2 3.21Å; I70-L342 HydrophobicContact CD1-CD2 3.98Å; I70-L342 HydrophobicContact CD1-CG 4.02Å; I70-L342 HydrophobicContact CG1-CD2 3.5Å; I70-L342 VanDerWaalsContact CG1-CD2 3.5Å; I70-L342 HydrophobicContact CG1-CG 3.94Å; T338-L342 HydrophobicContact CG2-CD1 4.05Å; T338-L342 HydrophobicContact CG2-CG 4.41Å; T338-L342 WeakPolarHBondContact O-CB 3.24Å; T338-L342 VanDerWaalsContact O-CG 3.24Å; T338-L342 WeakPolarHBondContact O-CG 3.47Å; T338-L342 PolarHBondContact O-N 2.87Å; R339-L342 WeakPolarHBondContact O-CB 3.48Å; R339-L342 PolarHBondContact O-N 3.48Å; L342-Q344 VanDerWaalsContact C-N 3.26Å; L342-Q344 PolarHBondContact O-N 3.23Å; L342-L345 PolarHBondContact O-N 2.86Å; L342-L346 PolarHBondContact O-N 3.42Å
343	D	88.1	Confident	77.7	Confident	93 Å²	93	89.5 Å²	89.5	50%	0.497	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-33.3	179.9	-70.9	-22.3	0	0	0	111.6	R339 A340 G347	R339-D343 VanDerWaalsContact O-CG 3.31Å; R339-D343 PolarHBondContact O-N 3.12Å; A340-D343 PolarHBondContact O-N 2.85Å; D343-G347 PolarHBondContact O-N 3.29Å
344	Q	86.5	Confident	75.1	Confident	136 Å²	136	89.7 Å²	89.7	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-64	-46.9	172.7	-173.5	-180	-4.3	0	0	112	A340 I341 L342 L346 G347	A340-Q344 PolarHBondContact O-N 2.88Å; I341-Q344 WeakPolarHBondContact O-CB 3.17Å; I341-Q344 PolarHBondContact O-N 3.44Å; L342-Q344 VanDerWaalsContact C-N 3.26Å; L342-Q344 PolarHBondContact O-N 3.23Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 3.01Å; Q344-G347 PolarHBondContact O-N 3.21Å
345	L	83	Confident	72.3	Confident	36 Å²	36	93.3 Å²	93.3	19%	0.188	49%	0.485	C	S	.	.	H	α-helix	trans	-64.5	-35.9	179.4	-68.5	171.8	0	0	0	112.7	I341 L342 G347	I341-L345 HydrophobicContact CG2-CD1 4.46Å; I341-L345 WeakPolarHBondContact O-CG 3.3Å; I341-L345 PolarHBondContact O-N 3.23Å; L342-L345 PolarHBondContact O-N 2.86Å; L345-G347 VanDerWaalsContact C-N 3.33Å
346	L	78.3	Confident	69.7	Low	48 Å²	48	94.1 Å²	94.1	25%	0.251	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-33.5	175	-96	159.2	0	0	0	112.7	H40 L107 L342 Q344 E348 Q349	H40-L346 HydrophobicContact CB-CD1 4.27Å; H40-L346 WeakPolarHBondContact ND1-CD1 3.31Å; L107-L346 HydrophobicContact CD1-CG 4.41Å; L342-L346 PolarHBondContact O-N 3.42Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 3.01Å; L346-E348 VanDerWaalsContact C-N 3.3Å; L346-E348 PolarHBondContact O-N 3.21Å; L346-Q349 VanDerWaalsContact O-CB 3.23Å; L346-Q349 WeakPolarHBondContact O-CB 3.4Å; L346-Q349 PolarHBondContact O-N 3.1Å
347	G	66.2	Low	67.1	Low	54 Å²	54	96.4 Å²	96.4	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-60.2	-37.8	-179.5	0	0	0	0	0	113.3	D343 Q344 L345 Q349	D343-G347 PolarHBondContact O-N 3.29Å; Q344-G347 PolarHBondContact O-N 3.21Å; L345-G347 VanDerWaalsContact C-N 3.33Å; G347-Q349 VanDerWaalsContact C-N 3.29Å; G347-Q349 PolarHBondContact O-N 3.31Å
348	E	63.9	Low	65.1	Low	128 Å²	128	98 Å²	98	60%	0.598	52%	0.518	S	S	*	.	H	α-helix	trans	-69.8	-26.5	179.8	-64.3	-178.6	169.9	0	0	112.6	L346 K350 L351	L346-E348 VanDerWaalsContact C-N 3.3Å; L346-E348 PolarHBondContact O-N 3.21Å; E348-K350 VanDerWaalsContact C-N 3.3Å; E348-K350 PolarHBondContact O-N 2.88Å; E348-L351 PolarHBondContact O-N 2.95Å
349	Q	56.9	Low	63.2	Low	48 Å²	48	100.7 Å²	100.7	22%	0.224	54%	0.535	C	S	.	.	H	α-helix	trans	-63.8	-29.6	-174.7	-157.3	-161.7	26.2	0	0	113.8	L107 P112 L346 G347 L351 E352	L107-Q349 HydrophobicContact CD2-CG 4.43Å; P112-Q349 HydrophobicContact CG-CG 4.19Å; L346-Q349 VanDerWaalsContact O-CB 3.23Å; L346-Q349 WeakPolarHBondContact O-CB 3.4Å; L346-Q349 PolarHBondContact O-N 3.1Å; G347-Q349 VanDerWaalsContact C-N 3.29Å; G347-Q349 PolarHBondContact O-N 3.31Å; Q349-L351 PolarHBondContact O-N 3.36Å; Q349-L351 VanDerWaalsContact O-N 3.11Å; Q349-E352 PolarHBondContact O-N 2.94Å
350	K	52.8	Low	61.9	Low	194 Å²	194	98.7 Å²	98.7	84%	0.843	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16	-175.1	-80.1	-175.7	-179.8	174.9	0	113.7	E348	E348-K350 VanDerWaalsContact C-N 3.3Å; E348-K350 PolarHBondContact O-N 2.88Å
351	L	48	Very low	60.9	Low	160 Å²	160	96.4 Å²	96.4	84%	0.838	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-23.3	-176.6	-119	84.8	0	0	0	114.7	E348 Q349	E348-L351 PolarHBondContact O-N 2.95Å; Q349-L351 PolarHBondContact O-N 3.36Å; Q349-L351 VanDerWaalsContact O-N 3.11Å
352	E	44.6	Very low	60.5	Low	117 Å²	117	96.8 Å²	96.8	55%	0.547	52%	0.519	S	S	.	.			trans	-134	84.1	-170.5	-71.7	-170.9	163	0	0	112.8	K111 Q349 S354	K111-E352 IonicContact NZ-OE2 3.37Å; K111-E352 PolarHBondContact NZ-OE2 3.14Å; Q349-E352 PolarHBondContact O-N 2.94Å; E352-S354 PolarHBondContact O-N 3.36Å
353	R	39.7	Very low	60.5	Low	247 Å²	247	96.8 Å²	96.8	93%	0.932	52%	0.52	S	S	*	.			trans	-89.6	80.6	157.5	-91.3	-177.7	172.6	171.6	-1.3	109.1
354	S	38.1	Very low	60.7	Low	105 Å²	105	95.8 Å²	95.8	73%	0.734	52%	0.518	S	S	*	.			trans	-80.6	130.9	168	-176.2	0	0	0	0	110.2	E352 A356	E352-S354 PolarHBondContact O-N 3.36Å; S354-A356 PolarHBondContact O-N 2.84Å; S354-A356 VanDerWaalsContact O-N 3.08Å
355	S	33.6	Very low	61	Low	107 Å²	107	92.8 Å²	92.8	75%	0.748	50%	0.503	S	S	*	.			trans	-66.2	98.6	173.8	50.4	0	0	0	0	110	V357	S355-V357 PolarHBondContact O-N 2.98Å
356	A	37.7	Very low	61.6	Low	58 Å²	58	95.6 Å²	95.6	48%	0.479	53%	0.525	S	S	.	.			trans	-68	116.7	178.2	0	0	0	0	0	110.7	A115 S354 E358	A115-A356 HydrophobicContact CB-CB 3.93Å; S354-A356 PolarHBondContact O-N 2.84Å; S354-A356 VanDerWaalsContact O-N 3.08Å; A356-E358 PolarHBondContact O-N 2.79Å
357	V	39.6	Very low	62.4	Low	117 Å²	117	95.3 Å²	95.3	71%	0.709	52%	0.522	S	S	*	.			trans	-67.1	125.7	171.7	175.8	0	0	0	0	109	S355 T359	S355-V357 PolarHBondContact O-N 2.98Å; V357-T359 VanDerWaalsContact C-N 3.29Å; V357-T359 HydrophobicContact CG1-CG2 4.43Å; V357-T359 PolarHBondContact O-N 3.36Å
358	E	51.2	Low	63.8	Low	159 Å²	159	92.7 Å²	92.7	74%	0.743	50%	0.495	S	S	*	.			trans	-70.9	70.9	179	-75.9	-175.6	135.7	0	0	112.5	A115 A356 T360	A115-E358 HydrophobicContact CB-CG 4.33Å; A356-E358 PolarHBondContact O-N 2.79Å; E358-T360 PolarHBondContact O-N 2.92Å
359	T	51.4	Low	65.3	Low	77 Å²	77	88 Å²	88	47%	0.472	47%	0.474	S	S	.	.			trans	-83.2	95.2	163	49.5	0	0	0	0	109.6	N116 V357 C361	N116-T359 VanDerWaalsContact CB-O 3.3Å; N116-T359 WeakPolarHBondContact CB-O 3.23Å; V357-T359 VanDerWaalsContact C-N 3.29Å; V357-T359 HydrophobicContact CG1-CG2 4.43Å; V357-T359 PolarHBondContact O-N 3.36Å; T359-C361 PolarHBondContact O-N 2.82Å
360	T	64.7	Low	67.2	Low	65 Å²	65	92.2 Å²	92.2	40%	0.399	49%	0.492	S	S	.	.			trans	-76	-8.2	-174.6	39.1	0	0	0	0	115.7	C119 E358	C119-T360 PolarHBondContact SG-O 2.88Å; E358-T360 PolarHBondContact O-N 2.92Å
361	C	73.2	Confident	69.3	Low	13 Å²	13	86.1 Å²	86.1	9%	0.088	46%	0.463	C	S	.	.			trans	-153.9	147.2	176	-60.2	0	0	0	0	112.5	T359 Q368 R457	T359-C361 PolarHBondContact O-N 2.82Å; C361-Q368 PolarHBondContact SG-NE2 3.48Å; C361-R457 HydrophobicContact CB-CG 4.43Å; C361-R457 VanDerWaalsContact SG-CG 3.57Å; C361-R457 PolarHBondContact SG-N 2.84Å
362	V	82.8	Confident	71.5	Confident	67 Å²	67	78.8 Å²	78.8	41%	0.406	43%	0.425	S	S	.	.	S	Bend	trans	-71.1	-30.9	179.4	-178.2	0	0	0	0	112.9	P149	P149-V362 HydrophobicContact CB-CG1 4.23Å; P149-V362 HydrophobicContact CG-CG1 3.83Å
363	T	90.1	Very high	73.9	Confident	4 Å²	4	75.1 Å²	75.1	3%	0.025	41%	0.409	C	S	.	.	S	Bend	trans	-106.2	153.9	-174	53.7	0	0	0	0	113.1	L146 V150 Q368	L146-T363 WeakPolarHBondContact O-CG2 3.42Å; L146-T363 PolarHBondContact O-OG1 3.29Å; V150-T363 HydrophobicContact CG2-CG2 3.95Å; T363-Q368 PolarHBondContact O-NE2 3Å; T363-Q368 WeakPolarHBondContact OG1-CG 3.24Å; T363-Q368 PolarHBondContact OG1-NE2 3.39Å
364	P	92.6	Very high	76.4	Confident	71 Å²	71	66 Å²	66	46%	0.461	38%	0.382	S	S	.	.			trans	-76.1	157.2	-179.5	30.5	-34.4	0	0	0	112.6	V150 C366 H367 Q368	V150-P364 HydrophobicContact CG2-CG 4.32Å; P364-C366 PolarHBondContact O-N 2.84Å; P364-H367 HydrophobicContact CG-CB 3.85Å; P364-H367 WeakPolarHBondContact O-CB 3.21Å; P364-H367 PolarHBondContact O-N 2.83Å; P364-H367 VanDerWaalsContact O-N 3.1Å; P364-Q368 WeakPolarHBondContact O-CG 3.45Å; P364-Q368 PolarHBondContact O-N 3.49Å; P364-Q368 VanDerWaalsContact O-N 3.08Å
365	F	93.4	Very high	79	Confident	74 Å²	74	61.4 Å²	61.4	33%	0.325	35%	0.349	S	S	.	.	H	α-helix	trans	-49.6	-51.5	-177	171.7	-97.2	0	0	0	113.8	H367 Q368 L369 S460 F463	F365-H367 VanDerWaalsContact C-N 3.28Å; F365-H367 PolarHBondContact O-N 3.47Å; F365-Q368 WeakPolarHBondContact O-CB 3.48Å; F365-Q368 PolarHBondContact O-N 2.93Å; F365-L369 HydrophobicContact CE1-CD2 4.05Å; F365-L369 HydrophobicContact CZ-CD2 4.21Å; F365-L369 WeakPolarHBondContact O-CB 3.3Å; F365-L369 PolarHBondContact O-N 3.34Å; F365-S460 WeakPolarHBondContact CD2-OG 3.24Å; F365-F463 HydrophobicContact CE2-CD2 4.17Å; F365-F463 AromaticContact CZ-CD2 3.92Å; F365-F463 HydrophobicContact CZ-CD2 3.92Å
366	C	95	Very high	81.7	Confident	95 Å²	95	56.6 Å²	56.6	64%	0.642	32%	0.315	S	S	*	.	H	α-helix	trans	-63.9	-33.8	-177	-63.4	0	0	0	0	112.8	P364 K370	P364-C366 PolarHBondContact O-N 2.84Å; C366-K370 WeakPolarHBondContact O-CB 3.13Å; C366-K370 PolarHBondContact O-N 3.19Å
367	H	95	Very high	84.1	Confident	41 Å²	41	58.1 Å²	58.1	19%	0.19	31%	0.312	C	S	.	.	H	α-helix	trans	-68.9	-43.9	176.3	-176.4	86.1	0	0	0	110.7	A145 P364 F365 K370 W371	A145-H367 PolarHBondContact O-CD2 2.86Å; A145-H367 PolarHBondContact O-NE2 3.43Å; P364-H367 HydrophobicContact CG-CB 3.85Å; P364-H367 WeakPolarHBondContact O-CB 3.21Å; P364-H367 PolarHBondContact O-N 2.83Å; P364-H367 VanDerWaalsContact O-N 3.1Å; F365-H367 VanDerWaalsContact C-N 3.28Å; F365-H367 PolarHBondContact O-N 3.47Å; H367-K370 PolarHBondContact O-N 2.69Å; H367-W371 AromaticContact CD2-CD1 3.88Å; H367-W371 AromaticContact CE1-CD1 3.66Å; H367-W371 AromaticContact CE1-NE1 3.37Å; H367-W371 PolarHBondContact CE1-NE1 3.44Å; H367-W371 AromaticContact NE2-CD1 3.52Å; H367-W371 AromaticContact NE2-NE1 3.55Å; H367-W371 PolarHBondContact O-N 3Å
368	Q	95.5	Very high	86.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-51	174.6	-63.7	175.9	-2.7	0	0	111.4	L146 C361 T363 P364 F365 K370 W371 I372 R457 S460	L146-Q368 HydrophobicContact CD2-CB 4.21Å; L146-Q368 HydrophobicContact CD2-CG 4.11Å; C361-Q368 PolarHBondContact SG-NE2 3.48Å; T363-Q368 PolarHBondContact O-NE2 3Å; T363-Q368 WeakPolarHBondContact OG1-CG 3.24Å; T363-Q368 PolarHBondContact OG1-NE2 3.39Å; P364-Q368 WeakPolarHBondContact O-CG 3.45Å; P364-Q368 PolarHBondContact O-N 3.49Å; P364-Q368 VanDerWaalsContact O-N 3.08Å; F365-Q368 WeakPolarHBondContact O-CB 3.48Å; F365-Q368 PolarHBondContact O-N 2.93Å; Q368-K370 VanDerWaalsContact C-N 3.33Å; Q368-K370 PolarHBondContact O-N 3.05Å; Q368-W371 PolarHBondContact O-N 3.31Å; Q368-I372 WeakPolarHBondContact O-CD1 3.45Å; Q368-I372 VanDerWaalsContact O-CG1 3.24Å; Q368-I372 WeakPolarHBondContact O-CG1 3.15Å; Q368-I372 PolarHBondContact O-N 2.91Å; Q368-R457 VanDerWaalsContact OE1-N 3.13Å; Q368-S460 PolarHBondContact OE1-OG 3.3Å
369	L	95.8	Very high	88.1	Confident	29 Å²	29	48.5 Å²	48.5	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-55.3	-47.7	179.3	-178	64.7	0	0	0	111.6	F365 W371 I372 I373 F463 G464	F365-L369 HydrophobicContact CE1-CD2 4.05Å; F365-L369 HydrophobicContact CZ-CD2 4.21Å; F365-L369 WeakPolarHBondContact O-CB 3.3Å; F365-L369 PolarHBondContact O-N 3.34Å; L369-W371 PolarHBondContact O-N 2.82Å; L369-I372 PolarHBondContact O-N 2.82Å; L369-I373 HydrophobicContact CD1-CD1 3.98Å; L369-I373 HydrophobicContact CD1-CG1 4.37Å; L369-I373 HydrophobicContact CG-CD1 3.84Å; L369-I373 WeakPolarHBondContact O-CB 3.43Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.44Å; L369-I373 PolarHBondContact O-N 3.32Å; L369-F463 HydrophobicContact CD1-CB 3.94Å; L369-G464 VanDerWaalsContact CD1-CA 3.41Å; L369-G464 VanDerWaalsContact CD1-N 3.26Å
370	K	96.3	Very high	89.5	Confident	137 Å²	137	47.7 Å²	47.7	60%	0.596	25%	0.249	S	C	*	.	H	α-helix	trans	-57.9	-45.6	179	178.4	179.2	177.5	174.8	0	112.4	C366 H367 Q368 C374	C366-K370 WeakPolarHBondContact O-CB 3.13Å; C366-K370 PolarHBondContact O-N 3.19Å; H367-K370 PolarHBondContact O-N 2.69Å; Q368-K370 VanDerWaalsContact C-N 3.33Å; Q368-K370 PolarHBondContact O-N 3.05Å; K370-C374 WeakPolarHBondContact O-CB 3.27Å; K370-C374 PolarHBondContact O-N 3.03Å
371	W	95.9	Very high	90.3	Very high	65 Å²	65	52.7 Å²	52.7	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-71.8	-37.8	-178.7	-84.6	98	0	0	0	112.5	F142 A145 L146 H367 Q368 L369 I373 C374 Q375	F142-W371 HydrophobicContact CD2-CB 4.43Å; F142-W371 HydrophobicContact CD2-CE3 4.43Å; F142-W371 HydrophobicContact CE2-CB 4.3Å; A145-W371 HydrophobicContact CB-CD2 3.43Å; A145-W371 VanDerWaalsContact CB-CD2 3.43Å; A145-W371 HydrophobicContact CB-CE3 3.85Å; A145-W371 HydrophobicContact CB-CG 3.9Å; A145-W371 HydrophobicContact CB-CH2 3.9Å; A145-W371 HydrophobicContact CB-CZ2 3.51Å; A145-W371 HydrophobicContact CB-CZ3 4.06Å; L146-W371 HydrophobicContact CD2-CB 3.81Å; L146-W371 HydrophobicContact CD2-CG 4.35Å; L146-W371 HydrophobicContact CG-CB 4.27Å; H367-W371 AromaticContact CD2-CD1 3.88Å; H367-W371 AromaticContact CE1-CD1 3.66Å; H367-W371 AromaticContact CE1-NE1 3.37Å; H367-W371 PolarHBondContact CE1-NE1 3.44Å; H367-W371 AromaticContact NE2-CD1 3.52Å; H367-W371 AromaticContact NE2-NE1 3.55Å; H367-W371 PolarHBondContact O-N 3Å; Q368-W371 PolarHBondContact O-N 3.31Å; L369-W371 PolarHBondContact O-N 2.82Å; W371-I373 VanDerWaalsContact C-N 3.34Å; W371-C374 PolarHBondContact O-N 3.17Å; W371-Q375 VanDerWaalsContact O-CB 3.26Å; W371-Q375 WeakPolarHBondContact O-CB 3.44Å; W371-Q375 PolarHBondContact O-N 3.2Å
372	I	95.2	Very high	90.4	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-46.7	173.8	-66.3	163.4	0	0	0	110.1	F142 Q368 L369 C374 Q375 S376 Y456	F142-I372 HydrophobicContact CZ-CG1 4.41Å; Q368-I372 WeakPolarHBondContact O-CD1 3.45Å; Q368-I372 VanDerWaalsContact O-CG1 3.24Å; Q368-I372 WeakPolarHBondContact O-CG1 3.15Å; Q368-I372 PolarHBondContact O-N 2.91Å; L369-I372 PolarHBondContact O-N 2.82Å; I372-C374 PolarHBondContact O-N 2.76Å; I372-Q375 PolarHBondContact O-N 2.99Å; I372-S376 WeakPolarHBondContact O-CB 3.46Å; I372-S376 PolarHBondContact O-N 3.42Å; I372-S376 PolarHBondContact O-OG 2.84Å; I372-Y456 HydrophobicContact CD1-CD1 3.66Å; I372-Y456 HydrophobicContact CD1-CD2 4.47Å; I372-Y456 HydrophobicContact CD1-CE1 4.25Å; I372-Y456 HydrophobicContact CD1-CG 3.78Å; I372-Y456 HydrophobicContact CG1-CD1 3.92Å; I372-Y456 HydrophobicContact CG1-CE1 4.27Å
373	I	94.1	Very high	90.1	Very high	40 Å²	40	55 Å²	55	21%	0.205	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-49	177	-67.9	168.4	0	0	0	110.7	L369 W371 Q375 S376 F377 L467 A468	L369-I373 HydrophobicContact CD1-CD1 3.98Å; L369-I373 HydrophobicContact CD1-CG1 4.37Å; L369-I373 HydrophobicContact CG-CD1 3.84Å; L369-I373 WeakPolarHBondContact O-CB 3.43Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.44Å; L369-I373 PolarHBondContact O-N 3.32Å; W371-I373 VanDerWaalsContact C-N 3.34Å; I373-Q375 VanDerWaalsContact C-N 3.32Å; I373-Q375 PolarHBondContact O-N 2.74Å; I373-S376 PolarHBondContact O-N 2.85Å; I373-F377 HydrophobicContact CG2-CD2 3.69Å; I373-F377 HydrophobicContact CG2-CE2 3.58Å; I373-F377 VanDerWaalsContact O-CD2 3.24Å; I373-F377 WeakPolarHBondContact O-CD2 3.34Å; I373-F377 PolarHBondContact O-N 3.41Å; I373-L467 HydrophobicContact CD1-CB 4.21Å; I373-L467 HydrophobicContact CD1-CD1 4.08Å; I373-L467 HydrophobicContact CG1-CB 4.48Å; I373-A468 HydrophobicContact CB-CB 4.18Å; I373-A468 HydrophobicContact CG1-CB 4.12Å; I373-A468 HydrophobicContact CG2-CB 4.07Å
374	C	94.1	Very high	89.4	Confident	55 Å²	55	58 Å²	58	37%	0.372	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-44	179.1	-171.9	0	0	0	0	111.8	K370 W371 I372 F377 K378	K370-C374 WeakPolarHBondContact O-CB 3.27Å; K370-C374 PolarHBondContact O-N 3.03Å; W371-C374 PolarHBondContact O-N 3.17Å; I372-C374 PolarHBondContact O-N 2.76Å; C374-F377 PolarHBondContact O-N 2.89Å; C374-K378 WeakPolarHBondContact O-CG 3.34Å; C374-K378 PolarHBondContact O-N 3.35Å
375	Q	92.6	Very high	89	Confident	9 Å²	9	63.7 Å²	63.7	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-65.4	-42	179.2	-166.4	68.6	-0.6	0	0	111.9	L131 F142 W371 I372 I373 F377 K378 N379	L131-Q375 HydrophobicContact CD2-CG 4.15Å; F142-Q375 HydrophobicContact CD2-CB 3.71Å; F142-Q375 HydrophobicContact CD2-CG 3.76Å; F142-Q375 HydrophobicContact CE2-CB 3.66Å; F142-Q375 HydrophobicContact CE2-CG 3.92Å; F142-Q375 HydrophobicContact CG-CG 4.19Å; F142-Q375 HydrophobicContact CZ-CG 4.47Å; W371-Q375 VanDerWaalsContact O-CB 3.26Å; W371-Q375 WeakPolarHBondContact O-CB 3.44Å; W371-Q375 PolarHBondContact O-N 3.2Å; I372-Q375 PolarHBondContact O-N 2.99Å; I373-Q375 VanDerWaalsContact C-N 3.32Å; I373-Q375 PolarHBondContact O-N 2.74Å; Q375-F377 VanDerWaalsContact C-N 3.32Å; Q375-F377 PolarHBondContact O-N 3.05Å; Q375-K378 PolarHBondContact O-N 3.37Å; Q375-N379 WeakPolarHBondContact O-CB 3.29Å; Q375-N379 PolarHBondContact O-N 2.74Å
376	S	90	Very high	88.4	Confident	6 Å²	6	64.7 Å²	64.7	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-37.9	174	-81	0	0	0	0	112.3	I372 I373 N379 F380 A468 E469	I372-S376 WeakPolarHBondContact O-CB 3.46Å; I372-S376 PolarHBondContact O-N 3.42Å; I372-S376 PolarHBondContact O-OG 2.84Å; I373-S376 PolarHBondContact O-N 2.85Å; S376-N379 WeakPolarHBondContact O-CB 3.45Å; S376-N379 PolarHBondContact O-N 3.24Å; S376-F380 WeakPolarHBondContact O-CB 3.21Å; S376-F380 PolarHBondContact O-N 3.12Å; S376-A468 VanDerWaalsContact CB-CB 3.44Å; S376-E469 PolarHBondContact OG-OE1 3.05Å
377	F	88.2	Confident	87.7	Confident	91 Å²	91	62.1 Å²	62.1	40%	0.399	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-37.2	172.8	-83.3	-67.7	0	0	0	113.1	I373 C374 Q375 F380 K381 P472	I373-F377 HydrophobicContact CG2-CD2 3.69Å; I373-F377 HydrophobicContact CG2-CE2 3.58Å; I373-F377 VanDerWaalsContact O-CD2 3.24Å; I373-F377 WeakPolarHBondContact O-CD2 3.34Å; I373-F377 PolarHBondContact O-N 3.41Å; C374-F377 PolarHBondContact O-N 2.89Å; Q375-F377 VanDerWaalsContact C-N 3.32Å; Q375-F377 PolarHBondContact O-N 3.05Å; F377-F380 WeakPolarHBondContact O-CB 3.35Å; F377-F380 PolarHBondContact O-N 3.46Å; F377-K381 PolarHBondContact O-N 3.26Å; F377-K381 VanDerWaalsContact O-N 3.12Å; F377-P472 HydrophobicContact CE1-CB 4.46Å; F377-P472 HydrophobicContact CE1-CG 4.1Å; F377-P472 HydrophobicContact CZ-CG 4Å
378	K	89.3	Confident	87.3	Confident	56 Å²	56	63.4 Å²	63.4	24%	0.243	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-44	172.6	-72	-176.6	179.6	-173.4	0	111.2	V134 D138 E141 C374 Q375 F380 K381 G382	V134-K378 HydrophobicContact CG1-CB 3.84Å; D138-K378 IonicContact OD1-NZ 3.32Å; D138-K378 PolarHBondContact OD1-NZ 2.91Å; E141-K378 IonicContact OE2-NZ 3.52Å; C374-K378 WeakPolarHBondContact O-CG 3.34Å; C374-K378 PolarHBondContact O-N 3.35Å; Q375-K378 PolarHBondContact O-N 3.37Å; K378-F380 VanDerWaalsContact C-N 3.27Å; K378-F380 PolarHBondContact O-N 2.98Å; K378-K381 PolarHBondContact O-N 3.2Å; K378-G382 PolarHBondContact O-N 3.39Å
379	N	85.9	Confident	86.9	Confident	18 Å²	18	67.8 Å²	67.8	10%	0.096	33%	0.33	C	S	.	.	H	α-helix	trans	-55.8	-44.7	174.9	-175.6	26.3	0	0	0	111.2	L131 T133 Q375 S376 G382	L131-N379 HydrophobicContact CD2-CB 4.09Å; T133-N379 WeakPolarHBondContact CB-OD1 3.4Å; T133-N379 WeakPolarHBondContact CG2-OD1 3.41Å; T133-N379 PolarHBondContact OG1-OD1 2.54Å; Q375-N379 WeakPolarHBondContact O-CB 3.29Å; Q375-N379 PolarHBondContact O-N 2.74Å; S376-N379 WeakPolarHBondContact O-CB 3.45Å; S376-N379 PolarHBondContact O-N 3.24Å; N379-G382 VanDerWaalsContact O-CA 3.29Å; N379-G382 WeakPolarHBondContact O-CA 3.49Å; N379-G382 PolarHBondContact O-N 3.19Å
380	F	79.9	Confident	86.4	Confident	60 Å²	60	70.2 Å²	70.2	26%	0.263	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-45.8	178	179.4	-102	0	0	0	112.9	S376 F377 K378 G382 F383 T387	S376-F380 WeakPolarHBondContact O-CB 3.21Å; S376-F380 PolarHBondContact O-N 3.12Å; F377-F380 WeakPolarHBondContact O-CB 3.35Å; F377-F380 PolarHBondContact O-N 3.46Å; K378-F380 VanDerWaalsContact C-N 3.27Å; K378-F380 PolarHBondContact O-N 2.98Å; F380-G382 PolarHBondContact O-N 2.73Å; F380-F383 PolarHBondContact O-N 2.98Å; F380-T387 HydrophobicContact CE1-CG2 4.15Å; F380-T387 HydrophobicContact CE2-CG2 3.57Å; F380-T387 WeakPolarHBondContact CE2-OG1 3.43Å; F380-T387 HydrophobicContact CZ-CG2 3.18Å
381	K	81.3	Confident	85.9	Confident	170 Å²	170	66 Å²	66	74%	0.739	33%	0.332	S	S	*	.	H	α-helix	trans	-61.3	-15.3	172.1	-69.9	-176.1	178.6	-175.1	0	113	F377 K378 F383 P384	F377-K381 PolarHBondContact O-N 3.26Å; F377-K381 VanDerWaalsContact O-N 3.12Å; K378-K381 PolarHBondContact O-N 3.2Å; K381-F383 VanDerWaalsContact C-N 3.3Å; K381-P384 WeakPolarHBondContact O-CD 3.48Å
382	G	75.3	Confident	85.7	Confident	13 Å²	13	67.3 Å²	67.3	13%	0.134	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.4	173.7	0	0	0	0	0	114.6	K378 N379 F380 P384	K378-G382 PolarHBondContact O-N 3.39Å; N379-G382 VanDerWaalsContact O-CA 3.29Å; N379-G382 WeakPolarHBondContact O-CA 3.49Å; N379-G382 PolarHBondContact O-N 3.19Å; F380-G382 PolarHBondContact O-N 2.73Å; G382-P384 VanDerWaalsContact C-CD 3.5Å
383	F	76.7	Confident	85.5	Confident	114 Å²	114	71.9 Å²	71.9	50%	0.5	37%	0.366	S	S	.	.			trans	-128.1	58.5	-179.2	-63	-73.3	0	0	0	112.7	T133 F380 K381 W385 V386	T133-F383 HydrophobicContact CG2-CD2 4.11Å; T133-F383 HydrophobicContact CG2-CE1 4.48Å; T133-F383 HydrophobicContact CG2-CE2 3.19Å; T133-F383 HydrophobicContact CG2-CZ 3.41Å; T133-F383 VanDerWaalsContact CG2-CZ 3.41Å; F380-F383 PolarHBondContact O-N 2.98Å; K381-F383 VanDerWaalsContact C-N 3.3Å; F383-W385 VanDerWaalsContact C-N 3.29Å; F383-W385 PolarHBondContact O-N 2.9Å; F383-V386 HydrophobicContact CB-CG2 4.45Å; F383-V386 PolarHBondContact O-N 3.36Å
384	P	75.9	Confident	85.3	Confident	67 Å²	67	70.8 Å²	70.8	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-38.8	-172.4	26.2	-33.4	0	0	0	112	K381 G382 V386 T387 V388	K381-P384 WeakPolarHBondContact O-CD 3.48Å; G382-P384 VanDerWaalsContact C-CD 3.5Å; P384-V386 PolarHBondContact O-N 2.89Å; P384-T387 PolarHBondContact O-N 3.4Å; P384-V388 WeakPolarHBondContact O-CB 3.26Å; P384-V388 WeakPolarHBondContact O-CG2 3.19Å; P384-V388 PolarHBondContact O-N 3.47Å
385	W	82.9	Confident	85.3	Confident	192 Å²	192	71.2 Å²	71.2	73%	0.727	36%	0.362	S	S	*	.	H	α-helix	trans	-64.2	-40.2	-176.3	-66.9	116.4	0	0	0	113.7	F383 T387 V388 I389	F383-W385 VanDerWaalsContact C-N 3.29Å; F383-W385 PolarHBondContact O-N 2.9Å; W385-T387 PolarHBondContact O-N 3.47Å; W385-V388 PolarHBondContact O-N 2.98Å; W385-I389 WeakPolarHBondContact O-CB 3.49Å; W385-I389 WeakPolarHBondContact O-CD1 3.27Å; W385-I389 WeakPolarHBondContact O-CG1 3.43Å; W385-I389 PolarHBondContact O-N 3.32Å
386	V	81.9	Confident	85.4	Confident	94 Å²	94	75.8 Å²	75.8	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-62.9	-46.6	-180	178.8	0	0	0	0	110.1	F383 P384 Q390	F383-V386 HydrophobicContact CB-CG2 4.45Å; F383-V386 PolarHBondContact O-N 3.36Å; P384-V386 PolarHBondContact O-N 2.89Å; V386-Q390 WeakPolarHBondContact O-CB 3.34Å; V386-Q390 PolarHBondContact O-N 3.31Å
387	T	80.3	Confident	85.5	Confident	41 Å²	41	79.4 Å²	79.4	25%	0.252	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-43.7	177.6	-52.6	0	0	0	0	112.1	F380 P384 W385 I389 Q390 A391	F380-T387 HydrophobicContact CE1-CG2 4.15Å; F380-T387 HydrophobicContact CE2-CG2 3.57Å; F380-T387 WeakPolarHBondContact CE2-OG1 3.43Å; F380-T387 HydrophobicContact CZ-CG2 3.18Å; P384-T387 PolarHBondContact O-N 3.4Å; W385-T387 PolarHBondContact O-N 3.47Å; T387-I389 PolarHBondContact O-N 3.41Å; T387-Q390 PolarHBondContact O-N 3.26Å; T387-A391 WeakPolarHBondContact O-CB 3.38Å; T387-A391 PolarHBondContact O-N 2.99Å
388	V	85.2	Confident	85.7	Confident	68 Å²	68	75.1 Å²	75.1	41%	0.412	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-46.7	179.8	168.6	0	0	0	0	110.6	P384 W385 Q390 A391 I392	P384-V388 WeakPolarHBondContact O-CB 3.26Å; P384-V388 WeakPolarHBondContact O-CG2 3.19Å; P384-V388 PolarHBondContact O-N 3.47Å; W385-V388 PolarHBondContact O-N 2.98Å; V388-Q390 VanDerWaalsContact C-N 3.35Å; V388-Q390 PolarHBondContact O-N 2.67Å; V388-A391 PolarHBondContact O-N 3.38Å; V388-I392 HydrophobicContact CG1-CD1 3.79Å; V388-I392 VanDerWaalsContact O-CG1 3.31Å; V388-I392 WeakPolarHBondContact O-CG1 3.22Å; V388-I392 PolarHBondContact O-N 2.99Å
389	I	88	Confident	85.9	Confident	93 Å²	93	75.1 Å²	75.1	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-45.6	177.5	-69.4	166	0	0	0	110.5	W385 T387 A391 I392 I393	W385-I389 WeakPolarHBondContact O-CB 3.49Å; W385-I389 WeakPolarHBondContact O-CD1 3.27Å; W385-I389 WeakPolarHBondContact O-CG1 3.43Å; W385-I389 PolarHBondContact O-N 3.32Å; T387-I389 PolarHBondContact O-N 3.41Å; I389-A391 VanDerWaalsContact C-N 3.32Å; I389-A391 PolarHBondContact O-N 3Å; I389-I392 PolarHBondContact O-N 3.13Å; I389-I393 HydrophobicContact CG2-CD1 3.68Å; I389-I393 HydrophobicContact CG2-CG1 4.37Å; I389-I393 WeakPolarHBondContact O-CG1 3.42Å; I389-I393 PolarHBondContact O-N 2.92Å
390	Q	85.2	Confident	86.2	Confident	80 Å²	80	76.7 Å²	76.7	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-43.2	177.4	-173.2	-177.3	-8	0	0	111.6	V386 T387 V388 I393 T394	V386-Q390 WeakPolarHBondContact O-CB 3.34Å; V386-Q390 PolarHBondContact O-N 3.31Å; T387-Q390 PolarHBondContact O-N 3.26Å; V388-Q390 VanDerWaalsContact C-N 3.35Å; V388-Q390 PolarHBondContact O-N 2.67Å; Q390-I393 PolarHBondContact O-N 3.47Å; Q390-T394 WeakPolarHBondContact O-CB 3.38Å; Q390-T394 PolarHBondContact O-N 3.4Å; Q390-T394 PolarHBondContact O-OG1 3.41Å
391	A	86.5	Confident	86.7	Confident	49 Å²	49	75.1 Å²	75.1	41%	0.405	40%	0.401	S	S	.	.	H	α-helix	trans	-63.5	-43.6	177.7	0	0	0	0	0	111.9	T387 V388 I389 T394 V395	T387-A391 WeakPolarHBondContact O-CB 3.38Å; T387-A391 PolarHBondContact O-N 2.99Å; V388-A391 PolarHBondContact O-N 3.38Å; I389-A391 VanDerWaalsContact C-N 3.32Å; I389-A391 PolarHBondContact O-N 3Å; A391-T394 PolarHBondContact O-N 3.01Å; A391-V395 WeakPolarHBondContact O-CG2 3.33Å; A391-V395 PolarHBondContact O-N 2.85Å
392	I	91.3	Very high	87.2	Confident	92 Å²	92	67 Å²	67	47%	0.472	37%	0.365	S	S	.	.	H	α-helix	trans	-61	-50.3	177.5	-68.5	166.2	0	0	0	110.8	V388 I389 T394 V395 I396	V388-I392 HydrophobicContact CG1-CD1 3.79Å; V388-I392 VanDerWaalsContact O-CG1 3.31Å; V388-I392 WeakPolarHBondContact O-CG1 3.22Å; V388-I392 PolarHBondContact O-N 2.99Å; I389-I392 PolarHBondContact O-N 3.13Å; I392-T394 VanDerWaalsContact C-N 3.28Å; I392-T394 PolarHBondContact O-N 3.46Å; I392-V395 PolarHBondContact O-N 2.85Å; I392-I396 HydrophobicContact CG2-CD1 3.72Å; I392-I396 HydrophobicContact CG2-CG1 4.45Å; I392-I396 WeakPolarHBondContact O-CG1 3.33Å; I392-I396 PolarHBondContact O-N 3.32Å
393	I	91.2	Very high	87.9	Confident	101 Å²	101	70.2 Å²	70.2	52%	0.518	38%	0.382	S	S	.	.	H	α-helix	trans	-58.7	-43.2	177.9	-67.6	169.6	0	0	0	110.6	I389 Q390 V395 I396 L397	I389-I393 HydrophobicContact CG2-CD1 3.68Å; I389-I393 HydrophobicContact CG2-CG1 4.37Å; I389-I393 WeakPolarHBondContact O-CG1 3.42Å; I389-I393 PolarHBondContact O-N 2.92Å; Q390-I393 PolarHBondContact O-N 3.47Å; I393-V395 PolarHBondContact O-N 2.73Å; I393-I396 PolarHBondContact O-N 2.9Å; I393-L397 WeakPolarHBondContact O-CB 3.24Å; I393-L397 PolarHBondContact O-N 3.3Å
394	T	90.3	Very high	88.4	Confident	17 Å²	17	68.3 Å²	68.3	10%	0.104	39%	0.387	C	S	.	.	H	α-helix	trans	-59.6	-45.2	178.5	-54.6	0	0	0	0	111.6	Q390 A391 I392 A398 P477 F481	Q390-T394 WeakPolarHBondContact O-CB 3.38Å; Q390-T394 PolarHBondContact O-N 3.4Å; Q390-T394 PolarHBondContact O-OG1 3.41Å; A391-T394 PolarHBondContact O-N 3.01Å; I392-T394 VanDerWaalsContact C-N 3.28Å; I392-T394 PolarHBondContact O-N 3.46Å; T394-A398 VanDerWaalsContact O-CB 3.28Å; T394-A398 WeakPolarHBondContact O-CB 3.38Å; T394-A398 PolarHBondContact O-N 3.32Å; T394-P477 HydrophobicContact CG2-CB 4.36Å; T394-P477 WeakPolarHBondContact CG2-O 3.35Å; T394-F481 HydrophobicContact CG2-CB 3.75Å; T394-F481 HydrophobicContact CG2-CD2 4.37Å
395	V	93	Very high	88.9	Confident	64 Å²	64	66.8 Å²	66.8	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-46	178.9	171.2	0	0	0	0	111.2	A391 I392 I393 L397 A398 T399 I484	A391-V395 WeakPolarHBondContact O-CG2 3.33Å; A391-V395 PolarHBondContact O-N 2.85Å; I392-V395 PolarHBondContact O-N 2.85Å; I393-V395 PolarHBondContact O-N 2.73Å; V395-L397 PolarHBondContact O-N 2.86Å; V395-A398 PolarHBondContact O-N 2.99Å; V395-T399 HydrophobicContact CG1-CG2 4.5Å; V395-T399 WeakPolarHBondContact O-CG2 3.41Å; V395-T399 PolarHBondContact O-N 3.01Å; V395-T399 PolarHBondContact O-OG1 2.8Å; V395-I484 HydrophobicContact CB-CD1 4.46Å; V395-I484 HydrophobicContact CG1-CD1 4.35Å; V395-I484 HydrophobicContact CG2-CD1 3.98Å
396	I	94.6	Very high	88.5	Confident	105 Å²	105	66.4 Å²	66.4	54%	0.538	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-49.4	179	-68.4	168.3	0	0	0	110.3	I392 I393 A398 T399 A400	I392-I396 HydrophobicContact CG2-CD1 3.72Å; I392-I396 HydrophobicContact CG2-CG1 4.45Å; I392-I396 WeakPolarHBondContact O-CG1 3.33Å; I392-I396 PolarHBondContact O-N 3.32Å; I393-I396 PolarHBondContact O-N 2.9Å; I396-A398 PolarHBondContact O-N 3.31Å; I396-T399 WeakPolarHBondContact CA-OG1 3.43Å; I396-T399 PolarHBondContact O-N 3.07Å; I396-T399 PolarHBondContact O-OG1 2.67Å; I396-A400 WeakPolarHBondContact O-CB 3.3Å; I396-A400 PolarHBondContact O-N 3.39Å
397	L	91.7	Very high	87.7	Confident	83 Å²	83	67.2 Å²	67.2	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-42.8	179.6	-171	65.3	0	0	0	111.5	I393 V395 T399 A400 V401 F428 F481	I393-L397 WeakPolarHBondContact O-CB 3.24Å; I393-L397 PolarHBondContact O-N 3.3Å; V395-L397 PolarHBondContact O-N 2.86Å; L397-T399 VanDerWaalsContact C-N 3.33Å; L397-T399 PolarHBondContact O-N 3.18Å; L397-A400 PolarHBondContact O-N 2.61Å; L397-V401 HydrophobicContact CD1-CG2 4.48Å; L397-V401 HydrophobicContact CG-CG2 4.49Å; L397-V401 WeakPolarHBondContact O-CG2 3.41Å; L397-V401 PolarHBondContact O-N 3.37Å; L397-F428 HydrophobicContact CD2-CE2 4.08Å; L397-F481 HydrophobicContact CB-CE2 4.2Å; L397-F481 HydrophobicContact CD2-CE2 4.09Å; L397-F481 HydrophobicContact CG-CE2 3.9Å
398	A	93.4	Very high	87.2	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-42.1	177.1	0	0	0	0	0	112	T394 V395 I396 G402 F481 I484 T485	T394-A398 VanDerWaalsContact O-CB 3.28Å; T394-A398 WeakPolarHBondContact O-CB 3.38Å; T394-A398 PolarHBondContact O-N 3.32Å; V395-A398 PolarHBondContact O-N 2.99Å; I396-A398 PolarHBondContact O-N 3.31Å; A398-G402 PolarHBondContact O-N 2.93Å; A398-F481 VanDerWaalsContact CA-CE2 3.47Å; A398-F481 HydrophobicContact CB-CB 4.46Å; A398-F481 HydrophobicContact CB-CD2 3.5Å; A398-F481 VanDerWaalsContact CB-CD2 3.5Å; A398-F481 HydrophobicContact CB-CE2 3.91Å; A398-F481 HydrophobicContact CB-CG 4.14Å; A398-I484 HydrophobicContact CB-CB 3.78Å; A398-I484 HydrophobicContact CB-CD1 4.33Å; A398-I484 HydrophobicContact CB-CG2 3.69Å; A398-T485 PolarHBondContact O-OG1 3.49Å
399	T	93.8	Very high	86.4	Confident	57 Å²	57	69.4 Å²	69.4	35%	0.35	38%	0.379	S	S	.	.	H	α-helix	trans	-65	-44.3	175.7	48.6	0	0	0	0	111.9	V395 I396 L397 G402 T403 I484 I488	V395-T399 HydrophobicContact CG1-CG2 4.5Å; V395-T399 WeakPolarHBondContact O-CG2 3.41Å; V395-T399 PolarHBondContact O-N 3.01Å; V395-T399 PolarHBondContact O-OG1 2.8Å; I396-T399 WeakPolarHBondContact CA-OG1 3.43Å; I396-T399 PolarHBondContact O-N 3.07Å; I396-T399 PolarHBondContact O-OG1 2.67Å; L397-T399 VanDerWaalsContact C-N 3.33Å; L397-T399 PolarHBondContact O-N 3.18Å; T399-G402 PolarHBondContact O-N 3.39Å; T399-T403 WeakPolarHBondContact O-CB 3.45Å; T399-T403 VanDerWaalsContact O-CG2 3.27Å; T399-T403 WeakPolarHBondContact O-CG2 3.44Å; T399-T403 PolarHBondContact O-N 3.38Å; T399-T403 PolarHBondContact O-OG1 3Å; T399-I484 HydrophobicContact CG2-CG2 3.99Å; T399-I488 HydrophobicContact CG2-CD1 3.92Å
400	A	92.4	Very high	85.5	Confident	51 Å²	51	68.5 Å²	68.5	42%	0.421	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-49.8	179	0	0	0	0	0	111.5	I396 L397 T403 A404	I396-A400 WeakPolarHBondContact O-CB 3.3Å; I396-A400 PolarHBondContact O-N 3.39Å; L397-A400 PolarHBondContact O-N 2.61Å; A400-T403 PolarHBondContact O-N 3.48Å; A400-T403 PolarHBondContact O-OG1 3.49Å; A400-A404 PolarHBondContact O-N 3.34Å; A400-A404 VanDerWaalsContact O-N 3.14Å
401	V	90.5	Very high	84.7	Confident	27 Å²	27	67.1 Å²	67.1	16%	0.164	37%	0.37	C	S	.	.	H	α-helix	trans	-61.2	-49.7	176.5	176.5	0	0	0	0	110.3	L397 T403 A404 F405 L424 F481 T485	L397-V401 HydrophobicContact CD1-CG2 4.48Å; L397-V401 HydrophobicContact CG-CG2 4.49Å; L397-V401 WeakPolarHBondContact O-CG2 3.41Å; L397-V401 PolarHBondContact O-N 3.37Å; V401-T403 VanDerWaalsContact C-N 3.31Å; V401-T403 PolarHBondContact O-N 3.27Å; V401-A404 WeakPolarHBondContact O-CB 3.14Å; V401-A404 PolarHBondContact O-N 3.26Å; V401-A404 VanDerWaalsContact O-N 3.14Å; V401-F405 HydrophobicContact CG1-CD2 4.38Å; V401-F405 HydrophobicContact CG1-CE2 4.32Å; V401-F405 WeakPolarHBondContact O-CD2 3.4Å; V401-F405 PolarHBondContact O-N 2.96Å; V401-L424 HydrophobicContact CG1-CD2 3.47Å; V401-L424 VanDerWaalsContact CG1-CD2 3.47Å; V401-F481 HydrophobicContact CB-CZ 4.44Å; V401-F481 HydrophobicContact CG2-CZ 4.26Å; V401-T485 HydrophobicContact CB-CG2 4.33Å; V401-T485 HydrophobicContact CG1-CG2 3.76Å
402	G	90.7	Very high	83.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-56.6	-43.2	178.4	0	0	0	0	0	112.8	A398 T399 A404 F405 R406 I488	A398-G402 PolarHBondContact O-N 2.93Å; T399-G402 PolarHBondContact O-N 3.39Å; G402-A404 VanDerWaalsContact C-N 3.32Å; G402-A404 PolarHBondContact O-N 3.44Å; G402-F405 PolarHBondContact O-N 3.45Å; G402-R406 PolarHBondContact O-N 3.4Å; G402-I488 WeakPolarHBondContact O-CG2 3.34Å
403	T	89.9	Confident	82.8	Confident	79 Å²	79	67 Å²	67	49%	0.485	37%	0.365	S	S	.	.	H	α-helix	trans	-66	-32.4	179.1	53	0	0	0	0	113.4	T399 A400 V401 F405 R406 I488	T399-T403 WeakPolarHBondContact O-CB 3.45Å; T399-T403 VanDerWaalsContact O-CG2 3.27Å; T399-T403 WeakPolarHBondContact O-CG2 3.44Å; T399-T403 PolarHBondContact O-N 3.38Å; T399-T403 PolarHBondContact O-OG1 3Å; A400-T403 PolarHBondContact O-N 3.48Å; A400-T403 PolarHBondContact O-OG1 3.49Å; V401-T403 VanDerWaalsContact C-N 3.31Å; V401-T403 PolarHBondContact O-N 3.27Å; T403-F405 PolarHBondContact O-N 3.27Å; T403-R406 WeakPolarHBondContact O-CB 2.94Å; T403-R406 PolarHBondContact O-N 3.39Å; T403-I488 HydrophobicContact CG2-CG2 4.07Å
404	A	87.9	Confident	82.2	Confident	74 Å²	74	63.1 Å²	63.1	61%	0.612	34%	0.344	S	S	*	.	H	α-helix	trans	-63.8	-27.8	176.5	0	0	0	0	0	112.5	A400 V401 G402	A400-A404 PolarHBondContact O-N 3.34Å; A400-A404 VanDerWaalsContact O-N 3.14Å; V401-A404 WeakPolarHBondContact O-CB 3.14Å; V401-A404 PolarHBondContact O-N 3.26Å; V401-A404 VanDerWaalsContact O-N 3.14Å; G402-A404 VanDerWaalsContact C-N 3.32Å; G402-A404 PolarHBondContact O-N 3.44Å
405	F	85.3	Confident	81.8	Confident	35 Å²	35	62.5 Å²	62.5	15%	0.154	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	6.9	178.7	-69.5	-88.9	0	0	0	113.6	V401 G402 T403 V407 L408 M417 L421 L424 A489	V401-F405 HydrophobicContact CG1-CD2 4.38Å; V401-F405 HydrophobicContact CG1-CE2 4.32Å; V401-F405 WeakPolarHBondContact O-CD2 3.4Å; V401-F405 PolarHBondContact O-N 2.96Å; G402-F405 PolarHBondContact O-N 3.45Å; T403-F405 PolarHBondContact O-N 3.27Å; F405-V407 PolarHBondContact O-N 3Å; F405-L408 HydrophobicContact CB-CD1 4.2Å; F405-L408 WeakPolarHBondContact O-CD1 3.18Å; F405-L408 VanDerWaalsContact O-CG 3.3Å; F405-L408 WeakPolarHBondContact O-CG 3.16Å; F405-M417 HydrophobicContact CD1-CE 4.15Å; F405-M417 HydrophobicContact CE1-CE 3.98Å; F405-L421 HydrophobicContact CB-CD1 4.44Å; F405-L421 HydrophobicContact CB-CD2 4.38Å; F405-L421 HydrophobicContact CD1-CB 3.98Å; F405-L421 HydrophobicContact CD1-CD1 4.41Å; F405-L421 HydrophobicContact CD2-CD1 3.8Å; F405-L421 HydrophobicContact CE1-CB 4.02Å; F405-L421 HydrophobicContact CE2-CD1 4.11Å; F405-L421 HydrophobicContact CG-CB 4.36Å; F405-L421 HydrophobicContact CG-CD1 3.97Å; F405-L421 HydrophobicContact CZ-CB 4.46Å; F405-L424 HydrophobicContact CE2-CD2 3.99Å; F405-L424 HydrophobicContact CZ-CD2 4.46Å; F405-A489 HydrophobicContact CB-CB 4.01Å
406	R	75.5	Confident	81.3	Confident	184 Å²	184	66 Å²	66	69%	0.694	35%	0.353	S	S	*	.			trans	-62.8	-16.6	-175.8	-177.5	174.3	167.5	137.3	0.1	114.1	G402 T403 L408	G402-R406 PolarHBondContact O-N 3.4Å; T403-R406 WeakPolarHBondContact O-CB 2.94Å; T403-R406 PolarHBondContact O-N 3.39Å; R406-L408 VanDerWaalsContact C-N 3.31Å; R406-L408 PolarHBondContact O-N 3.01Å
407	V	65.4	Low	80.8	Confident	111 Å²	111	65.3 Å²	65.3	67%	0.673	35%	0.349	S	S	*	.			trans	-95.3	57.5	178	-165.9	0	0	0	0	109.6	F405	F405-V407 PolarHBondContact O-N 3Å
408	L	68.8	Low	80.6	Confident	25 Å²	25	61.8 Å²	61.8	13%	0.131	33%	0.33	C	S	.	.			trans	-100.1	95	171.1	-80.3	163.2	0	0	0	109	F405 R406 E414 M417 R418 L421 A489 V491	F405-L408 HydrophobicContact CB-CD1 4.2Å; F405-L408 WeakPolarHBondContact O-CD1 3.18Å; F405-L408 VanDerWaalsContact O-CG 3.3Å; F405-L408 WeakPolarHBondContact O-CG 3.16Å; R406-L408 VanDerWaalsContact C-N 3.31Å; R406-L408 PolarHBondContact O-N 3.01Å; L408-E414 WeakPolarHBondContact CA-OE2 3.47Å; L408-E414 HydrophobicContact CD2-CB 4.3Å; L408-M417 HydrophobicContact CD2-CB 4.01Å; L408-R418 HydrophobicContact CD1-CG 4.32Å; L408-R418 HydrophobicContact CD2-CG 3.47Å; L408-R418 VanDerWaalsContact CD2-CG 3.47Å; L408-R418 HydrophobicContact CG-CG 4.48Å; L408-L421 HydrophobicContact CD1-CD2 4.19Å; L408-A489 HydrophobicContact CD1-CB 4.17Å; L408-A489 WeakPolarHBondContact CD1-O 3.27Å; L408-V491 HydrophobicContact CD1-CG2 4.46Å
409	K	68.5	Low	80.4	Confident	131 Å²	131	61.8 Å²	61.8	57%	0.57	33%	0.33	S	S	*	.			trans	-78.8	-166.6	160.6	-53.3	-176.7	176.4	-178.2	0	111.8	E414 R418	K409-E414 WeakPolarHBondContact CA-OE2 3.33Å; K409-E414 VanDerWaalsContact CB-OE1 3.27Å; K409-E414 WeakPolarHBondContact CB-OE1 3.29Å; K409-E414 PolarHBondContact N-OE1 3.48Å; K409-E414 PolarHBondContact N-OE2 2.89Å; K409-R418 PolarHBondContact O-NH2 2.92Å
410	N	68.8	Low	80.2	Confident	73 Å²	73	60.3 Å²	60.3	39%	0.39	33%	0.326	S	S	.	.	S	Bend	trans	-114.9	54.8	179.1	-72.9	-24.8	0	0	0	109.4	R418 F583	N410-R418 PolarHBondContact OD1-NH2 3.26Å; N410-F583 CarbonylContact O-C 3.51Å
411	D	69.2	Low	80.1	Confident	51 Å²	51	58 Å²	58	27%	0.273	31%	0.306	S	S	.	.			trans	-110.1	154.7	-178.1	-66.1	4	0	0	0	110.7	I413 E414	D411-I413 PolarHBondContact O-N 3.25Å; D411-I413 VanDerWaalsContact O-N 3.15Å; D411-E414 HydrophobicContact CB-CG 4.36Å; D411-E414 WeakPolarHBondContact O-CB 3.41Å; D411-E414 PolarHBondContact O-N 2.92Å
412	C	68.1	Low	80.2	Confident	32 Å²	32	56.9 Å²	56.9	22%	0.216	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.6	-176.7	37.6	0	0	0	0	115	E414 C595 V599	C412-E414 VanDerWaalsContact C-N 3.26Å; C412-E414 PolarHBondContact O-N 3.37Å; C412-C595 HydrophobicContact CB-CB 4.05Å; C412-C595 WeakPolarHBondContact CB-SG 3.4Å; C412-C595 WeakPolarHBondContact SG-CB 3.37Å; C412-C595 CovalentContact SG-SG 2.02Å; C412-C595 PolarHBondContact SG-SG 3.24Å; C412-V599 HydrophobicContact CB-CG1 4.14Å
413	I	70.2	Confident	80.3	Confident	106 Å²	106	58.9 Å²	58.9	54%	0.544	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-27	173.8	-62.9	172.2	0	0	0	111.2	D411	D411-I413 PolarHBondContact O-N 3.25Å; D411-I413 VanDerWaalsContact O-N 3.15Å
414	E	78.3	Confident	80.4	Confident	20 Å²	20	58 Å²	58	9%	0.093	30%	0.299	C	S	.	.	H	α-helix	trans	-88.5	-11.5	-168.5	-62	-166.2	-174.9	0	0	114.6	L408 K409 D411 C412 Q416 M417 R418	L408-E414 WeakPolarHBondContact CA-OE2 3.47Å; L408-E414 HydrophobicContact CD2-CB 4.3Å; K409-E414 WeakPolarHBondContact CA-OE2 3.33Å; K409-E414 VanDerWaalsContact CB-OE1 3.27Å; K409-E414 WeakPolarHBondContact CB-OE1 3.29Å; K409-E414 PolarHBondContact N-OE1 3.48Å; K409-E414 PolarHBondContact N-OE2 2.89Å; D411-E414 HydrophobicContact CB-CG 4.36Å; D411-E414 WeakPolarHBondContact O-CB 3.41Å; D411-E414 PolarHBondContact O-N 2.92Å; C412-E414 VanDerWaalsContact C-N 3.26Å; C412-E414 PolarHBondContact O-N 3.37Å; E414-Q416 PolarHBondContact O-N 3.49Å; E414-M417 PolarHBondContact O-N 3.02Å; E414-R418 PolarHBondContact O-N 3.31Å
415	V	82.3	Confident	80.6	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-53	-46.6	169.2	173.6	0	0	0	0	110	R418 A419 F578 F583 F606	V415-R418 PolarHBondContact O-N 3.38Å; V415-A419 WeakPolarHBondContact O-CB 3.47Å; V415-A419 PolarHBondContact O-N 3Å; V415-F578 HydrophobicContact CB-CE1 4.4Å; V415-F578 HydrophobicContact CG1-CE1 3.77Å; V415-F578 HydrophobicContact CG1-CZ 4.18Å; V415-F578 WeakPolarHBondContact O-CZ 3.34Å; V415-F583 HydrophobicContact CG2-CB 4.15Å; V415-F583 HydrophobicContact CG2-CD1 3.9Å; V415-F583 HydrophobicContact CG2-CD2 3.6Å; V415-F583 HydrophobicContact CG2-CE1 4.17Å; V415-F583 HydrophobicContact CG2-CE2 3.9Å; V415-F583 HydrophobicContact CG2-CG 3.6Å; V415-F583 HydrophobicContact CG2-CZ 4.18Å; V415-F606 HydrophobicContact CG1-CB 4.37Å; V415-F606 HydrophobicContact CG1-CD1 4.39Å; V415-F606 HydrophobicContact CG1-CD2 3.38Å; V415-F606 HydrophobicContact CG1-CE2 3.68Å; V415-F606 HydrophobicContact CG1-CG 3.78Å; V415-F606 HydrophobicContact CG1-CZ 4.3Å
416	Q	81.5	Confident	81	Confident	137 Å²	137	52.8 Å²	52.8	64%	0.64	26%	0.263	S	S	*	.	H	α-helix	trans	-66.4	-37.1	176.3	-77.4	-175.1	-16	0	0	112.6	E414 A419 G420	E414-Q416 PolarHBondContact O-N 3.49Å; Q416-A419 PolarHBondContact O-N 2.71Å; Q416-G420 PolarHBondContact O-N 3.02Å
417	M	84.6	Confident	81.9	Confident	92 Å²	92	45.9 Å²	45.9	45%	0.453	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-41.2	177.7	-68.4	-64.4	-71.4	0	0	111.9	F405 L408 E414 G420 L421	F405-M417 HydrophobicContact CD1-CE 4.15Å; F405-M417 HydrophobicContact CE1-CE 3.98Å; L408-M417 HydrophobicContact CD2-CB 4.01Å; E414-M417 PolarHBondContact O-N 3.02Å; M417-G420 PolarHBondContact O-N 2.93Å; M417-L421 PolarHBondContact O-N 2.98Å
418	R	88	Confident	83.1	Confident	9 Å²	9	42.5 Å²	42.5	3%	0.034	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-46.6	174.1	-69.6	-170.5	-174.7	-168.4	10.6	111.9	L408 K409 N410 E414 V415 G420 L421 L422 E577 F578	L408-R418 HydrophobicContact CD1-CG 4.32Å; L408-R418 HydrophobicContact CD2-CG 3.47Å; L408-R418 VanDerWaalsContact CD2-CG 3.47Å; L408-R418 HydrophobicContact CG-CG 4.48Å; K409-R418 PolarHBondContact O-NH2 2.92Å; N410-R418 PolarHBondContact OD1-NH2 3.26Å; E414-R418 PolarHBondContact O-N 3.31Å; V415-R418 PolarHBondContact O-N 3.38Å; R418-G420 VanDerWaalsContact C-N 3.28Å; R418-G420 PolarHBondContact O-N 3Å; R418-L421 WeakPolarHBondContact O-CB 3.46Å; R418-L421 PolarHBondContact O-N 3.27Å; R418-L422 WeakPolarHBondContact O-CG 3.46Å; R418-L422 PolarHBondContact O-N 3.38Å; R418-E577 IonicContact CZ-OE1 3.9Å; R418-E577 IonicContact NH1-OE1 2.98Å; R418-E577 PolarHBondContact NH1-OE1 3.39Å; R418-F578 HydrophobicContact CB-CE1 4.41Å; R418-F578 HydrophobicContact CB-CZ 3.8Å
419	A	89	Confident	84.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-39.2	177.8	0	0	0	0	0	111.1	V415 Q416 L422 Y423 L548 F570 L574 F578 F606	V415-A419 WeakPolarHBondContact O-CB 3.47Å; V415-A419 PolarHBondContact O-N 3Å; Q416-A419 PolarHBondContact O-N 2.71Å; A419-L422 PolarHBondContact O-N 3.35Å; A419-Y423 WeakPolarHBondContact O-CB 3.35Å; A419-Y423 PolarHBondContact O-N 3.13Å; A419-L548 HydrophobicContact CB-CD2 3.54Å; A419-F570 WeakPolarHBondContact O-CE2 3.43Å; A419-L574 HydrophobicContact CB-CD2 3.95Å; A419-F578 HydrophobicContact CB-CE2 4.18Å; A419-F578 HydrophobicContact CB-CZ 4.18Å; A419-F606 HydrophobicContact CB-CE1 4.25Å; A419-F606 HydrophobicContact CB-CZ 3.89Å
420	G	89.5	Confident	85.4	Confident	26 Å²	26	35.1 Å²	35.1	27%	0.268	18%	0.182	S	C	.	.	H	α-helix	trans	-62.1	-40.5	173.5	0	0	0	0	0	113.5	Q416 M417 R418 Y423 L424	Q416-G420 PolarHBondContact O-N 3.02Å; M417-G420 PolarHBondContact O-N 2.93Å; R418-G420 VanDerWaalsContact C-N 3.28Å; R418-G420 PolarHBondContact O-N 3Å; G420-Y423 PolarHBondContact O-N 3.21Å; G420-L424 WeakPolarHBondContact O-CB 3.49Å; G420-L424 PolarHBondContact O-N 3.49Å
421	L	90.5	Very high	86.5	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-48.2	173.9	174.5	63.1	0	0	0	111.7	F405 L408 M417 R418 Y423 L424 L425 T485 A489 V491	F405-L421 HydrophobicContact CB-CD1 4.44Å; F405-L421 HydrophobicContact CB-CD2 4.38Å; F405-L421 HydrophobicContact CD1-CB 3.98Å; F405-L421 HydrophobicContact CD1-CD1 4.41Å; F405-L421 HydrophobicContact CD2-CD1 3.8Å; F405-L421 HydrophobicContact CE1-CB 4.02Å; F405-L421 HydrophobicContact CE2-CD1 4.11Å; F405-L421 HydrophobicContact CG-CB 4.36Å; F405-L421 HydrophobicContact CG-CD1 3.97Å; F405-L421 HydrophobicContact CZ-CB 4.46Å; L408-L421 HydrophobicContact CD1-CD2 4.19Å; M417-L421 PolarHBondContact O-N 2.98Å; R418-L421 WeakPolarHBondContact O-CB 3.46Å; R418-L421 PolarHBondContact O-N 3.27Å; L421-Y423 VanDerWaalsContact C-N 3.26Å; L421-Y423 PolarHBondContact O-N 3.25Å; L421-L424 WeakPolarHBondContact O-CB 3.05Å; L421-L424 PolarHBondContact O-N 2.84Å; L421-L425 WeakPolarHBondContact O-CG 3.07Å; L421-L425 PolarHBondContact O-N 2.96Å; L421-T485 HydrophobicContact CD1-CG2 3.87Å; L421-A489 HydrophobicContact CD2-CB 3.44Å; L421-A489 VanDerWaalsContact CD2-CB 3.44Å; L421-V491 HydrophobicContact CD2-CG2 3.69Å
422	L	91.8	Very high	87.4	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-34.3	179.1	-63.8	176.3	0	0	0	111.9	R418 A419 L425 T426 F570 L573 L574 E577 F578	R418-L422 WeakPolarHBondContact O-CG 3.46Å; R418-L422 PolarHBondContact O-N 3.38Å; A419-L422 PolarHBondContact O-N 3.35Å; L422-L425 HydrophobicContact CD2-CD1 4.38Å; L422-L425 PolarHBondContact O-N 3.2Å; L422-T426 PolarHBondContact O-N 3.4Å; L422-T426 PolarHBondContact O-OG1 3.4Å; L422-F570 HydrophobicContact CB-CD2 4.38Å; L422-F570 HydrophobicContact CB-CE2 4Å; L422-L573 HydrophobicContact CB-CB 4.3Å; L422-L573 HydrophobicContact CD1-CB 4.33Å; L422-L573 HydrophobicContact CD2-CB 4.26Å; L422-L574 HydrophobicContact CD1-CD2 4.01Å; L422-E577 HydrophobicContact CD1-CB 3.73Å; L422-E577 HydrophobicContact CD1-CG 4.08Å; L422-F578 HydrophobicContact CD1-CE2 4.42Å
423	Y	92.5	Very high	88.5	Confident	42 Å²	42	34.8 Å²	34.8	17%	0.165	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-42.8	173.2	-176.2	-116.9	0	0	0	111.5	A419 G420 L421 L425 T426 I427 L541 L548 F570	A419-Y423 WeakPolarHBondContact O-CB 3.35Å; A419-Y423 PolarHBondContact O-N 3.13Å; G420-Y423 PolarHBondContact O-N 3.21Å; L421-Y423 VanDerWaalsContact C-N 3.26Å; L421-Y423 PolarHBondContact O-N 3.25Å; Y423-L425 VanDerWaalsContact C-N 3.34Å; Y423-L425 PolarHBondContact O-N 2.85Å; Y423-T426 WeakPolarHBondContact O-CB 3.45Å; Y423-T426 PolarHBondContact O-N 2.91Å; Y423-T426 VanDerWaalsContact O-N 3.12Å; Y423-I427 HydrophobicContact CD1-CD1 3.62Å; Y423-I427 HydrophobicContact CD1-CG1 4.42Å; Y423-I427 HydrophobicContact CE1-CD1 3.34Å; Y423-I427 HydrophobicContact CE1-CG1 4.11Å; Y423-I427 HydrophobicContact CE2-CD1 4.47Å; Y423-I427 HydrophobicContact CE2-CG1 4.38Å; Y423-I427 HydrophobicContact CG-CD1 4.31Å; Y423-I427 WeakPolarHBondContact O-CG1 3.5Å; Y423-I427 PolarHBondContact O-N 2.98Å; Y423-L541 HydrophobicContact CE2-CD2 4.49Å; Y423-L541 VanDerWaalsContact OH-C 3.29Å; Y423-L541 PolarHBondContact OH-O 3.17Å; Y423-L548 HydrophobicContact CD1-CD1 4.35Å; Y423-L548 HydrophobicContact CG-CD1 4.16Å; Y423-F570 HydrophobicContact CD2-CD1 4.32Å; Y423-F570 HydrophobicContact CD2-CD2 4.37Å; Y423-F570 HydrophobicContact CD2-CE1 4.28Å; Y423-F570 HydrophobicContact CD2-CE2 4.37Å; Y423-F570 HydrophobicContact CD2-CG 4.37Å; Y423-F570 HydrophobicContact CD2-CZ 4.32Å; Y423-F570 HydrophobicContact CG-CE2 4.48Å; Y423-F570 HydrophobicContact CG-CZ 4.47Å
424	L	91.9	Very high	89.5	Confident	60 Å²	60	30.7 Å²	30.7	31%	0.314	16%	0.159	S	C	.	.	H	α-helix	trans	-60.9	-41.4	174.7	-178.3	64	0	0	0	112.2	V401 F405 G420 L421 T426 I427 F428	V401-L424 HydrophobicContact CG1-CD2 3.47Å; V401-L424 VanDerWaalsContact CG1-CD2 3.47Å; F405-L424 HydrophobicContact CE2-CD2 3.99Å; F405-L424 HydrophobicContact CZ-CD2 4.46Å; G420-L424 WeakPolarHBondContact O-CB 3.49Å; G420-L424 PolarHBondContact O-N 3.49Å; L421-L424 WeakPolarHBondContact O-CB 3.05Å; L421-L424 PolarHBondContact O-N 2.84Å; L424-T426 VanDerWaalsContact C-N 3.32Å; L424-T426 PolarHBondContact O-N 3.14Å; L424-I427 PolarHBondContact O-N 3.25Å; L424-F428 PolarHBondContact O-N 2.9Å
425	L	92.3	Very high	89.9	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-60.9	-43.2	173.4	-67.5	-179.9	0	0	0	111.1	L421 L422 Y423 F428 Q429 F481 T485 I505	L421-L425 WeakPolarHBondContact O-CG 3.07Å; L421-L425 PolarHBondContact O-N 2.96Å; L422-L425 HydrophobicContact CD2-CD1 4.38Å; L422-L425 PolarHBondContact O-N 3.2Å; Y423-L425 VanDerWaalsContact C-N 3.34Å; Y423-L425 PolarHBondContact O-N 2.85Å; L425-F428 PolarHBondContact O-N 3.4Å; L425-Q429 WeakPolarHBondContact O-CG 3.39Å; L425-Q429 PolarHBondContact O-N 3.3Å; L425-Q429 VanDerWaalsContact O-N 3.08Å; L425-F481 HydrophobicContact CD2-CD1 4.47Å; L425-F481 HydrophobicContact CD2-CE1 4.07Å; L425-T485 HydrophobicContact CD2-CG2 3.99Å; L425-I505 HydrophobicContact CD1-CD1 4.39Å
426	T	94.1	Very high	90.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-46.8	177	-56.8	0	0	0	0	111.5	L422 Y423 L424 F428 Q429 C430 L508 P566 F570	L422-T426 PolarHBondContact O-N 3.4Å; L422-T426 PolarHBondContact O-OG1 3.4Å; Y423-T426 WeakPolarHBondContact O-CB 3.45Å; Y423-T426 PolarHBondContact O-N 2.91Å; Y423-T426 VanDerWaalsContact O-N 3.12Å; L424-T426 VanDerWaalsContact C-N 3.32Å; L424-T426 PolarHBondContact O-N 3.14Å; T426-F428 VanDerWaalsContact C-N 3.3Å; T426-F428 PolarHBondContact O-N 3.13Å; T426-Q429 PolarHBondContact O-N 3.33Å; T426-C430 PolarHBondContact O-N 3.25Å; T426-C430 VanDerWaalsContact O-N 3.11Å; T426-L508 HydrophobicContact CG2-CD2 3.91Å; T426-P566 HydrophobicContact CG2-CB 3.72Å; T426-F570 HydrophobicContact CG2-CB 4.17Å
427	I	93.7	Very high	90.5	Very high	38 Å²	38	25.6 Å²	25.6	20%	0.195	14%	0.142	C	C	.	.	H	α-helix	trans	-54.7	-48.6	175.4	-70.4	162.3	0	0	0	110.3	Y423 L424 Q429 C430 I431 L541	Y423-I427 HydrophobicContact CD1-CD1 3.62Å; Y423-I427 HydrophobicContact CD1-CG1 4.42Å; Y423-I427 HydrophobicContact CE1-CD1 3.34Å; Y423-I427 HydrophobicContact CE1-CG1 4.11Å; Y423-I427 HydrophobicContact CE2-CD1 4.47Å; Y423-I427 HydrophobicContact CE2-CG1 4.38Å; Y423-I427 HydrophobicContact CG-CD1 4.31Å; Y423-I427 WeakPolarHBondContact O-CG1 3.5Å; Y423-I427 PolarHBondContact O-N 2.98Å; L424-I427 PolarHBondContact O-N 3.25Å; I427-Q429 VanDerWaalsContact C-N 3.34Å; I427-Q429 PolarHBondContact O-N 3.02Å; I427-C430 PolarHBondContact O-N 3.41Å; I427-I431 HydrophobicContact CG2-CD1 3.49Å; I427-I431 VanDerWaalsContact CG2-CD1 3.49Å; I427-I431 HydrophobicContact CG2-CG1 4.15Å; I427-I431 WeakPolarHBondContact O-CG1 3.3Å; I427-I431 PolarHBondContact O-N 3.47Å; I427-L541 HydrophobicContact CB-CD1 4.43Å; I427-L541 HydrophobicContact CB-CD2 4.39Å; I427-L541 HydrophobicContact CG1-CD1 4.14Å; I427-L541 HydrophobicContact CG1-CD2 3.74Å; I427-L541 HydrophobicContact CG1-CG 4.44Å; I427-L541 HydrophobicContact CG2-CD1 4.22Å
428	F	91.7	Very high	90.7	Very high	41 Å²	41	25 Å²	25	18%	0.18	14%	0.138	C	C	.	.	H	α-helix	trans	-61.1	-42.5	-177.9	-172.7	-94	0	0	0	112.1	L397 L424 L425 T426 C430 T432 F481	L397-F428 HydrophobicContact CD2-CE2 4.08Å; L424-F428 PolarHBondContact O-N 2.9Å; L425-F428 PolarHBondContact O-N 3.4Å; T426-F428 VanDerWaalsContact C-N 3.3Å; T426-F428 PolarHBondContact O-N 3.13Å; F428-C430 VanDerWaalsContact C-N 3.35Å; F428-C430 PolarHBondContact O-N 3.33Å; F428-T432 HydrophobicContact CD1-CG2 4.07Å; F428-T432 HydrophobicContact CD2-CG2 4.35Å; F428-T432 HydrophobicContact CE1-CG2 3.69Å; F428-T432 HydrophobicContact CE2-CG2 4Å; F428-T432 HydrophobicContact CG-CG2 4.4Å; F428-T432 HydrophobicContact CZ-CG2 3.66Å; F428-T432 WeakPolarHBondContact O-CB 3.38Å; F428-T432 VanDerWaalsContact O-CG2 3.31Å; F428-T432 WeakPolarHBondContact O-CG2 3.48Å; F428-T432 PolarHBondContact O-N 3.22Å; F428-T432 VanDerWaalsContact O-N 3.09Å; F428-T432 PolarHBondContact O-OG1 3.46Å; F428-F481 HydrophobicContact CB-CD1 4.42Å; F428-F481 HydrophobicContact CB-CE1 3.99Å; F428-F481 HydrophobicContact CD1-CB 4.32Å; F428-F481 AromaticContact CD1-CD1 3.26Å; F428-F481 HydrophobicContact CD1-CD1 3.26Å; F428-F481 AromaticContact CD1-CE1 3.64Å; F428-F481 HydrophobicContact CD1-CE1 3.64Å; F428-F481 AromaticContact CD1-CG 3.81Å; F428-F481 HydrophobicContact CD1-CG 3.81Å; F428-F481 HydrophobicContact CD1-CZ 4.45Å; F428-F481 HydrophobicContact CD2-CD1 4.2Å; F428-F481 AromaticContact CD2-CE1 3.85Å; F428-F481 HydrophobicContact CD2-CE1 3.85Å; F428-F481 HydrophobicContact CD2-CE2 4.35Å; F428-F481 AromaticContact CD2-CZ 3.94Å; F428-F481 HydrophobicContact CD2-CZ 3.94Å; F428-F481 HydrophobicContact CE1-CB 3.62Å; F428-F481 AromaticContact CE1-CD1 3.37Å; F428-F481 HydrophobicContact CE1-CD1 3.37Å; F428-F481 AromaticContact CE1-CD2 3.99Å; F428-F481 HydrophobicContact CE1-CD2 3.99Å; F428-F481 HydrophobicContact CE1-CE1 4.03Å; F428-F481 AromaticContact CE1-CG 3.36Å; F428-F481 HydrophobicContact CE1-CG 3.36Å; F428-F481 HydrophobicContact CE2-CD1 4.29Å; F428-F481 HydrophobicContact CE2-CD2 4.09Å; F428-F481 HydrophobicContact CE2-CE1 4.23Å; F428-F481 HydrophobicContact CE2-CE2 4.03Å; F428-F481 HydrophobicContact CE2-CG 4.24Å; F428-F481 HydrophobicContact CE2-CZ 4.11Å; F428-F481 AromaticContact CG-CD1 3.7Å; F428-F481 HydrophobicContact CG-CD1 3.7Å; F428-F481 AromaticContact CG-CE1 3.53Å; F428-F481 HydrophobicContact CG-CE1 3.53Å; F428-F481 HydrophobicContact CG-CG 4.4Å; F428-F481 HydrophobicContact CG-CZ 4.12Å; F428-F481 HydrophobicContact CZ-CB 4.07Å; F428-F481 AromaticContact CZ-CD1 3.9Å; F428-F481 HydrophobicContact CZ-CD1 3.9Å; F428-F481 AromaticContact CZ-CD2 3.72Å; F428-F481 HydrophobicContact CZ-CD2 3.72Å; F428-F481 HydrophobicContact CZ-CE1 4.3Å; F428-F481 HydrophobicContact CZ-CE2 4.15Å; F428-F481 AromaticContact CZ-CG 3.61Å; F428-F481 HydrophobicContact CZ-CG 3.61Å; F428-F481 HydrophobicContact CZ-CZ 4.42Å
429	Q	92.6	Very high	90.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-41.3	176.2	-63.9	-51.3	-35.6	0	0	112.2	L425 T426 I427 T432 S433 S478 S482 I505 L508 A509	L425-Q429 WeakPolarHBondContact O-CG 3.39Å; L425-Q429 PolarHBondContact O-N 3.3Å; L425-Q429 VanDerWaalsContact O-N 3.08Å; T426-Q429 PolarHBondContact O-N 3.33Å; I427-Q429 VanDerWaalsContact C-N 3.34Å; I427-Q429 PolarHBondContact O-N 3.02Å; Q429-T432 PolarHBondContact O-OG1 3.49Å; Q429-S433 WeakPolarHBondContact O-CB 3.47Å; Q429-S433 PolarHBondContact O-N 2.91Å; Q429-S433 PolarHBondContact O-OG 3.22Å; Q429-S478 PolarHBondContact NE2-O 2.9Å; Q429-S478 PolarHBondContact NE2-OG 3.37Å; Q429-S478 VanDerWaalsContact OE1-CB 3.29Å; Q429-S478 PolarHBondContact OE1-OG 3.49Å; Q429-S482 PolarHBondContact NE2-OG 3.2Å; Q429-I505 HydrophobicContact CG-CG2 3.96Å; Q429-L508 HydrophobicContact CB-CD2 3.89Å; Q429-L508 HydrophobicContact CB-CG 4.06Å; Q429-L508 HydrophobicContact CG-CD2 4.06Å; Q429-A509 VanDerWaalsContact OE1-CB 3.29Å
430	C	93.6	Very high	90.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-70.6	-44.8	179.6	-69	0	0	0	0	112.8	T426 I427 F428 S433 F537 L541	T426-C430 PolarHBondContact O-N 3.25Å; T426-C430 VanDerWaalsContact O-N 3.11Å; I427-C430 PolarHBondContact O-N 3.41Å; F428-C430 VanDerWaalsContact C-N 3.35Å; F428-C430 PolarHBondContact O-N 3.33Å; C430-S433 WeakPolarHBondContact O-CB 3.05Å; C430-S433 PolarHBondContact O-N 3.48Å; C430-F537 HydrophobicContact CB-CD1 3.72Å; C430-F537 HydrophobicContact CB-CE1 3.93Å; C430-F537 HydrophobicContact CB-CG 4.15Å; C430-F537 HydrophobicContact CB-CZ 4.49Å; C430-F537 WeakPolarHBondContact O-CE2 3.44Å; C430-L541 HydrophobicContact CB-CD1 4.41Å
431	I	90.1	Very high	90.5	Very high	100 Å²	100	24.6 Å²	24.6	51%	0.513	13%	0.131	S	C	.	.	H	α-helix	trans	-67.2	-44.9	-177.8	-67.8	178.6	0	0	0	111.2	I427 S433 V434	I427-I431 HydrophobicContact CG2-CD1 3.49Å; I427-I431 VanDerWaalsContact CG2-CD1 3.49Å; I427-I431 HydrophobicContact CG2-CG1 4.15Å; I427-I431 WeakPolarHBondContact O-CG1 3.3Å; I427-I431 PolarHBondContact O-N 3.47Å; I431-S433 PolarHBondContact O-N 3.44Å; I431-V434 WeakPolarHBondContact O-CB 3.46Å; I431-V434 WeakPolarHBondContact O-CG2 3.2Å; I431-V434 PolarHBondContact O-N 3.48Å; I431-V434 VanDerWaalsContact O-N 3.13Å
432	T	88.7	Confident	90.3	Very high	46 Å²	46	30.3 Å²	30.3	28%	0.282	16%	0.16	S	C	.	.	H	α-helix	trans	-63.5	-30.7	178.8	53.8	0	0	0	0	112.4	F428 Q429 V434 S435 S478	F428-T432 HydrophobicContact CD1-CG2 4.07Å; F428-T432 HydrophobicContact CD2-CG2 4.35Å; F428-T432 HydrophobicContact CE1-CG2 3.69Å; F428-T432 HydrophobicContact CE2-CG2 4Å; F428-T432 HydrophobicContact CG-CG2 4.4Å; F428-T432 HydrophobicContact CZ-CG2 3.66Å; F428-T432 WeakPolarHBondContact O-CB 3.38Å; F428-T432 VanDerWaalsContact O-CG2 3.31Å; F428-T432 WeakPolarHBondContact O-CG2 3.48Å; F428-T432 PolarHBondContact O-N 3.22Å; F428-T432 VanDerWaalsContact O-N 3.09Å; F428-T432 PolarHBondContact O-OG1 3.46Å; Q429-T432 PolarHBondContact O-OG1 3.49Å; T432-V434 PolarHBondContact O-N 2.66Å; T432-S435 PolarHBondContact O-N 2.9Å; T432-S435 PolarHBondContact O-OG 3.41Å; T432-S478 PolarHBondContact OG1-OG 2.97Å
433	S	91	Very high	90	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-21	176.7	-66.6	0	0	0	0	113.8	Q429 C430 I431 S435 A436 A509 A512 S513 P516	Q429-S433 WeakPolarHBondContact O-CB 3.47Å; Q429-S433 PolarHBondContact O-N 2.91Å; Q429-S433 PolarHBondContact O-OG 3.22Å; C430-S433 WeakPolarHBondContact O-CB 3.05Å; C430-S433 PolarHBondContact O-N 3.48Å; I431-S433 PolarHBondContact O-N 3.44Å; S433-S435 PolarHBondContact O-N 2.9Å; S433-A436 WeakPolarHBondContact O-CA 3.41Å; S433-A436 WeakPolarHBondContact O-CB 3.35Å; S433-A436 PolarHBondContact O-N 3.5Å; S433-A509 PolarHBondContact OG-O 2.73Å; S433-A512 WeakPolarHBondContact OG-CB 3.34Å; S433-S513 PolarHBondContact OG-OG 3.24Å; S433-P516 WeakPolarHBondContact O-CG 3.33Å
434	V	90.8	Very high	89.8	Confident	20 Å²	20	31.3 Å²	31.3	12%	0.121	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-56.3	-40.6	177.8	175.4	0	0	0	0	111.6	I431 T432 A436 G437 T530 V533 F537	I431-V434 WeakPolarHBondContact O-CB 3.46Å; I431-V434 WeakPolarHBondContact O-CG2 3.2Å; I431-V434 PolarHBondContact O-N 3.48Å; I431-V434 VanDerWaalsContact O-N 3.13Å; T432-V434 PolarHBondContact O-N 2.66Å; V434-A436 PolarHBondContact O-N 3.38Å; V434-G437 PolarHBondContact O-N 3.16Å; V434-T530 HydrophobicContact CG1-CG2 3.71Å; V434-V533 HydrophobicContact CG2-CG1 4.23Å; V434-F537 HydrophobicContact CG2-CD2 3.69Å; V434-F537 HydrophobicContact CG2-CE2 3.99Å
435	S	86.9	Confident	89.6	Confident	50 Å²	50	32.8 Å²	32.8	35%	0.35	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-59.2	-12.4	176.4	70.4	0	0	0	0	113.1	T432 S433 G437 R474	T432-S435 PolarHBondContact O-N 2.9Å; T432-S435 PolarHBondContact O-OG 3.41Å; S433-S435 PolarHBondContact O-N 2.9Å; S435-G437 VanDerWaalsContact C-N 3.26Å; S435-G437 PolarHBondContact O-N 3.06Å; S435-R474 PolarHBondContact O-NE 3.46Å; S435-R474 PolarHBondContact O-NH2 3.24Å
436	A	89.8	Confident	89.5	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-63.9	-31.1	-177	0	0	0	0	0	113.6	S433 V434 E438 L439 L470 R474 P516 L517	S433-A436 WeakPolarHBondContact O-CA 3.41Å; S433-A436 WeakPolarHBondContact O-CB 3.35Å; S433-A436 PolarHBondContact O-N 3.5Å; V434-A436 PolarHBondContact O-N 3.38Å; A436-E438 PolarHBondContact O-N 2.92Å; A436-L439 WeakPolarHBondContact O-CB 3.39Å; A436-L439 PolarHBondContact O-N 3.23Å; A436-L470 HydrophobicContact CB-CD1 4.01Å; A436-R474 PolarHBondContact O-NH1 2.98Å; A436-R474 PolarHBondContact O-NH2 3Å; A436-P516 HydrophobicContact CB-CG 4.01Å; A436-L517 HydrophobicContact CB-CG 4.29Å; A436-L517 WeakPolarHBondContact O-CD2 3.41Å
437	G	87.7	Confident	89.4	Confident	5 Å²	5	34.2 Å²	34.2	5%	0.052	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-63.2	-23.7	-175.7	0	0	0	0	0	114.7	V434 S435 L439 P516	V434-G437 PolarHBondContact O-N 3.16Å; S435-G437 VanDerWaalsContact C-N 3.26Å; S435-G437 PolarHBondContact O-N 3.06Å; G437-L439 PolarHBondContact O-N 3.01Å; G437-P516 WeakPolarHBondContact CA-O 3.49Å
438	E	87.4	Confident	89.2	Confident	78 Å²	78	32.7 Å²	32.7	36%	0.364	17%	0.174	S	C	.	.	H	α-helix	trans	-68.6	-17.1	178.3	-73.9	176.9	-168	0	0	114.1	A436 F440 V441 I442 V526	A436-E438 PolarHBondContact O-N 2.92Å; E438-F440 PolarHBondContact O-N 3.45Å; E438-V441 PolarHBondContact O-N 2.87Å; E438-I442 HydrophobicContact CB-CD1 3.8Å; E438-I442 HydrophobicContact CB-CG1 4.28Å; E438-I442 HydrophobicContact CG-CD1 4.39Å; E438-I442 WeakPolarHBondContact O-CG1 3.31Å; E438-I442 PolarHBondContact O-N 2.83Å; E438-I442 VanDerWaalsContact O-N 3.13Å; E438-V526 HydrophobicContact CG-CB 4.44Å; E438-V526 HydrophobicContact CG-CG1 3.51Å; E438-V526 HydrophobicContact CG-CG2 4.06Å
439	L	88	Confident	89.2	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-54.7	-47.6	-167.7	-173	56.2	0	0	0	113.7	A436 G437 K465 E469 L517	A436-L439 WeakPolarHBondContact O-CB 3.39Å; A436-L439 PolarHBondContact O-N 3.23Å; G437-L439 PolarHBondContact O-N 3.01Å; L439-K465 HydrophobicContact CD2-CB 4.41Å; L439-E469 HydrophobicContact CD1-CB 3.76Å; L439-E469 WeakPolarHBondContact CD1-OE2 3.4Å; L439-L517 HydrophobicContact CB-CD2 3.77Å; L439-L517 HydrophobicContact CD2-CD2 3.95Å; L439-L517 HydrophobicContact CG-CD2 4.48Å
440	F	89	Confident	89.1	Confident	6 Å²	6	32.3 Å²	32.3	3%	0.026	17%	0.172	C	C	.	.	H	α-helix	trans	-93.5	-24.8	-175.7	-63.6	-57.5	0	0	0	112.4	E438 R444 Y461 F462 K465 L517 A521 T637 L641	E438-F440 PolarHBondContact O-N 3.45Å; F440-R444 WeakPolarHBondContact O-CA 3.42Å; F440-R444 WeakPolarHBondContact O-CB 3.19Å; F440-R444 PolarHBondContact O-N 3.09Å; F440-R444 VanDerWaalsContact O-N 3.17Å; F440-Y461 AromaticContact CD1-CE1 3.55Å; F440-Y461 HydrophobicContact CD1-CE1 3.55Å; F440-Y461 HydrophobicContact CE1-CD1 4.28Å; F440-Y461 AromaticContact CE1-CE1 3.67Å; F440-Y461 HydrophobicContact CE1-CE1 3.67Å; F440-F462 HydrophobicContact CE2-CD2 4.34Å; F440-F462 HydrophobicContact CE2-CE2 4.42Å; F440-F462 AromaticContact CZ-CD2 3.81Å; F440-F462 HydrophobicContact CZ-CD2 3.81Å; F440-F462 HydrophobicContact CZ-CE2 4.25Å; F440-K465 HydrophobicContact CE1-CB 3.79Å; F440-K465 HydrophobicContact CE1-CG 4.12Å; F440-K465 HydrophobicContact CZ-CB 4.35Å; F440-L517 HydrophobicContact CD2-CD2 3.9Å; F440-L517 HydrophobicContact CE2-CD2 3.79Å; F440-A521 HydrophobicContact CB-CB 4.46Å; F440-A521 HydrophobicContact CD2-CB 4.1Å; F440-T637 HydrophobicContact CD2-CG2 4Å; F440-T637 HydrophobicContact CE2-CG2 3.63Å; F440-L641 HydrophobicContact CB-CD2 4.26Å; F440-L641 HydrophobicContact CD1-CD1 4.12Å; F440-L641 HydrophobicContact CD1-CD2 4.37Å; F440-L641 HydrophobicContact CD2-CD1 4.28Å; F440-L641 HydrophobicContact CE1-CD1 3.96Å; F440-L641 HydrophobicContact CE2-CD1 4.13Å; F440-L641 HydrophobicContact CG-CD1 4.27Å; F440-L641 HydrophobicContact CG-CD2 4.22Å; F440-L641 HydrophobicContact CZ-CD1 3.97Å
441	V	87.1	Confident	89	Confident	18 Å²	18	35 Å²	35	11%	0.109	19%	0.185	C	C	.	.	H	α-helix	trans	-70.7	-46.5	-178.9	-175.8	0	0	0	0	110.9	E438 D443 R444 G520 V526	E438-V441 PolarHBondContact O-N 2.87Å; V441-D443 VanDerWaalsContact C-N 3.29Å; V441-D443 PolarHBondContact O-N 2.91Å; V441-R444 WeakPolarHBondContact O-CB 3.36Å; V441-R444 PolarHBondContact O-N 2.88Å; V441-G520 WeakPolarHBondContact CG2-O 3.47Å; V441-V526 HydrophobicContact CB-CG2 3.78Å; V441-V526 HydrophobicContact CG1-CG2 3.55Å; V441-V526 HydrophobicContact CG2-CG2 4.23Å
442	I	85.2	Confident	88.8	Confident	121 Å²	121	31.1 Å²	31.1	62%	0.621	17%	0.166	S	C	*	.	H	α-helix	trans	-62	-39.2	-177.5	-67.2	174.8	0	0	0	111.5	E438	E438-I442 HydrophobicContact CB-CD1 3.8Å; E438-I442 HydrophobicContact CB-CG1 4.28Å; E438-I442 HydrophobicContact CG-CD1 4.39Å; E438-I442 WeakPolarHBondContact O-CG1 3.31Å; E438-I442 PolarHBondContact O-N 2.83Å; E438-I442 VanDerWaalsContact O-N 3.13Å
443	D	86.6	Confident	88.8	Confident	25 Å²	25	28.9 Å²	28.9	13%	0.134	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	9.6	-176.3	-93.8	-33.7	0	0	0	113.6	V441 V445 R446 F447 K465	V441-D443 VanDerWaalsContact C-N 3.29Å; V441-D443 PolarHBondContact O-N 2.91Å; D443-V445 PolarHBondContact O-N 3.19Å; D443-R446 VanDerWaalsContact CG-NH2 3.29Å; D443-R446 PolarHBondContact O-N 3.18Å; D443-R446 IonicContact OD1-CZ 2.71Å; D443-R446 IonicContact OD1-NE 2.69Å; D443-R446 PolarHBondContact OD1-NE 3.11Å; D443-R446 IonicContact OD1-NH2 3.52Å; D443-R446 PolarHBondContact OD1-NH2 3.21Å; D443-R446 IonicContact OD2-CZ 3.15Å; D443-R446 IonicContact OD2-NE 3.55Å; D443-R446 IonicContact OD2-NH2 3Å; D443-R446 PolarHBondContact OD2-NH2 2.93Å; D443-F447 WeakPolarHBondContact O-CB 3.31Å; D443-F447 PolarHBondContact O-N 3.36Å; D443-K465 IonicContact OD2-NZ 3.29Å; D443-K465 PolarHBondContact OD2-NZ 2.92Å
444	R	87.7	Confident	88.7	Confident	42 Å²	42	28.9 Å²	28.9	16%	0.158	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-48.1	-171.6	-177.5	178.7	178.8	130.2	-0.6	113.3	F440 V441 R446 F447 L448 G522 E523 N524	F440-R444 WeakPolarHBondContact O-CA 3.42Å; F440-R444 WeakPolarHBondContact O-CB 3.19Å; F440-R444 PolarHBondContact O-N 3.09Å; F440-R444 VanDerWaalsContact O-N 3.17Å; V441-R444 WeakPolarHBondContact O-CB 3.36Å; V441-R444 PolarHBondContact O-N 2.88Å; R444-R446 VanDerWaalsContact C-N 3.27Å; R444-R446 PolarHBondContact O-N 3.23Å; R444-F447 PolarHBondContact O-N 2.93Å; R444-L448 HydrophobicContact CG-CD1 3.96Å; R444-L448 WeakPolarHBondContact O-CB 3.34Å; R444-L448 PolarHBondContact O-N 2.9Å; R444-G522 VanDerWaalsContact NH1-C 3.28Å; R444-G522 PolarHBondContact NH1-O 3.4Å; R444-E523 PolarHBondContact NH1-O 2.91Å; R444-N524 VanDerWaalsContact CZ-OD1 3.28Å; R444-N524 PolarHBondContact NH1-OD1 3.09Å
445	V	87.5	Confident	88.8	Confident	90 Å²	90	28 Å²	28	55%	0.545	15%	0.147	S	C	.	.	H	α-helix	trans	-59.8	-43.4	-179.5	177	0	0	0	0	110.3	V129 D443 H449	V129-V445 HydrophobicContact CG2-CG1 4.26Å; D443-V445 PolarHBondContact O-N 3.19Å; V445-H449 WeakPolarHBondContact O-CB 3.32Å; V445-H449 PolarHBondContact O-N 3.27Å
446	R	91.2	Very high	89.1	Confident	27 Å²	27	25.7 Å²	25.7	10%	0.102	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-47	177.9	-175.6	173.1	70.6	86.1	-1.5	112.1	V129 D443 R444 L448 H449 E450	V129-R446 HydrophobicContact CG1-CB 3.87Å; V129-R446 HydrophobicContact CG1-CG 3.84Å; D443-R446 VanDerWaalsContact CG-NH2 3.29Å; D443-R446 PolarHBondContact O-N 3.18Å; D443-R446 IonicContact OD1-CZ 2.71Å; D443-R446 IonicContact OD1-NE 2.69Å; D443-R446 PolarHBondContact OD1-NE 3.11Å; D443-R446 IonicContact OD1-NH2 3.52Å; D443-R446 PolarHBondContact OD1-NH2 3.21Å; D443-R446 IonicContact OD2-CZ 3.15Å; D443-R446 IonicContact OD2-NE 3.55Å; D443-R446 IonicContact OD2-NH2 3Å; D443-R446 PolarHBondContact OD2-NH2 2.93Å; R444-R446 VanDerWaalsContact C-N 3.27Å; R444-R446 PolarHBondContact O-N 3.23Å; R446-L448 VanDerWaalsContact C-N 3.35Å; R446-L448 PolarHBondContact O-N 2.88Å; R446-H449 PolarHBondContact O-N 2.87Å; R446-E450 VanDerWaalsContact CD-OE1 3.28Å; R446-E450 WeakPolarHBondContact CD-OE1 3.43Å; R446-E450 HydrophobicContact CG-CG 4.19Å; R446-E450 WeakPolarHBondContact CG-OE1 3.45Å; R446-E450 IonicContact CZ-OE1 3.7Å; R446-E450 IonicContact NH1-OE1 3.18Å; R446-E450 PolarHBondContact NH1-OE1 3.31Å; R446-E450 IonicContact NH1-OE2 2.8Å; R446-E450 PolarHBondContact NH1-OE2 3.4Å; R446-E450 WeakPolarHBondContact O-CB 3.28Å; R446-E450 WeakPolarHBondContact O-CG 3.29Å; R446-E450 PolarHBondContact O-N 2.81Å
447	F	91.8	Very high	89.1	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-55.6	-49.5	175.7	162.8	-109.1	0	0	0	111.8	D443 R444 H449 E450 H451 Y456 V458 Y461 L641	D443-F447 WeakPolarHBondContact O-CB 3.31Å; D443-F447 PolarHBondContact O-N 3.36Å; R444-F447 PolarHBondContact O-N 2.93Å; F447-H449 PolarHBondContact O-N 3.23Å; F447-E450 PolarHBondContact O-N 3.35Å; F447-H451 HydrophobicContact CD2-CB 4.39Å; F447-H451 HydrophobicContact CE2-CB 4.07Å; F447-H451 HydrophobicContact CZ-CB 4.42Å; F447-H451 WeakPolarHBondContact O-CB 3.48Å; F447-H451 PolarHBondContact O-N 2.93Å; F447-Y456 AromaticContact CD2-CE2 3.95Å; F447-Y456 HydrophobicContact CD2-CE2 3.95Å; F447-Y456 HydrophobicContact CE2-CE2 4.24Å; F447-V458 HydrophobicContact CE2-CG2 4.46Å; F447-V458 HydrophobicContact CZ-CG1 4.21Å; F447-V458 HydrophobicContact CZ-CG2 4.05Å; F447-Y461 HydrophobicContact CB-CE1 4.15Å; F447-Y461 HydrophobicContact CB-CE2 4.05Å; F447-Y461 AromaticContact CD2-CD1 3.35Å; F447-Y461 HydrophobicContact CD2-CD1 3.35Å; F447-Y461 AromaticContact CD2-CD2 3.81Å; F447-Y461 HydrophobicContact CD2-CD2 3.81Å; F447-Y461 AromaticContact CD2-CE1 3.49Å; F447-Y461 HydrophobicContact CD2-CE1 3.49Å; F447-Y461 VanDerWaalsContact CD2-CE1 3.49Å; F447-Y461 AromaticContact CD2-CE2 3.93Å; F447-Y461 HydrophobicContact CD2-CE2 3.93Å; F447-Y461 AromaticContact CD2-CG 3.51Å; F447-Y461 HydrophobicContact CD2-CG 3.51Å; F447-Y461 AromaticContact CD2-CZ 3.79Å; F447-Y461 AromaticContact CE2-CD1 3.55Å; F447-Y461 HydrophobicContact CE2-CD1 3.55Å; F447-Y461 HydrophobicContact CE2-CE1 4.06Å; F447-Y461 AromaticContact CE2-CG 3.82Å; F447-Y461 HydrophobicContact CE2-CG 3.82Å; F447-Y461 HydrophobicContact CG-CD1 4.15Å; F447-Y461 AromaticContact CG-CE1 3.82Å; F447-Y461 HydrophobicContact CG-CE1 3.82Å; F447-Y461 HydrophobicContact CG-CE2 4.36Å; F447-Y461 AromaticContact CG-CZ 3.95Å; F447-Y461 HydrophobicContact CZ-CD1 4.46Å; F447-L641 HydrophobicContact CE1-CD2 4.38Å
448	L	88.8	Confident	89.3	Confident	6 Å²	6	30.5 Å²	30.5	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-62.2	-44.2	-179.4	-81.5	170	0	0	0	111.7	R444 R446 T452 V644 I647	R444-L448 HydrophobicContact CG-CD1 3.96Å; R444-L448 WeakPolarHBondContact O-CB 3.34Å; R444-L448 PolarHBondContact O-N 2.9Å; R446-L448 VanDerWaalsContact C-N 3.35Å; R446-L448 PolarHBondContact O-N 2.88Å; L448-T452 VanDerWaalsContact O-CB 3.3Å; L448-T452 WeakPolarHBondContact O-CB 3.38Å; L448-T452 WeakPolarHBondContact O-CG2 3.17Å; L448-T452 PolarHBondContact O-N 2.67Å; L448-T452 PolarHBondContact O-OG1 3.45Å; L448-V644 HydrophobicContact CD1-CG1 4Å; L448-V644 HydrophobicContact CD2-CG1 3.8Å; L448-V644 HydrophobicContact CG-CG1 4.18Å; L448-I647 HydrophobicContact CB-CD1 4.42Å; L448-I647 HydrophobicContact CB-CG1 4.43Å; L448-I647 HydrophobicContact CD1-CD1 4.04Å; L448-I647 HydrophobicContact CD1-CG1 3.38Å; L448-I647 HydrophobicContact CG-CG1 4.47Å
449	H	90.9	Very high	89.6	Confident	18 Å²	18	28 Å²	28	8%	0.083	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-53.4	176.3	175.9	67.2	0	0	0	112	Y123 P125 V129 V445 R446 F447 H451 T452 S453	Y123-H449 PolarHBondContact O-CE1 3.02Å; P125-H449 VanDerWaalsContact CD-CE1 3.46Å; P125-H449 WeakPolarHBondContact CD-CE1 3.46Å; V129-H449 HydrophobicContact CB-CB 4.32Å; V129-H449 HydrophobicContact CG1-CB 4.02Å; V129-H449 HydrophobicContact CG2-CB 4.1Å; V445-H449 WeakPolarHBondContact O-CB 3.32Å; V445-H449 PolarHBondContact O-N 3.27Å; R446-H449 PolarHBondContact O-N 2.87Å; F447-H449 PolarHBondContact O-N 3.23Å; H449-H451 PolarHBondContact O-N 3.27Å; H449-T452 PolarHBondContact O-N 3.22Å; H449-T452 PolarHBondContact O-OG1 2.82Å; H449-T452 VanDerWaalsContact O-OG1 3.1Å; H449-S453 VanDerWaalsContact O-CB 3.31Å; H449-S453 WeakPolarHBondContact O-CB 3.3Å; H449-S453 PolarHBondContact O-N 3.37Å; H449-S453 PolarHBondContact O-OG 2.98Å
450	E	92.3	Very high	90	Very high	15 Å²	15	27.8 Å²	27.8	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-42.4	-178.3	-71.4	176.1	-166.2	0	0	111.5	R446 F447 S453 G454 Y455 Y456	R446-E450 VanDerWaalsContact CD-OE1 3.28Å; R446-E450 WeakPolarHBondContact CD-OE1 3.43Å; R446-E450 HydrophobicContact CG-CG 4.19Å; R446-E450 WeakPolarHBondContact CG-OE1 3.45Å; R446-E450 IonicContact CZ-OE1 3.7Å; R446-E450 IonicContact NH1-OE1 3.18Å; R446-E450 PolarHBondContact NH1-OE1 3.31Å; R446-E450 IonicContact NH1-OE2 2.8Å; R446-E450 PolarHBondContact NH1-OE2 3.4Å; R446-E450 WeakPolarHBondContact O-CB 3.28Å; R446-E450 WeakPolarHBondContact O-CG 3.29Å; R446-E450 PolarHBondContact O-N 2.81Å; F447-E450 PolarHBondContact O-N 3.35Å; E450-S453 PolarHBondContact O-N 3.31Å; E450-G454 PolarHBondContact O-N 3.27Å; E450-Y455 HydrophobicContact CB-CD2 4.11Å; E450-Y455 HydrophobicContact CB-CG 4.04Å; E450-Y455 HydrophobicContact CG-CD1 4.48Å; E450-Y455 HydrophobicContact CG-CD2 4.42Å; E450-Y455 HydrophobicContact CG-CG 4.35Å; E450-Y455 WeakPolarHBondContact O-CB 3.19Å; E450-Y455 VanDerWaalsContact O-CD2 3.26Å; E450-Y455 WeakPolarHBondContact O-CD2 3.34Å; E450-Y455 PolarHBondContact O-N 3.27Å; E450-Y456 HydrophobicContact CB-CE1 3.94Å; E450-Y456 HydrophobicContact CB-CE2 4.47Å; E450-Y456 WeakPolarHBondContact OE2-CE1 3.43Å; E450-Y456 PolarHBondContact OE2-OH 3.37Å
451	H	89.7	Confident	90.2	Very high	58 Å²	58	27.6 Å²	27.6	27%	0.269	14%	0.137	S	C	.	.	H	α-helix	trans	-65.2	-47.5	177.7	-179.8	52.1	0	0	0	111.7	F447 H449 S453 G454 Y456	F447-H451 HydrophobicContact CD2-CB 4.39Å; F447-H451 HydrophobicContact CE2-CB 4.07Å; F447-H451 HydrophobicContact CZ-CB 4.42Å; F447-H451 WeakPolarHBondContact O-CB 3.48Å; F447-H451 PolarHBondContact O-N 2.93Å; H449-H451 PolarHBondContact O-N 3.27Å; H451-S453 VanDerWaalsContact C-N 3.26Å; H451-S453 PolarHBondContact O-N 2.87Å; H451-G454 PolarHBondContact O-N 3.49Å; H451-G454 VanDerWaalsContact O-N 3.14Å; H451-Y456 HydrophobicContact CB-CE2 4.34Å; H451-Y456 PolarHBondContact ND1-O 2.85Å
452	T	86.7	Confident	90.6	Very high	17 Å²	17	27.1 Å²	27.1	10%	0.104	13%	0.134	C	C	.	.	H	α-helix	trans	-66.2	-31	178.6	54.9	0	0	0	0	111.9	R96 K118 L448 H449 G454 N646	R96-T452 PolarHBondContact NH1-O 3Å; R96-T452 PolarHBondContact NH1-OG1 3.43Å; K118-T452 WeakPolarHBondContact CB-O 3.4Å; L448-T452 VanDerWaalsContact O-CB 3.3Å; L448-T452 WeakPolarHBondContact O-CB 3.38Å; L448-T452 WeakPolarHBondContact O-CG2 3.17Å; L448-T452 PolarHBondContact O-N 2.67Å; L448-T452 PolarHBondContact O-OG1 3.45Å; H449-T452 PolarHBondContact O-N 3.22Å; H449-T452 PolarHBondContact O-OG1 2.82Å; H449-T452 VanDerWaalsContact O-OG1 3.1Å; T452-G454 PolarHBondContact O-N 3.31Å; T452-N646 WeakPolarHBondContact CG2-OD1 3.35Å
453	S	89.5	Confident	91	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	9.6	176.6	-57	0	0	0	0	113.8	R96 R147 H449 E450 H451	R96-S453 VanDerWaalsContact NH1-N 3.17Å; R96-S453 PolarHBondContact NH1-OG 2.96Å; R147-S453 PolarHBondContact NE-O 2.95Å; R147-S453 PolarHBondContact NH2-O 3.49Å; H449-S453 VanDerWaalsContact O-CB 3.31Å; H449-S453 WeakPolarHBondContact O-CB 3.3Å; H449-S453 PolarHBondContact O-N 3.37Å; H449-S453 PolarHBondContact O-OG 2.98Å; E450-S453 PolarHBondContact O-N 3.31Å; H451-S453 VanDerWaalsContact C-N 3.26Å; H451-S453 PolarHBondContact O-N 2.87Å
454	G	88.6	Confident	91.4	Very high	2 Å²	2	24.7 Å²	24.7	2%	0.021	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	21	171.1	0	0	0	0	0	115.3	C119 E450 H451 T452	C119-G454 VanDerWaalsContact SG-CA 3.59Å; E450-G454 PolarHBondContact O-N 3.27Å; H451-G454 PolarHBondContact O-N 3.49Å; H451-G454 VanDerWaalsContact O-N 3.14Å; T452-G454 PolarHBondContact O-N 3.31Å
455	Y	92.5	Very high	91.6	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.008	11%	0.11	C	C	.	.	S	Bend	trans	-66.5	-46.5	176.4	-77.4	-113.6	0	0	0	111.3	F142 S143 L146 R147 E450	F142-Y455 HydrophobicContact CD1-CD1 4.09Å; F142-Y455 HydrophobicContact CD1-CE1 4.1Å; F142-Y455 AromaticContact CE1-CD1 3.86Å; F142-Y455 HydrophobicContact CE1-CD1 3.86Å; F142-Y455 HydrophobicContact CE1-CE1 4.27Å; S143-Y455 WeakPolarHBondContact CB-OH 3.19Å; S143-Y455 PolarHBondContact OG-OH 2.87Å; L146-Y455 HydrophobicContact CB-CD1 4.37Å; L146-Y455 WeakPolarHBondContact CB-O 3.46Å; L146-Y455 HydrophobicContact CD1-CD1 4.09Å; R147-Y455 VanDerWaalsContact CD-CE2 3.49Å; R147-Y455 HydrophobicContact CG-CD1 4.45Å; R147-Y455 HydrophobicContact CG-CD2 4.25Å; R147-Y455 HydrophobicContact CG-CG 4.22Å; E450-Y455 HydrophobicContact CB-CD2 4.11Å; E450-Y455 HydrophobicContact CB-CG 4.04Å; E450-Y455 HydrophobicContact CG-CD1 4.48Å; E450-Y455 HydrophobicContact CG-CD2 4.42Å; E450-Y455 HydrophobicContact CG-CG 4.35Å; E450-Y455 WeakPolarHBondContact O-CB 3.19Å; E450-Y455 VanDerWaalsContact O-CD2 3.26Å; E450-Y455 WeakPolarHBondContact O-CD2 3.34Å; E450-Y455 PolarHBondContact O-N 3.27Å
456	Y	92.9	Very high	91.8	Very high	1 Å²	1	19.2 Å²	19.2	0%	0.004	9%	0.088	C	C	.	.			trans	-158.8	164.3	-175.4	49.5	-114.9	0	0	0	112.7	F142 L146 I372 F447 E450 H451 Y461	F142-Y456 HydrophobicContact CZ-CE1 4.26Å; L146-Y456 HydrophobicContact CD1-CD1 4Å; I372-Y456 HydrophobicContact CD1-CD1 3.66Å; I372-Y456 HydrophobicContact CD1-CD2 4.47Å; I372-Y456 HydrophobicContact CD1-CE1 4.25Å; I372-Y456 HydrophobicContact CD1-CG 3.78Å; I372-Y456 HydrophobicContact CG1-CD1 3.92Å; I372-Y456 HydrophobicContact CG1-CE1 4.27Å; F447-Y456 AromaticContact CD2-CE2 3.95Å; F447-Y456 HydrophobicContact CD2-CE2 3.95Å; F447-Y456 HydrophobicContact CE2-CE2 4.24Å; E450-Y456 HydrophobicContact CB-CE1 3.94Å; E450-Y456 HydrophobicContact CB-CE2 4.47Å; E450-Y456 WeakPolarHBondContact OE2-CE1 3.43Å; E450-Y456 PolarHBondContact OE2-OH 3.37Å; H451-Y456 HydrophobicContact CB-CE2 4.34Å; H451-Y456 PolarHBondContact ND1-O 2.85Å; Y456-Y461 HydrophobicContact CE1-CD2 4.49Å; Y456-Y461 AromaticContact CE2-CD2 3.74Å; Y456-Y461 HydrophobicContact CE2-CD2 3.74Å; Y456-Y461 AromaticContact CE2-CG 3.91Å; Y456-Y461 HydrophobicContact CE2-CG 3.91Å; Y456-Y461 AromaticContact CZ-CD2 3.63Å; Y456-Y461 VanDerWaalsContact OH-CD2 3.3Å; Y456-Y461 WeakPolarHBondContact OH-CD2 3.27Å
457	R	90.6	Very high	91.8	Very high	97 Å²	97	21.8 Å²	21.8	37%	0.366	10%	0.104	S	C	.	.			trans	-78.8	157.6	172.3	-55.9	176.8	-174.4	-144.3	-1.3	110.7	C361 Q368 S459 S460 Y461	C361-R457 HydrophobicContact CB-CG 4.43Å; C361-R457 VanDerWaalsContact SG-CG 3.57Å; C361-R457 PolarHBondContact SG-N 2.84Å; Q368-R457 VanDerWaalsContact OE1-N 3.13Å; R457-S459 VanDerWaalsContact C-N 3.26Å; R457-S459 PolarHBondContact O-N 2.92Å; R457-S460 PolarHBondContact O-N 3.29Å; R457-Y461 PolarHBondContact O-N 3Å; R457-Y461 VanDerWaalsContact O-N 3.14Å
458	V	91.9	Very high	91.6	Very high	9 Å²	9	21.9 Å²	21.9	6%	0.055	11%	0.105	C	C	.	.	H	α-helix	trans	-58.2	-39	176.1	-177.2	0	0	0	0	111.7	F447 Y461 F462 Y638 L641 L642	F447-V458 HydrophobicContact CE2-CG2 4.46Å; F447-V458 HydrophobicContact CZ-CG1 4.21Å; F447-V458 HydrophobicContact CZ-CG2 4.05Å; V458-Y461 PolarHBondContact O-N 3.39Å; V458-F462 VanDerWaalsContact O-CB 3.3Å; V458-F462 WeakPolarHBondContact O-CB 3.42Å; V458-F462 PolarHBondContact O-N 3.43Å; V458-Y638 HydrophobicContact CB-CE2 4.45Å; V458-Y638 HydrophobicContact CG1-CD2 4.41Å; V458-Y638 HydrophobicContact CG1-CE2 4.05Å; V458-L641 HydrophobicContact CG1-CB 3.81Å; V458-L642 HydrophobicContact CB-CD2 3.79Å; V458-L642 HydrophobicContact CG1-CD2 4.01Å; V458-L642 HydrophobicContact CG1-CG 4.24Å; V458-L642 HydrophobicContact CG2-CD2 3.91Å
459	S	93.7	Very high	91.4	Very high	25 Å²	25	21.8 Å²	21.8	18%	0.175	11%	0.105	C	C	.	.	H	α-helix	trans	-62.8	-45.2	177.2	55.5	0	0	0	0	112.7	R457 Y461 F462 F463	R457-S459 VanDerWaalsContact C-N 3.26Å; R457-S459 PolarHBondContact O-N 2.92Å; S459-Y461 VanDerWaalsContact C-N 3.3Å; S459-Y461 PolarHBondContact O-N 2.9Å; S459-F462 PolarHBondContact O-N 3.5Å; S459-F463 WeakPolarHBondContact O-CD2 3.2Å; S459-F463 PolarHBondContact O-N 3.3Å
460	S	94.8	Very high	91.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.2	-42.3	177.4	-53.7	0	0	0	0	111.4	F365 Q368 R457 G464	F365-S460 WeakPolarHBondContact CD2-OG 3.24Å; Q368-S460 PolarHBondContact OE1-OG 3.3Å; R457-S460 PolarHBondContact O-N 3.29Å; S460-G464 WeakPolarHBondContact O-CA 3.49Å; S460-G464 PolarHBondContact O-N 2.91Å
461	Y	94.3	Very high	90.8	Very high	3 Å²	3	23 Å²	23	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-48.9	175.3	176.3	-99.3	0	0	0	112.5	F440 F447 Y456 R457 V458 S459 G464 K465	F440-Y461 AromaticContact CD1-CE1 3.55Å; F440-Y461 HydrophobicContact CD1-CE1 3.55Å; F440-Y461 HydrophobicContact CE1-CD1 4.28Å; F440-Y461 AromaticContact CE1-CE1 3.67Å; F440-Y461 HydrophobicContact CE1-CE1 3.67Å; F447-Y461 HydrophobicContact CB-CE1 4.15Å; F447-Y461 HydrophobicContact CB-CE2 4.05Å; F447-Y461 AromaticContact CD2-CD1 3.35Å; F447-Y461 HydrophobicContact CD2-CD1 3.35Å; F447-Y461 AromaticContact CD2-CD2 3.81Å; F447-Y461 HydrophobicContact CD2-CD2 3.81Å; F447-Y461 AromaticContact CD2-CE1 3.49Å; F447-Y461 HydrophobicContact CD2-CE1 3.49Å; F447-Y461 VanDerWaalsContact CD2-CE1 3.49Å; F447-Y461 AromaticContact CD2-CE2 3.93Å; F447-Y461 HydrophobicContact CD2-CE2 3.93Å; F447-Y461 AromaticContact CD2-CG 3.51Å; F447-Y461 HydrophobicContact CD2-CG 3.51Å; F447-Y461 AromaticContact CD2-CZ 3.79Å; F447-Y461 AromaticContact CE2-CD1 3.55Å; F447-Y461 HydrophobicContact CE2-CD1 3.55Å; F447-Y461 HydrophobicContact CE2-CE1 4.06Å; F447-Y461 AromaticContact CE2-CG 3.82Å; F447-Y461 HydrophobicContact CE2-CG 3.82Å; F447-Y461 HydrophobicContact CG-CD1 4.15Å; F447-Y461 AromaticContact CG-CE1 3.82Å; F447-Y461 HydrophobicContact CG-CE1 3.82Å; F447-Y461 HydrophobicContact CG-CE2 4.36Å; F447-Y461 AromaticContact CG-CZ 3.95Å; F447-Y461 HydrophobicContact CZ-CD1 4.46Å; Y456-Y461 HydrophobicContact CE1-CD2 4.49Å; Y456-Y461 AromaticContact CE2-CD2 3.74Å; Y456-Y461 HydrophobicContact CE2-CD2 3.74Å; Y456-Y461 AromaticContact CE2-CG 3.91Å; Y456-Y461 HydrophobicContact CE2-CG 3.91Å; Y456-Y461 AromaticContact CZ-CD2 3.63Å; Y456-Y461 VanDerWaalsContact OH-CD2 3.3Å; Y456-Y461 WeakPolarHBondContact OH-CD2 3.27Å; R457-Y461 PolarHBondContact O-N 3Å; R457-Y461 VanDerWaalsContact O-N 3.14Å; V458-Y461 PolarHBondContact O-N 3.39Å; S459-Y461 VanDerWaalsContact C-N 3.3Å; S459-Y461 PolarHBondContact O-N 2.9Å; Y461-G464 PolarHBondContact O-N 3.35Å; Y461-K465 HydrophobicContact CD1-CG 4.43Å; Y461-K465 HydrophobicContact CD2-CG 4.06Å; Y461-K465 HydrophobicContact CE1-CG 4.08Å; Y461-K465 HydrophobicContact CE2-CD 4.26Å; Y461-K465 HydrophobicContact CE2-CG 3.69Å; Y461-K465 HydrophobicContact CG-CG 4.42Å; Y461-K465 WeakPolarHBondContact O-CB 3.13Å; Y461-K465 WeakPolarHBondContact O-CG 3.44Å; Y461-K465 PolarHBondContact O-N 3.48Å
462	F	94.7	Very high	90.4	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.035	11%	0.109	C	C	.	.	H	α-helix	trans	-57	-56.1	-179.5	175.6	-105.2	0	0	0	111.5	F440 V458 S459 G464 K465 L466 L634 T637 Y638 L641	F440-F462 HydrophobicContact CE2-CD2 4.34Å; F440-F462 HydrophobicContact CE2-CE2 4.42Å; F440-F462 AromaticContact CZ-CD2 3.81Å; F440-F462 HydrophobicContact CZ-CD2 3.81Å; F440-F462 HydrophobicContact CZ-CE2 4.25Å; V458-F462 VanDerWaalsContact O-CB 3.3Å; V458-F462 WeakPolarHBondContact O-CB 3.42Å; V458-F462 PolarHBondContact O-N 3.43Å; S459-F462 PolarHBondContact O-N 3.5Å; F462-G464 PolarHBondContact O-N 3.01Å; F462-K465 PolarHBondContact O-N 3.27Å; F462-L466 HydrophobicContact CD1-CD1 3.98Å; F462-L466 HydrophobicContact CD2-CD1 4.38Å; F462-L466 HydrophobicContact CE1-CD1 3.47Å; F462-L466 VanDerWaalsContact CE1-CD1 3.47Å; F462-L466 HydrophobicContact CE2-CD1 3.93Å; F462-L466 HydrophobicContact CE2-CG 4.45Å; F462-L466 HydrophobicContact CG-CD1 4.42Å; F462-L466 HydrophobicContact CZ-CD1 3.47Å; F462-L466 VanDerWaalsContact CZ-CD1 3.47Å; F462-L466 HydrophobicContact CZ-CG 4.44Å; F462-L466 WeakPolarHBondContact O-CG 3.07Å; F462-L466 PolarHBondContact O-N 2.7Å; F462-L634 HydrophobicContact CZ-CB 4.13Å; F462-L634 HydrophobicContact CZ-CD2 4.17Å; F462-L634 WeakPolarHBondContact CZ-O 3.4Å; F462-T637 HydrophobicContact CD2-CG2 4.5Å; F462-T637 HydrophobicContact CE2-CG2 3.81Å; F462-Y638 HydrophobicContact CB-CD2 4.13Å; F462-Y638 HydrophobicContact CD1-CD2 4.13Å; F462-Y638 HydrophobicContact CG-CD2 4.02Å; F462-L641 HydrophobicContact CB-CD1 4.49Å; F462-L641 HydrophobicContact CD2-CD1 3.76Å
463	F	95.1	Very high	90	Very high	94 Å²	94	24.3 Å²	24.3	41%	0.412	12%	0.117	S	C	.	.	H	α-helix	trans	-66.7	-37.4	178.9	-69.4	-62.4	0	0	0	112.1	F365 L369 S459 K465 L466 L467	F365-F463 HydrophobicContact CE2-CD2 4.17Å; F365-F463 AromaticContact CZ-CD2 3.92Å; F365-F463 HydrophobicContact CZ-CD2 3.92Å; L369-F463 HydrophobicContact CD1-CB 3.94Å; S459-F463 WeakPolarHBondContact O-CD2 3.2Å; S459-F463 PolarHBondContact O-N 3.3Å; F463-K465 PolarHBondContact O-N 2.87Å; F463-L466 PolarHBondContact O-N 3.4Å; F463-L467 WeakPolarHBondContact O-CB 3.17Å; F463-L467 VanDerWaalsContact O-CG 3.27Å; F463-L467 WeakPolarHBondContact O-CG 3.29Å; F463-L467 PolarHBondContact O-N 3.04Å
464	G	93.9	Very high	89.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-44.1	177.4	0	0	0	0	0	112.4	L369 S460 Y461 F462 A468	L369-G464 VanDerWaalsContact CD1-CA 3.41Å; L369-G464 VanDerWaalsContact CD1-N 3.26Å; S460-G464 WeakPolarHBondContact O-CA 3.49Å; S460-G464 PolarHBondContact O-N 2.91Å; Y461-G464 PolarHBondContact O-N 3.35Å; F462-G464 PolarHBondContact O-N 3.01Å; G464-A468 WeakPolarHBondContact O-CB 3.47Å; G464-A468 PolarHBondContact O-N 2.98Å
465	K	91.8	Very high	89.1	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-67.6	-42.7	176.5	-78	-63.1	-160.3	164.4	0	112.9	L439 F440 D443 Y461 F462 F463 E469 L470	L439-K465 HydrophobicContact CD2-CB 4.41Å; F440-K465 HydrophobicContact CE1-CB 3.79Å; F440-K465 HydrophobicContact CE1-CG 4.12Å; F440-K465 HydrophobicContact CZ-CB 4.35Å; D443-K465 IonicContact OD2-NZ 3.29Å; D443-K465 PolarHBondContact OD2-NZ 2.92Å; Y461-K465 HydrophobicContact CD1-CG 4.43Å; Y461-K465 HydrophobicContact CD2-CG 4.06Å; Y461-K465 HydrophobicContact CE1-CG 4.08Å; Y461-K465 HydrophobicContact CE2-CD 4.26Å; Y461-K465 HydrophobicContact CE2-CG 3.69Å; Y461-K465 HydrophobicContact CG-CG 4.42Å; Y461-K465 WeakPolarHBondContact O-CB 3.13Å; Y461-K465 WeakPolarHBondContact O-CG 3.44Å; Y461-K465 PolarHBondContact O-N 3.48Å; F462-K465 PolarHBondContact O-N 3.27Å; F463-K465 PolarHBondContact O-N 2.87Å; K465-E469 HydrophobicContact CD-CG 4.33Å; K465-E469 IonicContact NZ-OE1 2.71Å; K465-E469 PolarHBondContact NZ-OE1 3.48Å; K465-E469 IonicContact NZ-OE2 2.61Å; K465-E469 PolarHBondContact NZ-OE2 2.94Å; K465-E469 WeakPolarHBondContact O-CB 3.35Å; K465-E469 PolarHBondContact O-N 3.15Å; K465-L470 PolarHBondContact O-N 2.85Å
466	L	92.1	Very high	88.7	Confident	17 Å²	17	31 Å²	31	9%	0.089	15%	0.149	C	C	.	.	I	π-helix	trans	-59.3	-49.9	174.9	-71.5	177.7	0	0	0	110.9	F462 F463 L470 I471 L517 L634	F462-L466 HydrophobicContact CD1-CD1 3.98Å; F462-L466 HydrophobicContact CD2-CD1 4.38Å; F462-L466 HydrophobicContact CE1-CD1 3.47Å; F462-L466 VanDerWaalsContact CE1-CD1 3.47Å; F462-L466 HydrophobicContact CE2-CD1 3.93Å; F462-L466 HydrophobicContact CE2-CG 4.45Å; F462-L466 HydrophobicContact CG-CD1 4.42Å; F462-L466 HydrophobicContact CZ-CD1 3.47Å; F462-L466 VanDerWaalsContact CZ-CD1 3.47Å; F462-L466 HydrophobicContact CZ-CG 4.44Å; F462-L466 WeakPolarHBondContact O-CG 3.07Å; F462-L466 PolarHBondContact O-N 2.7Å; F463-L466 PolarHBondContact O-N 3.4Å; L466-L470 HydrophobicContact CD2-CB 4.43Å; L466-L470 HydrophobicContact CD2-CD2 3.71Å; L466-L470 WeakPolarHBondContact O-CB 3.49Å; L466-L470 PolarHBondContact O-N 3.24Å; L466-I471 WeakPolarHBondContact O-CG1 3.27Å; L466-I471 PolarHBondContact O-N 3.47Å; L466-L517 HydrophobicContact CD2-CD1 3.94Å; L466-L634 HydrophobicContact CD1-CD2 4.3Å; L466-L634 HydrophobicContact CD2-CD2 4.23Å
467	L	90.6	Very high	88.3	Confident	80 Å²	80	32.2 Å²	32.2	42%	0.419	16%	0.157	S	C	.	.	I	π-helix	trans	-70.3	-41.4	-176.5	-67.2	176.4	0	0	0	113.2	I373 F463 I471	I373-L467 HydrophobicContact CD1-CB 4.21Å; I373-L467 HydrophobicContact CD1-CD1 4.08Å; I373-L467 HydrophobicContact CG1-CB 4.48Å; F463-L467 WeakPolarHBondContact O-CB 3.17Å; F463-L467 VanDerWaalsContact O-CG 3.27Å; F463-L467 WeakPolarHBondContact O-CG 3.29Å; F463-L467 PolarHBondContact O-N 3.04Å; L467-I471 HydrophobicContact CD2-CD1 3.72Å
468	A	87.5	Confident	88.1	Confident	6 Å²	6	27.8 Å²	27.8	5%	0.05	14%	0.141	C	C	.	.	I	π-helix	trans	-89.2	-23.8	-172	0	0	0	0	0	114.3	I373 S376 G464 P472	I373-A468 HydrophobicContact CB-CB 4.18Å; I373-A468 HydrophobicContact CG1-CB 4.12Å; I373-A468 HydrophobicContact CG2-CB 4.07Å; S376-A468 VanDerWaalsContact CB-CB 3.44Å; G464-A468 WeakPolarHBondContact O-CB 3.47Å; G464-A468 PolarHBondContact O-N 2.98Å; A468-P472 WeakPolarHBondContact O-CD 3.39Å; A468-P472 WeakPolarHBondContact O-CG 3.08Å
469	E	85	Confident	87.9	Confident	5 Å²	5	28.4 Å²	28.4	2%	0.023	15%	0.145	C	C	.	.	I	π-helix	trans	-120	-43.5	-174.9	-61.2	-168.3	-166	0	0	112.9	S376 L439 K465 R473	S376-E469 PolarHBondContact OG-OE1 3.05Å; L439-E469 HydrophobicContact CD1-CB 3.76Å; L439-E469 WeakPolarHBondContact CD1-OE2 3.4Å; K465-E469 HydrophobicContact CD-CG 4.33Å; K465-E469 IonicContact NZ-OE1 2.71Å; K465-E469 PolarHBondContact NZ-OE1 3.48Å; K465-E469 IonicContact NZ-OE2 2.61Å; K465-E469 PolarHBondContact NZ-OE2 2.94Å; K465-E469 WeakPolarHBondContact O-CB 3.35Å; K465-E469 PolarHBondContact O-N 3.15Å; E469-R473 WeakPolarHBondContact O-CB 3.38Å; E469-R473 PolarHBondContact O-N 3.28Å; E469-R473 VanDerWaalsContact O-N 3.14Å; E469-R473 IonicContact OE1-NH2 3.19Å; E469-R473 IonicContact OE2-CZ 3.89Å; E469-R473 IonicContact OE2-NH1 3.27Å; E469-R473 PolarHBondContact OE2-NH1 3.07Å; E469-R473 IonicContact OE2-NH2 2.97Å; E469-R473 PolarHBondContact OE2-NH2 2.96Å
470	L	84.8	Confident	87.7	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.016	15%	0.151	C	C	.	.	I	π-helix	trans	-65.7	-47.2	-179.9	-168	68.3	0	0	0	111.1	A436 K465 L466 R474 L475 Y510 L517	A436-L470 HydrophobicContact CB-CD1 4.01Å; K465-L470 PolarHBondContact O-N 2.85Å; L466-L470 HydrophobicContact CD2-CB 4.43Å; L466-L470 HydrophobicContact CD2-CD2 3.71Å; L466-L470 WeakPolarHBondContact O-CB 3.49Å; L466-L470 PolarHBondContact O-N 3.24Å; L470-R474 HydrophobicContact CD1-CB 4.34Å; L470-R474 HydrophobicContact CD1-CG 4.48Å; L470-R474 WeakPolarHBondContact O-CB 3.21Å; L470-R474 PolarHBondContact O-N 3.09Å; L470-L475 HydrophobicContact CD2-CD1 4.26Å; L470-L475 HydrophobicContact CG-CD1 3.91Å; L470-L475 HydrophobicContact CG-CG 4.4Å; L470-L475 PolarHBondContact O-N 3.26Å; L470-L475 VanDerWaalsContact O-N 3.13Å; L470-Y510 HydrophobicContact CD2-CD1 4.37Å; L470-Y510 HydrophobicContact CD2-CE1 4.35Å; L470-L517 HydrophobicContact CD1-CD1 4.44Å; L470-L517 HydrophobicContact CD2-CD1 4.07Å
471	I	85.5	Confident	87.6	Confident	56 Å²	56	29.9 Å²	29.9	29%	0.287	15%	0.152	S	C	.	.	I	π-helix	trans	-63.8	-58.5	-177.8	-38.6	-168.1	0	0	0	111.6	L466 L467 L475 L476 Y510	L466-I471 WeakPolarHBondContact O-CG1 3.27Å; L466-I471 PolarHBondContact O-N 3.47Å; L467-I471 HydrophobicContact CD2-CD1 3.72Å; I471-L475 PolarHBondContact O-N 3.33Å; I471-L476 PolarHBondContact O-N 3.41Å; I471-Y510 WeakPolarHBondContact CD1-OH 3.4Å; I471-Y510 WeakPolarHBondContact CG1-OH 3.21Å
472	P	82.4	Confident	87.4	Confident	33 Å²	33	29.7 Å²	29.7	21%	0.214	15%	0.152	C	C	.	.	I	π-helix	trans	-77.4	-33.2	-170.1	-16.5	34.7	0	0	0	112.6	F377 A468	F377-P472 HydrophobicContact CE1-CB 4.46Å; F377-P472 HydrophobicContact CE1-CG 4.1Å; F377-P472 HydrophobicContact CZ-CG 4Å; A468-P472 WeakPolarHBondContact O-CD 3.39Å; A468-P472 WeakPolarHBondContact O-CG 3.08Å
473	R	77.7	Confident	87.1	Confident	69 Å²	69	32 Å²	32	26%	0.26	16%	0.164	S	C	.	.	I	π-helix	trans	-87.9	-31.7	-172.4	-162.2	-174.2	-64.2	147.6	1.9	113	E469	E469-R473 WeakPolarHBondContact O-CB 3.38Å; E469-R473 PolarHBondContact O-N 3.28Å; E469-R473 VanDerWaalsContact O-N 3.14Å; E469-R473 IonicContact OE1-NH2 3.19Å; E469-R473 IonicContact OE2-CZ 3.89Å; E469-R473 IonicContact OE2-NH1 3.27Å; E469-R473 PolarHBondContact OE2-NH1 3.07Å; E469-R473 IonicContact OE2-NH2 2.97Å; E469-R473 PolarHBondContact OE2-NH2 2.96Å
474	R	79.2	Confident	87	Confident	32 Å²	32	29.4 Å²	29.4	12%	0.121	15%	0.154	C	C	.	.	I	π-helix	trans	-115.3	-49.5	-171.5	-56.5	-161.2	-178.7	127.1	-12.5	112.6	S435 A436 L470	S435-R474 PolarHBondContact O-NE 3.46Å; S435-R474 PolarHBondContact O-NH2 3.24Å; A436-R474 PolarHBondContact O-NH1 2.98Å; A436-R474 PolarHBondContact O-NH2 3Å; L470-R474 HydrophobicContact CD1-CB 4.34Å; L470-R474 HydrophobicContact CD1-CG 4.48Å; L470-R474 WeakPolarHBondContact O-CB 3.21Å; L470-R474 PolarHBondContact O-N 3.09Å
475	L	80.1	Confident	86.8	Confident	7 Å²	7	29.4 Å²	29.4	4%	0.037	15%	0.154	C	C	.	.	I	π-helix	trans	-79	-38.8	-172.8	-63.9	162.4	0	0	0	112.8	L470 I471 S478 T479 A509 Y510	L470-L475 HydrophobicContact CD2-CD1 4.26Å; L470-L475 HydrophobicContact CG-CD1 3.91Å; L470-L475 HydrophobicContact CG-CG 4.4Å; L470-L475 PolarHBondContact O-N 3.26Å; L470-L475 VanDerWaalsContact O-N 3.13Å; I471-L475 PolarHBondContact O-N 3.33Å; L475-S478 PolarHBondContact O-N 3.43Å; L475-T479 WeakPolarHBondContact O-CB 3.44Å; L475-T479 PolarHBondContact O-N 2.88Å; L475-T479 PolarHBondContact O-OG1 2.95Å; L475-A509 HydrophobicContact CD2-CB 3.48Å; L475-A509 VanDerWaalsContact CD2-CB 3.48Å; L475-Y510 HydrophobicContact CD1-CD1 3.77Å; L475-Y510 HydrophobicContact CD1-CD2 3.61Å; L475-Y510 HydrophobicContact CD1-CE1 3.38Å; L475-Y510 HydrophobicContact CD1-CE2 3.23Å; L475-Y510 HydrophobicContact CD1-CG 3.88Å; L475-Y510 HydrophobicContact CD2-CD2 4.04Å; L475-Y510 HydrophobicContact CD2-CE2 4.38Å; L475-Y510 HydrophobicContact CD2-CG 4.29Å; L475-Y510 HydrophobicContact CG-CD2 4.41Å; L475-Y510 HydrophobicContact CG-CE2 4.28Å
476	L	83.9	Confident	86.6	Confident	104 Å²	104	29.5 Å²	29.5	55%	0.545	15%	0.154	S	C	.	.	H	α-helix	trans	-60.3	-51.7	179.5	-171.9	85.3	0	0	0	112.4	I471 S478 T479 V480	I471-L476 PolarHBondContact O-N 3.41Å; L476-S478 PolarHBondContact O-N 2.9Å; L476-T479 PolarHBondContact O-N 3.33Å; L476-V480 VanDerWaalsContact O-CG2 3.29Å; L476-V480 WeakPolarHBondContact O-CG2 3.27Å; L476-V480 PolarHBondContact O-N 3.45Å
477	P	85.6	Confident	86.4	Confident	27 Å²	27	32.3 Å²	32.3	18%	0.175	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-38.9	176.5	-24.1	34.5	0	0	0	112.5	T394 V480 F481	T394-P477 HydrophobicContact CG2-CB 4.36Å; T394-P477 WeakPolarHBondContact CG2-O 3.35Å; P477-V480 PolarHBondContact O-N 3.38Å; P477-F481 WeakPolarHBondContact O-CB 3.34Å; P477-F481 PolarHBondContact O-N 3.21Å
478	S	85.7	Confident	86.3	Confident	4 Å²	4	30.6 Å²	30.6	3%	0.028	16%	0.163	C	C	.	.	H	α-helix	trans	-69.2	-36.9	-178.7	-154.9	0	0	0	0	112.9	Q429 T432 L475 L476 S482	Q429-S478 PolarHBondContact NE2-O 2.9Å; Q429-S478 PolarHBondContact NE2-OG 3.37Å; Q429-S478 VanDerWaalsContact OE1-CB 3.29Å; Q429-S478 PolarHBondContact OE1-OG 3.49Å; T432-S478 PolarHBondContact OG1-OG 2.97Å; L475-S478 PolarHBondContact O-N 3.43Å; L476-S478 PolarHBondContact O-N 2.9Å; S478-S482 PolarHBondContact O-N 3.45Å; S478-S482 PolarHBondContact O-OG 2.91Å
479	T	87.2	Confident	86.2	Confident	22 Å²	22	30.3 Å²	30.3	14%	0.135	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-39.3	175.1	-54.6	0	0	0	0	110.8	L475 L476 S482 L483 I502 M506	L475-T479 WeakPolarHBondContact O-CB 3.44Å; L475-T479 PolarHBondContact O-N 2.88Å; L475-T479 PolarHBondContact O-OG1 2.95Å; L476-T479 PolarHBondContact O-N 3.33Å; T479-S482 PolarHBondContact O-N 3.33Å; T479-L483 VanDerWaalsContact O-CB 3.28Å; T479-L483 WeakPolarHBondContact O-CB 3.38Å; T479-L483 PolarHBondContact O-N 2.84Å; T479-I502 HydrophobicContact CG2-CG2 4.16Å; T479-M506 HydrophobicContact CG2-CG 4.09Å
480	V	90.1	Very high	85.7	Confident	52 Å²	52	32 Å²	32	32%	0.315	18%	0.18	S	C	.	.	H	α-helix	trans	-62.9	-43.3	174.8	170.8	0	0	0	0	111.3	L476 P477 S482 L483 I484	L476-V480 VanDerWaalsContact O-CG2 3.29Å; L476-V480 WeakPolarHBondContact O-CG2 3.27Å; L476-V480 PolarHBondContact O-N 3.45Å; P477-V480 PolarHBondContact O-N 3.38Å; V480-S482 PolarHBondContact O-N 2.88Å; V480-L483 PolarHBondContact O-N 3.4Å; V480-I484 HydrophobicContact CG1-CD1 3.71Å; V480-I484 HydrophobicContact CG1-CG1 4.39Å; V480-I484 WeakPolarHBondContact O-CG1 3.35Å; V480-I484 PolarHBondContact O-N 3.44Å
481	F	91.7	Very high	85.2	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-55.6	-51.5	175.5	173.6	-91	0	0	0	111.6	T394 L397 A398 V401 L425 F428 P477 L483 I484 T485	T394-F481 HydrophobicContact CG2-CB 3.75Å; T394-F481 HydrophobicContact CG2-CD2 4.37Å; L397-F481 HydrophobicContact CB-CE2 4.2Å; L397-F481 HydrophobicContact CD2-CE2 4.09Å; L397-F481 HydrophobicContact CG-CE2 3.9Å; A398-F481 VanDerWaalsContact CA-CE2 3.47Å; A398-F481 HydrophobicContact CB-CB 4.46Å; A398-F481 HydrophobicContact CB-CD2 3.5Å; A398-F481 VanDerWaalsContact CB-CD2 3.5Å; A398-F481 HydrophobicContact CB-CE2 3.91Å; A398-F481 HydrophobicContact CB-CG 4.14Å; V401-F481 HydrophobicContact CB-CZ 4.44Å; V401-F481 HydrophobicContact CG2-CZ 4.26Å; L425-F481 HydrophobicContact CD2-CD1 4.47Å; L425-F481 HydrophobicContact CD2-CE1 4.07Å; F428-F481 HydrophobicContact CB-CD1 4.42Å; F428-F481 HydrophobicContact CB-CE1 3.99Å; F428-F481 HydrophobicContact CD1-CB 4.32Å; F428-F481 AromaticContact CD1-CD1 3.26Å; F428-F481 HydrophobicContact CD1-CD1 3.26Å; F428-F481 AromaticContact CD1-CE1 3.64Å; F428-F481 HydrophobicContact CD1-CE1 3.64Å; F428-F481 AromaticContact CD1-CG 3.81Å; F428-F481 HydrophobicContact CD1-CG 3.81Å; F428-F481 HydrophobicContact CD1-CZ 4.45Å; F428-F481 HydrophobicContact CD2-CD1 4.2Å; F428-F481 AromaticContact CD2-CE1 3.85Å; F428-F481 HydrophobicContact CD2-CE1 3.85Å; F428-F481 HydrophobicContact CD2-CE2 4.35Å; F428-F481 AromaticContact CD2-CZ 3.94Å; F428-F481 HydrophobicContact CD2-CZ 3.94Å; F428-F481 HydrophobicContact CE1-CB 3.62Å; F428-F481 AromaticContact CE1-CD1 3.37Å; F428-F481 HydrophobicContact CE1-CD1 3.37Å; F428-F481 AromaticContact CE1-CD2 3.99Å; F428-F481 HydrophobicContact CE1-CD2 3.99Å; F428-F481 HydrophobicContact CE1-CE1 4.03Å; F428-F481 AromaticContact CE1-CG 3.36Å; F428-F481 HydrophobicContact CE1-CG 3.36Å; F428-F481 HydrophobicContact CE2-CD1 4.29Å; F428-F481 HydrophobicContact CE2-CD2 4.09Å; F428-F481 HydrophobicContact CE2-CE1 4.23Å; F428-F481 HydrophobicContact CE2-CE2 4.03Å; F428-F481 HydrophobicContact CE2-CG 4.24Å; F428-F481 HydrophobicContact CE2-CZ 4.11Å; F428-F481 AromaticContact CG-CD1 3.7Å; F428-F481 HydrophobicContact CG-CD1 3.7Å; F428-F481 AromaticContact CG-CE1 3.53Å; F428-F481 HydrophobicContact CG-CE1 3.53Å; F428-F481 HydrophobicContact CG-CG 4.4Å; F428-F481 HydrophobicContact CG-CZ 4.12Å; F428-F481 HydrophobicContact CZ-CB 4.07Å; F428-F481 AromaticContact CZ-CD1 3.9Å; F428-F481 HydrophobicContact CZ-CD1 3.9Å; F428-F481 AromaticContact CZ-CD2 3.72Å; F428-F481 HydrophobicContact CZ-CD2 3.72Å; F428-F481 HydrophobicContact CZ-CE1 4.3Å; F428-F481 HydrophobicContact CZ-CE2 4.15Å; F428-F481 AromaticContact CZ-CG 3.61Å; F428-F481 HydrophobicContact CZ-CG 3.61Å; F428-F481 HydrophobicContact CZ-CZ 4.42Å; P477-F481 WeakPolarHBondContact O-CB 3.34Å; P477-F481 PolarHBondContact O-N 3.21Å; F481-L483 PolarHBondContact O-N 3.43Å; F481-I484 PolarHBondContact O-N 2.62Å; F481-T485 WeakPolarHBondContact O-CB 3.45Å; F481-T485 PolarHBondContact O-N 3.41Å; F481-T485 PolarHBondContact O-OG1 2.94Å
482	S	90.1	Very high	84.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-38.1	-179.2	-66.2	0	0	0	0	112.6	Q429 S478 T479 V480 T485 Y486	Q429-S482 PolarHBondContact NE2-OG 3.2Å; S478-S482 PolarHBondContact O-N 3.45Å; S478-S482 PolarHBondContact O-OG 2.91Å; T479-S482 PolarHBondContact O-N 3.33Å; V480-S482 PolarHBondContact O-N 2.88Å; S482-T485 PolarHBondContact O-N 2.94Å; S482-Y486 WeakPolarHBondContact O-CB 3.3Å; S482-Y486 PolarHBondContact O-N 3.44Å
483	L	90	Very high	84.1	Confident	57 Å²	57	35 Å²	35	30%	0.298	19%	0.191	S	C	.	.	H	α-helix	trans	-59.2	-50.9	175.9	173.6	61	0	0	0	111.6	T479 V480 F481 T485 Y486 V487 F498 I502	T479-L483 VanDerWaalsContact O-CB 3.28Å; T479-L483 WeakPolarHBondContact O-CB 3.38Å; T479-L483 PolarHBondContact O-N 2.84Å; V480-L483 PolarHBondContact O-N 3.4Å; F481-L483 PolarHBondContact O-N 3.43Å; L483-T485 PolarHBondContact O-N 3.48Å; L483-Y486 PolarHBondContact O-N 2.93Å; L483-V487 HydrophobicContact CD1-CG2 4.12Å; L483-V487 VanDerWaalsContact O-CG2 3.3Å; L483-V487 WeakPolarHBondContact O-CG2 3.49Å; L483-V487 PolarHBondContact O-N 3.48Å; L483-V487 VanDerWaalsContact O-N 3.08Å; L483-F498 HydrophobicContact CD1-CE2 3.38Å; L483-F498 HydrophobicContact CD1-CZ 3.37Å; L483-I502 HydrophobicContact CD1-CD1 4.27Å
484	I	92.1	Very high	84.3	Confident	39 Å²	39	34.1 Å²	34.1	20%	0.2	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-46.1	-179.6	-68.1	168.3	0	0	0	110.3	V395 A398 T399 V480 F481 Y486 V487 I488	V395-I484 HydrophobicContact CB-CD1 4.46Å; V395-I484 HydrophobicContact CG1-CD1 4.35Å; V395-I484 HydrophobicContact CG2-CD1 3.98Å; A398-I484 HydrophobicContact CB-CB 3.78Å; A398-I484 HydrophobicContact CB-CD1 4.33Å; A398-I484 HydrophobicContact CB-CG2 3.69Å; T399-I484 HydrophobicContact CG2-CG2 3.99Å; V480-I484 HydrophobicContact CG1-CD1 3.71Å; V480-I484 HydrophobicContact CG1-CG1 4.39Å; V480-I484 WeakPolarHBondContact O-CG1 3.35Å; V480-I484 PolarHBondContact O-N 3.44Å; F481-I484 PolarHBondContact O-N 2.62Å; I484-Y486 PolarHBondContact O-N 3.42Å; I484-V487 PolarHBondContact O-N 3.21Å; I484-I488 HydrophobicContact CG2-CD1 3.7Å; I484-I488 WeakPolarHBondContact O-CG1 3.33Å; I484-I488 PolarHBondContact O-N 3.23Å; I484-I488 VanDerWaalsContact O-N 3.1Å
485	T	90.6	Very high	84.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-45.5	-179.2	-55.4	0	0	0	0	111.1	A398 V401 L421 L425 F481 S482 L483 I488 A489	A398-T485 PolarHBondContact O-OG1 3.49Å; V401-T485 HydrophobicContact CB-CG2 4.33Å; V401-T485 HydrophobicContact CG1-CG2 3.76Å; L421-T485 HydrophobicContact CD1-CG2 3.87Å; L425-T485 HydrophobicContact CD2-CG2 3.99Å; F481-T485 WeakPolarHBondContact O-CB 3.45Å; F481-T485 PolarHBondContact O-N 3.41Å; F481-T485 PolarHBondContact O-OG1 2.94Å; S482-T485 PolarHBondContact O-N 2.94Å; L483-T485 PolarHBondContact O-N 3.48Å; T485-I488 PolarHBondContact O-N 3.23Å; T485-A489 VanDerWaalsContact O-CB 3.25Å; T485-A489 WeakPolarHBondContact O-CB 3.49Å; T485-A489 PolarHBondContact O-N 2.97Å
486	Y	86.1	Confident	84.8	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-44	-179.4	-172.8	-90.4	0	0	0	112.4	S482 L483 I484 A489 G490 V491 K492 M493 F498 M501	S482-Y486 WeakPolarHBondContact O-CB 3.3Å; S482-Y486 PolarHBondContact O-N 3.44Å; L483-Y486 PolarHBondContact O-N 2.93Å; I484-Y486 PolarHBondContact O-N 3.42Å; Y486-A489 PolarHBondContact O-N 3.48Å; Y486-G490 PolarHBondContact O-N 3.48Å; Y486-V491 HydrophobicContact CD1-CB 4.43Å; Y486-V491 HydrophobicContact CD2-CB 3.86Å; Y486-V491 HydrophobicContact CD2-CG1 4.02Å; Y486-V491 HydrophobicContact CD2-CG2 4.08Å; Y486-V491 HydrophobicContact CE1-CB 4.07Å; Y486-V491 HydrophobicContact CE2-CB 3.45Å; Y486-V491 VanDerWaalsContact CE2-CB 3.45Å; Y486-V491 HydrophobicContact CE2-CG1 3.25Å; Y486-V491 HydrophobicContact CE2-CG2 4.12Å; Y486-V491 HydrophobicContact CG-CB 4.34Å; Y486-K492 PolarHBondContact OH-N 3.42Å; Y486-K492 PolarHBondContact OH-O 3.27Å; Y486-K492 VanDerWaalsContact OH-O 3.06Å; Y486-M493 HydrophobicContact CD1-SD 4.47Å; Y486-M493 HydrophobicContact CE1-SD 4.2Å; Y486-F498 HydrophobicContact CD1-CD2 4.38Å; Y486-F498 HydrophobicContact CE1-CD2 4.34Å; Y486-M501 HydrophobicContact CD1-SD 4.24Å; Y486-M501 HydrophobicContact CD2-CG 4.19Å; Y486-M501 HydrophobicContact CD2-SD 3.41Å; Y486-M501 WeakPolarHBondContact CD2-SD 3.28Å; Y486-M501 HydrophobicContact CE2-CG 4.07Å; Y486-M501 HydrophobicContact CE2-SD 3.87Å; Y486-M501 HydrophobicContact CG-SD 3.61Å
487	V	88	Confident	84.9	Confident	77 Å²	77	43.1 Å²	43.1	47%	0.467	24%	0.235	S	C	.	.	H	α-helix	trans	-64.6	-42.2	179.3	171	0	0	0	0	111.4	L483 I484 F498	L483-V487 HydrophobicContact CD1-CG2 4.12Å; L483-V487 VanDerWaalsContact O-CG2 3.3Å; L483-V487 WeakPolarHBondContact O-CG2 3.49Å; L483-V487 PolarHBondContact O-N 3.48Å; L483-V487 VanDerWaalsContact O-N 3.08Å; I484-V487 PolarHBondContact O-N 3.21Å; V487-F498 HydrophobicContact CG2-CE2 4.31Å
488	I	88.8	Confident	85	Confident	43 Å²	43	44.1 Å²	44.1	22%	0.221	24%	0.237	C	C	.	.	H	α-helix	trans	-71.7	-36.3	-179.5	-63.5	170.3	0	0	0	111.5	T399 G402 T403 I484 T485 G490	T399-I488 HydrophobicContact CG2-CD1 3.92Å; G402-I488 WeakPolarHBondContact O-CG2 3.34Å; T403-I488 HydrophobicContact CG2-CG2 4.07Å; I484-I488 HydrophobicContact CG2-CD1 3.7Å; I484-I488 WeakPolarHBondContact O-CG1 3.33Å; I484-I488 PolarHBondContact O-N 3.23Å; I484-I488 VanDerWaalsContact O-N 3.1Å; T485-I488 PolarHBondContact O-N 3.23Å; I488-G490 PolarHBondContact O-N 2.68Å
489	A	85.1	Confident	85.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.9	-15.2	-179.1	0	0	0	0	0	113.7	F405 L408 L421 T485 Y486 V491	F405-A489 HydrophobicContact CB-CB 4.01Å; L408-A489 HydrophobicContact CD1-CB 4.17Å; L408-A489 WeakPolarHBondContact CD1-O 3.27Å; L421-A489 HydrophobicContact CD2-CB 3.44Å; L421-A489 VanDerWaalsContact CD2-CB 3.44Å; T485-A489 VanDerWaalsContact O-CB 3.25Å; T485-A489 WeakPolarHBondContact O-CB 3.49Å; T485-A489 PolarHBondContact O-N 2.97Å; Y486-A489 PolarHBondContact O-N 3.48Å; A489-V491 HydrophobicContact CB-CG2 3.8Å
490	G	76.1	Confident	85.3	Confident	42 Å²	42	49.6 Å²	49.6	43%	0.433	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	23.5	174.3	0	0	0	0	0	114.6	Y486 I488	Y486-G490 PolarHBondContact O-N 3.48Å; I488-G490 PolarHBondContact O-N 2.68Å
491	V	74.2	Confident	85.3	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.03	25%	0.246	C	C	.	.			trans	-69.1	173.4	-177.9	-167	0	0	0	0	110.9	L408 L421 Y486 A489 M493 E577	L408-V491 HydrophobicContact CD1-CG2 4.46Å; L421-V491 HydrophobicContact CD2-CG2 3.69Å; Y486-V491 HydrophobicContact CD1-CB 4.43Å; Y486-V491 HydrophobicContact CD2-CB 3.86Å; Y486-V491 HydrophobicContact CD2-CG1 4.02Å; Y486-V491 HydrophobicContact CD2-CG2 4.08Å; Y486-V491 HydrophobicContact CE1-CB 4.07Å; Y486-V491 HydrophobicContact CE2-CB 3.45Å; Y486-V491 VanDerWaalsContact CE2-CB 3.45Å; Y486-V491 HydrophobicContact CE2-CG1 3.25Å; Y486-V491 HydrophobicContact CE2-CG2 4.12Å; Y486-V491 HydrophobicContact CG-CB 4.34Å; A489-V491 HydrophobicContact CB-CG2 3.8Å; V491-M493 WeakPolarHBondContact O-CE 3.43Å; V491-M493 PolarHBondContact O-N 2.89Å; V491-M493 VanDerWaalsContact O-SD 3.41Å; V491-E577 HydrophobicContact CG1-CG 4.03Å; V491-E577 WeakPolarHBondContact CG1-OE1 3.39Å; V491-E577 WeakPolarHBondContact CG1-OE2 3.43Å
492	K	74.1	Confident	85.2	Confident	47 Å²	47	48.4 Å²	48.4	20%	0.204	25%	0.253	C	S	.	.			trans	-51.6	96.1	-172.7	-169.7	179.3	-175.1	176.6	0	114.4	Y486 S494 C497 E577 L579 Q581	Y486-K492 PolarHBondContact OH-N 3.42Å; Y486-K492 PolarHBondContact OH-O 3.27Å; Y486-K492 VanDerWaalsContact OH-O 3.06Å; K492-S494 PolarHBondContact O-N 3.32Å; K492-C497 HydrophobicContact CD-CB 4.09Å; K492-C497 VanDerWaalsContact CD-SG 3.53Å; K492-C497 VanDerWaalsContact CE-SG 3.51Å; K492-C497 HydrophobicContact CG-CB 4.26Å; K492-E577 WeakPolarHBondContact CB-OE2 3.46Å; K492-E577 PolarHBondContact N-OE2 3.49Å; K492-L579 PolarHBondContact NZ-O 2.56Å; K492-Q581 VanDerWaalsContact CD-NE2 3.34Å
493	M	70	Confident	85.3	Confident	103 Å²	103	51.5 Å²	51.5	51%	0.507	27%	0.274	S	S	.	.			trans	-78.9	16.4	-173.4	-123.2	68.5	73.6	0	0	115.5	Y486 V491 M495	Y486-M493 HydrophobicContact CD1-SD 4.47Å; Y486-M493 HydrophobicContact CE1-SD 4.2Å; V491-M493 WeakPolarHBondContact O-CE 3.43Å; V491-M493 PolarHBondContact O-N 2.89Å; V491-M493 VanDerWaalsContact O-SD 3.41Å; M493-M495 PolarHBondContact O-N 2.94Å
494	S	82.3	Confident	85.5	Confident	50 Å²	50	48.8 Å²	48.8	35%	0.35	26%	0.259	S	S	.	.			trans	-65.3	138.4	175.2	78.5	0	0	0	0	110	K492 K496 C497 F498	K492-S494 PolarHBondContact O-N 3.32Å; S494-K496 PolarHBondContact O-N 3.03Å; S494-K496 VanDerWaalsContact O-N 3.15Å; S494-C497 PolarHBondContact O-N 2.69Å; S494-C497 VanDerWaalsContact OG-CB 3.27Å; S494-C497 WeakPolarHBondContact OG-CB 3.5Å; S494-C497 PolarHBondContact OG-N 3.42Å; S494-C497 PolarHBondContact OG-SG 3.25Å; S494-F498 WeakPolarHBondContact O-CB 3.49Å; S494-F498 PolarHBondContact O-N 3.34Å
495	M	82.4	Confident	85.5	Confident	150 Å²	150	47 Å²	47	74%	0.739	25%	0.25	S	S	*	.	H	α-helix	trans	-54.7	-40.2	-174.7	-165.2	-179.2	-131.2	0	0	112	M493 F499	M493-M495 PolarHBondContact O-N 2.94Å; M495-F499 HydrophobicContact CE-CE2 4.38Å; M495-F499 HydrophobicContact CG-CD2 3.99Å; M495-F499 HydrophobicContact CG-CE2 3.69Å; M495-F499 WeakPolarHBondContact O-CD2 3.47Å; M495-F499 PolarHBondContact O-N 2.92Å
496	K	87.2	Confident	85.6	Confident	170 Å²	170	50.4 Å²	50.4	74%	0.739	27%	0.267	S	S	*	.	H	α-helix	trans	-62.2	-53.9	175.9	-174.7	-179.2	176.2	-175.6	0	111.5	S494 F498 F499 T500	S494-K496 PolarHBondContact O-N 3.03Å; S494-K496 VanDerWaalsContact O-N 3.15Å; K496-F498 VanDerWaalsContact C-N 3.28Å; K496-F498 PolarHBondContact O-N 3.35Å; K496-F499 PolarHBondContact O-N 3.46Å; K496-T500 WeakPolarHBondContact O-CB 3.49Å; K496-T500 PolarHBondContact O-N 2.99Å; K496-T500 PolarHBondContact O-OG1 2.78Å
497	C	86.5	Confident	85.9	Confident	11 Å²	11	52 Å²	52	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-34.3	-177.1	-66.4	0	0	0	0	112.6	K492 S494 M501 N576	K492-C497 HydrophobicContact CD-CB 4.09Å; K492-C497 VanDerWaalsContact CD-SG 3.53Å; K492-C497 VanDerWaalsContact CE-SG 3.51Å; K492-C497 HydrophobicContact CG-CB 4.26Å; S494-C497 PolarHBondContact O-N 2.69Å; S494-C497 VanDerWaalsContact OG-CB 3.27Å; S494-C497 WeakPolarHBondContact OG-CB 3.5Å; S494-C497 PolarHBondContact OG-N 3.42Å; S494-C497 PolarHBondContact OG-SG 3.25Å; C497-M501 WeakPolarHBondContact O-CB 3.37Å; C497-M501 PolarHBondContact O-N 3.04Å; C497-N576 WeakPolarHBondContact CA-OD1 3.45Å; C497-N576 PolarHBondContact O-ND2 3.49Å
498	F	87	Confident	86.2	Confident	48 Å²	48	48.3 Å²	48.3	21%	0.211	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-52.8	176.3	175.9	-99.5	0	0	0	112.3	L483 Y486 V487 S494 K496 T500 M501 I502	L483-F498 HydrophobicContact CD1-CE2 3.38Å; L483-F498 HydrophobicContact CD1-CZ 3.37Å; Y486-F498 HydrophobicContact CD1-CD2 4.38Å; Y486-F498 HydrophobicContact CE1-CD2 4.34Å; V487-F498 HydrophobicContact CG2-CE2 4.31Å; S494-F498 WeakPolarHBondContact O-CB 3.49Å; S494-F498 PolarHBondContact O-N 3.34Å; K496-F498 VanDerWaalsContact C-N 3.28Å; K496-F498 PolarHBondContact O-N 3.35Å; F498-T500 VanDerWaalsContact C-N 3.35Å; F498-T500 PolarHBondContact O-N 3.08Å; F498-M501 WeakPolarHBondContact O-CB 3.29Å; F498-M501 PolarHBondContact O-N 3.49Å; F498-I502 HydrophobicContact CD1-CD1 4.06Å; F498-I502 HydrophobicContact CE1-CD1 3.46Å; F498-I502 VanDerWaalsContact CE1-CD1 3.46Å; F498-I502 HydrophobicContact CE2-CD1 4.18Å; F498-I502 HydrophobicContact CZ-CD1 3.55Å; F498-I502 WeakPolarHBondContact O-CG1 3.23Å; F498-I502 PolarHBondContact O-N 3.33Å; F498-I502 VanDerWaalsContact O-N 3.09Å
499	F	88.9	Confident	86.4	Confident	114 Å²	114	46.3 Å²	46.3	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-38.9	178.6	-75.7	-64.3	0	0	0	112.2	M495 K496 M501 I502 C503	M495-F499 HydrophobicContact CE-CE2 4.38Å; M495-F499 HydrophobicContact CG-CD2 3.99Å; M495-F499 HydrophobicContact CG-CE2 3.69Å; M495-F499 WeakPolarHBondContact O-CD2 3.47Å; M495-F499 PolarHBondContact O-N 2.92Å; K496-F499 PolarHBondContact O-N 3.46Å; F499-M501 VanDerWaalsContact C-N 3.31Å; F499-M501 PolarHBondContact O-N 3.47Å; F499-I502 PolarHBondContact O-N 3.41Å; F499-C503 PolarHBondContact O-N 3.02Å; F499-C503 PolarHBondContact O-SG 3.28Å
500	T	90.6	Very high	86.8	Confident	27 Å²	27	49.3 Å²	49.3	17%	0.166	26%	0.256	C	S	.	.	H	α-helix	trans	-57.8	-45.3	174	-60.5	0	0	0	0	111.1	K496 F498 I502 C503 T504 N576 F619	K496-T500 WeakPolarHBondContact O-CB 3.49Å; K496-T500 PolarHBondContact O-N 2.99Å; K496-T500 PolarHBondContact O-OG1 2.78Å; F498-T500 VanDerWaalsContact C-N 3.35Å; F498-T500 PolarHBondContact O-N 3.08Å; T500-I502 PolarHBondContact O-N 3.21Å; T500-C503 PolarHBondContact O-N 3.04Å; T500-T504 PolarHBondContact O-N 2.9Å; T500-T504 PolarHBondContact O-OG1 3.45Å; T500-N576 WeakPolarHBondContact CB-OD1 3.26Å; T500-N576 HydrophobicContact CG2-CB 4.31Å; T500-N576 WeakPolarHBondContact CG2-OD1 3.5Å; T500-F619 HydrophobicContact CG2-CE1 3.75Å; T500-F619 HydrophobicContact CG2-CE2 3.8Å; T500-F619 HydrophobicContact CG2-CZ 3.08Å
501	M	89.6	Confident	87.7	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-46.6	176.7	-173.5	-120.7	65.4	0	0	111.5	Y486 C497 F498 F499 C503 T504 I505 L573	Y486-M501 HydrophobicContact CD1-SD 4.24Å; Y486-M501 HydrophobicContact CD2-CG 4.19Å; Y486-M501 HydrophobicContact CD2-SD 3.41Å; Y486-M501 WeakPolarHBondContact CD2-SD 3.28Å; Y486-M501 HydrophobicContact CE2-CG 4.07Å; Y486-M501 HydrophobicContact CE2-SD 3.87Å; Y486-M501 HydrophobicContact CG-SD 3.61Å; C497-M501 WeakPolarHBondContact O-CB 3.37Å; C497-M501 PolarHBondContact O-N 3.04Å; F498-M501 WeakPolarHBondContact O-CB 3.29Å; F498-M501 PolarHBondContact O-N 3.49Å; F499-M501 VanDerWaalsContact C-N 3.31Å; F499-M501 PolarHBondContact O-N 3.47Å; M501-C503 VanDerWaalsContact C-N 3.31Å; M501-C503 PolarHBondContact O-N 3.39Å; M501-T504 PolarHBondContact O-N 3.42Å; M501-I505 HydrophobicContact CE-CB 4.49Å; M501-I505 HydrophobicContact CE-CD1 3.42Å; M501-I505 VanDerWaalsContact CE-CD1 3.42Å; M501-I505 HydrophobicContact CE-CG1 4.07Å; M501-I505 HydrophobicContact CG-CD1 4.11Å; M501-I505 HydrophobicContact CG-CG1 4.44Å; M501-I505 WeakPolarHBondContact O-CG1 3.5Å; M501-I505 PolarHBondContact O-N 2.82Å; M501-I505 HydrophobicContact SD-CD1 3.66Å; M501-L573 HydrophobicContact CG-CD2 3.76Å
502	I	89.7	Confident	88.7	Confident	29 Å²	29	47.1 Å²	47.1	15%	0.149	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-45.3	179.5	-65.9	176.7	0	0	0	109.9	T479 L483 F498 F499 T500 I505 M506	T479-I502 HydrophobicContact CG2-CG2 4.16Å; L483-I502 HydrophobicContact CD1-CD1 4.27Å; F498-I502 HydrophobicContact CD1-CD1 4.06Å; F498-I502 HydrophobicContact CE1-CD1 3.46Å; F498-I502 VanDerWaalsContact CE1-CD1 3.46Å; F498-I502 HydrophobicContact CE2-CD1 4.18Å; F498-I502 HydrophobicContact CZ-CD1 3.55Å; F498-I502 WeakPolarHBondContact O-CG1 3.23Å; F498-I502 PolarHBondContact O-N 3.33Å; F498-I502 VanDerWaalsContact O-N 3.09Å; F499-I502 PolarHBondContact O-N 3.41Å; T500-I502 PolarHBondContact O-N 3.21Å; I502-I505 PolarHBondContact O-N 3.31Å; I502-M506 HydrophobicContact CG2-CE 3.93Å; I502-M506 HydrophobicContact CG2-CG 4.48Å; I502-M506 HydrophobicContact CG2-SD 4.29Å; I502-M506 WeakPolarHBondContact O-CG 3.35Å; I502-M506 PolarHBondContact O-N 3.13Å
503	C	92.1	Very high	89.6	Confident	65 Å²	65	45 Å²	45	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-59.2	-47.2	175.5	-74	0	0	0	0	112.2	F499 T500 M501 I505 M506 V507	F499-C503 PolarHBondContact O-N 3.02Å; F499-C503 PolarHBondContact O-SG 3.28Å; T500-C503 PolarHBondContact O-N 3.04Å; M501-C503 VanDerWaalsContact C-N 3.31Å; M501-C503 PolarHBondContact O-N 3.39Å; C503-I505 VanDerWaalsContact C-N 3.35Å; C503-I505 PolarHBondContact O-N 3.09Å; C503-M506 PolarHBondContact O-N 3.27Å; C503-V507 WeakPolarHBondContact O-CG2 3.11Å; C503-V507 PolarHBondContact O-N 2.79Å
504	T	93.9	Very high	90.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-44.3	178.2	-56.3	0	0	0	0	111.7	T500 M501 V507 L508 A572 L573 H623	T500-T504 PolarHBondContact O-N 2.9Å; T500-T504 PolarHBondContact O-OG1 3.45Å; M501-T504 PolarHBondContact O-N 3.42Å; T504-V507 PolarHBondContact O-N 3.35Å; T504-L508 VanDerWaalsContact O-CB 3.29Å; T504-L508 WeakPolarHBondContact O-CB 3.4Å; T504-L508 PolarHBondContact O-N 3.46Å; T504-A572 HydrophobicContact CG2-CB 3.52Å; T504-L573 HydrophobicContact CG2-CD2 4Å; T504-L573 HydrophobicContact CG2-CG 4Å; T504-H623 WeakPolarHBondContact CA-NE2 3.43Å; T504-H623 PolarHBondContact OG1-CE1 2.83Å; T504-H623 PolarHBondContact OG1-NE2 2.72Å
505	I	93	Very high	91.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-42.2	179.3	-69.5	-171.4	0	0	0	111.4	L425 Q429 M501 I502 C503 L508 A509 L573	L425-I505 HydrophobicContact CD1-CD1 4.39Å; Q429-I505 HydrophobicContact CG-CG2 3.96Å; M501-I505 HydrophobicContact CE-CB 4.49Å; M501-I505 HydrophobicContact CE-CD1 3.42Å; M501-I505 VanDerWaalsContact CE-CD1 3.42Å; M501-I505 HydrophobicContact CE-CG1 4.07Å; M501-I505 HydrophobicContact CG-CD1 4.11Å; M501-I505 HydrophobicContact CG-CG1 4.44Å; M501-I505 WeakPolarHBondContact O-CG1 3.5Å; M501-I505 PolarHBondContact O-N 2.82Å; M501-I505 HydrophobicContact SD-CD1 3.66Å; I502-I505 PolarHBondContact O-N 3.31Å; C503-I505 VanDerWaalsContact C-N 3.35Å; C503-I505 PolarHBondContact O-N 3.09Å; I505-L508 PolarHBondContact O-N 3.32Å; I505-A509 VanDerWaalsContact O-CB 3.28Å; I505-A509 WeakPolarHBondContact O-CB 3.3Å; I505-A509 PolarHBondContact O-N 3.05Å; I505-L573 HydrophobicContact CD1-CD2 4.5Å; I505-L573 HydrophobicContact CG1-CD2 4.07Å
506	M	91.2	Very high	91.9	Very high	72 Å²	72	31.7 Å²	31.7	36%	0.355	16%	0.156	S	C	.	.	H	α-helix	trans	-61.6	-49.8	175.4	-72.9	-172.8	-57.7	0	0	111	T479 I502 C503 L508 A509 Y510	T479-M506 HydrophobicContact CG2-CG 4.09Å; I502-M506 HydrophobicContact CG2-CE 3.93Å; I502-M506 HydrophobicContact CG2-CG 4.48Å; I502-M506 HydrophobicContact CG2-SD 4.29Å; I502-M506 WeakPolarHBondContact O-CG 3.35Å; I502-M506 PolarHBondContact O-N 3.13Å; C503-M506 PolarHBondContact O-N 3.27Å; M506-L508 VanDerWaalsContact C-N 3.35Å; M506-L508 PolarHBondContact O-N 3.43Å; M506-A509 PolarHBondContact O-N 3.1Å; M506-Y510 VanDerWaalsContact O-CD2 3.3Å; M506-Y510 WeakPolarHBondContact O-CD2 3.28Å; M506-Y510 PolarHBondContact O-N 3.03Å
507	V	93.5	Very high	92.2	Very high	35 Å²	35	23.6 Å²	23.6	21%	0.212	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-45.7	179.7	173	0	0	0	0	110.8	C503 T504 A509 Y510 S511 L626 V627	C503-V507 WeakPolarHBondContact O-CG2 3.11Å; C503-V507 PolarHBondContact O-N 2.79Å; T504-V507 PolarHBondContact O-N 3.35Å; V507-A509 PolarHBondContact O-N 2.95Å; V507-Y510 PolarHBondContact O-N 3.29Å; V507-S511 WeakPolarHBondContact O-CB 3.43Å; V507-S511 PolarHBondContact O-N 2.74Å; V507-S511 PolarHBondContact O-OG 2.96Å; V507-S511 VanDerWaalsContact O-OG 3.04Å; V507-L626 HydrophobicContact CG1-CB 3.62Å; V507-L626 HydrophobicContact CG1-CD1 4Å; V507-L626 HydrophobicContact CG1-CG 4.46Å; V507-V627 HydrophobicContact CG1-CG2 4.06Å
508	L	95.1	Very high	92.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-56.6	-48.3	174.6	171.4	60.4	0	0	0	111.9	T426 Q429 T504 I505 M506 Y510 S511 A512 I565 L626	T426-L508 HydrophobicContact CG2-CD2 3.91Å; Q429-L508 HydrophobicContact CB-CD2 3.89Å; Q429-L508 HydrophobicContact CB-CG 4.06Å; Q429-L508 HydrophobicContact CG-CD2 4.06Å; T504-L508 VanDerWaalsContact O-CB 3.29Å; T504-L508 WeakPolarHBondContact O-CB 3.4Å; T504-L508 PolarHBondContact O-N 3.46Å; I505-L508 PolarHBondContact O-N 3.32Å; M506-L508 VanDerWaalsContact C-N 3.35Å; M506-L508 PolarHBondContact O-N 3.43Å; L508-Y510 VanDerWaalsContact C-N 3.35Å; L508-Y510 PolarHBondContact O-N 2.88Å; L508-S511 PolarHBondContact O-N 3Å; L508-A512 VanDerWaalsContact O-CB 3.23Å; L508-A512 WeakPolarHBondContact O-CB 3.21Å; L508-A512 PolarHBondContact O-N 3.44Å; L508-I565 HydrophobicContact CD1-CG2 3.84Å; L508-L626 HydrophobicContact CD1-CD2 4.44Å
509	A	93.1	Very high	92.6	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-64.1	-39	-178.5	0	0	0	0	0	112.2	Q429 S433 L475 I505 M506 V507 S513	Q429-A509 VanDerWaalsContact OE1-CB 3.29Å; S433-A509 PolarHBondContact OG-O 2.73Å; L475-A509 HydrophobicContact CD2-CB 3.48Å; L475-A509 VanDerWaalsContact CD2-CB 3.48Å; I505-A509 VanDerWaalsContact O-CB 3.28Å; I505-A509 WeakPolarHBondContact O-CB 3.3Å; I505-A509 PolarHBondContact O-N 3.05Å; M506-A509 PolarHBondContact O-N 3.1Å; V507-A509 PolarHBondContact O-N 2.95Å; A509-S513 VanDerWaalsContact O-CB 3.24Å; A509-S513 WeakPolarHBondContact O-CB 3.31Å; A509-S513 PolarHBondContact O-N 3.35Å; A509-S513 PolarHBondContact O-OG 2.82Å
510	Y	92.2	Very high	92.4	Very high	64 Å²	64	18.4 Å²	18.4	25%	0.251	10%	0.1	S	C	.	.	H	α-helix	trans	-66.6	-47.7	175.2	-93.9	-86.1	0	0	0	112.3	L470 I471 L475 M506 V507 L508 A512 S513 S514 M630	L470-Y510 HydrophobicContact CD2-CD1 4.37Å; L470-Y510 HydrophobicContact CD2-CE1 4.35Å; I471-Y510 WeakPolarHBondContact CD1-OH 3.4Å; I471-Y510 WeakPolarHBondContact CG1-OH 3.21Å; L475-Y510 HydrophobicContact CD1-CD1 3.77Å; L475-Y510 HydrophobicContact CD1-CD2 3.61Å; L475-Y510 HydrophobicContact CD1-CE1 3.38Å; L475-Y510 HydrophobicContact CD1-CE2 3.23Å; L475-Y510 HydrophobicContact CD1-CG 3.88Å; L475-Y510 HydrophobicContact CD2-CD2 4.04Å; L475-Y510 HydrophobicContact CD2-CE2 4.38Å; L475-Y510 HydrophobicContact CD2-CG 4.29Å; L475-Y510 HydrophobicContact CG-CD2 4.41Å; L475-Y510 HydrophobicContact CG-CE2 4.28Å; M506-Y510 VanDerWaalsContact O-CD2 3.3Å; M506-Y510 WeakPolarHBondContact O-CD2 3.28Å; M506-Y510 PolarHBondContact O-N 3.03Å; V507-Y510 PolarHBondContact O-N 3.29Å; L508-Y510 VanDerWaalsContact C-N 3.35Å; L508-Y510 PolarHBondContact O-N 2.88Å; Y510-A512 VanDerWaalsContact C-N 3.33Å; Y510-A512 PolarHBondContact O-N 3.37Å; Y510-S513 PolarHBondContact O-N 3.45Å; Y510-S514 PolarHBondContact O-N 2.93Å; Y510-M630 HydrophobicContact CD1-SD 4.34Å; Y510-M630 HydrophobicContact CG-SD 4.39Å
511	S	94.8	Very high	92.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-44.4	177.2	-59.2	0	0	0	0	110.6	V507 L508 S513 S514 L626	V507-S511 WeakPolarHBondContact O-CB 3.43Å; V507-S511 PolarHBondContact O-N 2.74Å; V507-S511 PolarHBondContact O-OG 2.96Å; V507-S511 VanDerWaalsContact O-OG 3.04Å; L508-S511 PolarHBondContact O-N 3Å; S511-S513 VanDerWaalsContact C-N 3.35Å; S511-S513 PolarHBondContact O-N 3.47Å; S511-S514 PolarHBondContact O-N 3.28Å; S511-S514 PolarHBondContact O-OG 3.46Å; S511-L626 VanDerWaalsContact OG-C 3.26Å; S511-L626 PolarHBondContact OG-O 3.2Å
512	A	95	Very high	91.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-40.5	175.3	0	0	0	0	0	112.2	S433 L508 Y510 S514 L515 P516 F537 I565	S433-A512 WeakPolarHBondContact OG-CB 3.34Å; L508-A512 VanDerWaalsContact O-CB 3.23Å; L508-A512 WeakPolarHBondContact O-CB 3.21Å; L508-A512 PolarHBondContact O-N 3.44Å; Y510-A512 VanDerWaalsContact C-N 3.33Å; Y510-A512 PolarHBondContact O-N 3.37Å; A512-S514 VanDerWaalsContact C-N 3.3Å; A512-S514 PolarHBondContact O-N 3.16Å; A512-L515 PolarHBondContact O-N 3.3Å; A512-P516 WeakPolarHBondContact O-CD 3.28Å; A512-F537 HydrophobicContact CB-CE1 4.2Å; A512-F537 HydrophobicContact CB-CZ 3.95Å; A512-I565 HydrophobicContact CB-CG2 4.14Å
513	S	94.2	Very high	90.9	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-68.1	-27	177.2	-69.3	0	0	0	0	113.5	S433 A509 Y510 S511 L515 P516 L517	S433-S513 PolarHBondContact OG-OG 3.24Å; A509-S513 VanDerWaalsContact O-CB 3.24Å; A509-S513 WeakPolarHBondContact O-CB 3.31Å; A509-S513 PolarHBondContact O-N 3.35Å; A509-S513 PolarHBondContact O-OG 2.82Å; Y510-S513 PolarHBondContact O-N 3.45Å; S511-S513 VanDerWaalsContact C-N 3.35Å; S511-S513 PolarHBondContact O-N 3.47Å; S513-L515 VanDerWaalsContact C-N 3.3Å; S513-L515 PolarHBondContact O-N 3.04Å; S513-P516 WeakPolarHBondContact O-CD 3.45Å; S513-L517 WeakPolarHBondContact O-CD1 3.28Å; S513-L517 VanDerWaalsContact O-CG 3.27Å; S513-L517 WeakPolarHBondContact O-CG 3.32Å
514	S	94.8	Very high	90	Very high	1 Å²	1	25 Å²	25	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-28.9	-179.9	72	0	0	0	0	113.4	Y510 S511 A512 L517 S518 L633	Y510-S514 PolarHBondContact O-N 2.93Å; S511-S514 PolarHBondContact O-N 3.28Å; S511-S514 PolarHBondContact O-OG 3.46Å; A512-S514 VanDerWaalsContact C-N 3.3Å; A512-S514 PolarHBondContact O-N 3.16Å; S514-L517 PolarHBondContact O-N 2.92Å; S514-S518 WeakPolarHBondContact O-CB 3.34Å; S514-S518 PolarHBondContact O-N 3.38Å; S514-L633 WeakPolarHBondContact OG-CB 3.46Å; S514-L633 VanDerWaalsContact OG-CD1 3.26Å; S514-L633 WeakPolarHBondContact OG-CD1 3.3Å
515	L	94.9	Very high	89.5	Confident	21 Å²	21	27.8 Å²	27.8	11%	0.11	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-58.6	180	-178.8	67.9	0	0	0	113.3	A512 S513 L517 S518 I519 V533 Y536 F537 I565 L633	A512-L515 PolarHBondContact O-N 3.3Å; S513-L515 VanDerWaalsContact C-N 3.3Å; S513-L515 PolarHBondContact O-N 3.04Å; L515-L517 PolarHBondContact O-N 3.24Å; L515-S518 PolarHBondContact O-N 3.05Å; L515-S518 PolarHBondContact O-OG 3.41Å; L515-I519 HydrophobicContact CD1-CD1 4.22Å; L515-I519 HydrophobicContact CG-CD1 4.44Å; L515-I519 PolarHBondContact O-N 3.18Å; L515-V533 HydrophobicContact CD2-CG1 4.43Å; L515-Y536 HydrophobicContact CD2-CD1 3.18Å; L515-Y536 HydrophobicContact CD2-CD2 4.38Å; L515-Y536 HydrophobicContact CD2-CE1 3.28Å; L515-Y536 HydrophobicContact CD2-CE2 4.43Å; L515-Y536 HydrophobicContact CD2-CG 3.8Å; L515-F537 HydrophobicContact CD2-CZ 4.28Å; L515-I565 HydrophobicContact CB-CD1 4.29Å; L515-L633 HydrophobicContact CB-CD1 4.04Å; L515-L633 HydrophobicContact CD1-CD1 4.19Å; L515-L633 HydrophobicContact CD1-CD2 4.12Å
516	P	93.7	Very high	89	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.019	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-28	176.8	21.9	-30.7	0	0	0	113.1	S433 A436 G437 A512 S513 I519 G520 V533	S433-P516 WeakPolarHBondContact O-CG 3.33Å; A436-P516 HydrophobicContact CB-CG 4.01Å; G437-P516 WeakPolarHBondContact CA-O 3.49Å; A512-P516 WeakPolarHBondContact O-CD 3.28Å; S513-P516 WeakPolarHBondContact O-CD 3.45Å; P516-I519 PolarHBondContact O-N 3Å; P516-G520 PolarHBondContact O-N 3.19Å; P516-V533 HydrophobicContact CB-CB 4.38Å; P516-V533 HydrophobicContact CB-CG1 3.98Å; P516-V533 HydrophobicContact CB-CG2 3.81Å; P516-V533 HydrophobicContact CG-CG1 4.2Å
517	L	92.9	Very high	88.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-42.2	171.6	-70.4	172.1	0	0	0	111.9	A436 L439 F440 L466 L470 S513 S514 L515 I519 A521 L634 T637	A436-L517 HydrophobicContact CB-CG 4.29Å; A436-L517 WeakPolarHBondContact O-CD2 3.41Å; L439-L517 HydrophobicContact CB-CD2 3.77Å; L439-L517 HydrophobicContact CD2-CD2 3.95Å; L439-L517 HydrophobicContact CG-CD2 4.48Å; F440-L517 HydrophobicContact CD2-CD2 3.9Å; F440-L517 HydrophobicContact CE2-CD2 3.79Å; L466-L517 HydrophobicContact CD2-CD1 3.94Å; L470-L517 HydrophobicContact CD1-CD1 4.44Å; L470-L517 HydrophobicContact CD2-CD1 4.07Å; S513-L517 WeakPolarHBondContact O-CD1 3.28Å; S513-L517 VanDerWaalsContact O-CG 3.27Å; S513-L517 WeakPolarHBondContact O-CG 3.32Å; S514-L517 PolarHBondContact O-N 2.92Å; L515-L517 PolarHBondContact O-N 3.24Å; L517-I519 VanDerWaalsContact C-N 3.31Å; L517-I519 PolarHBondContact O-N 2.88Å; L517-A521 WeakPolarHBondContact O-CB 3.42Å; L517-A521 PolarHBondContact O-N 3.46Å; L517-A521 VanDerWaalsContact O-N 3.09Å; L517-L634 HydrophobicContact CD1-CD2 4.2Å; L517-T637 HydrophobicContact CB-CG2 4.16Å
518	S	92.1	Very high	88.6	Confident	8 Å²	8	32.6 Å²	32.6	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-69.2	-24.7	179.2	76.3	0	0	0	0	114.3	S514 L515 L633 T637 Q640	S514-S518 WeakPolarHBondContact O-CB 3.34Å; S514-S518 PolarHBondContact O-N 3.38Å; L515-S518 PolarHBondContact O-N 3.05Å; L515-S518 PolarHBondContact O-OG 3.41Å; S518-L633 WeakPolarHBondContact CB-O 3.15Å; S518-T637 WeakPolarHBondContact CA-OG1 3.42Å; S518-T637 PolarHBondContact N-OG1 3.23Å; S518-T637 VanDerWaalsContact N-OG1 3.16Å; S518-Q640 PolarHBondContact O-NE2 2.02Å; S518-Q640 PolarHBondContact O-OE1 3.47Å
519	I	90.4	Very high	88.4	Confident	55 Å²	55	32.9 Å²	32.9	28%	0.282	20%	0.2	S	C	.	.	H	α-helix	trans	-92.6	-34.6	177.2	-58.6	176.2	0	0	0	110.1	L515 P516 L517 P529 V533	L515-I519 HydrophobicContact CD1-CD1 4.22Å; L515-I519 HydrophobicContact CG-CD1 4.44Å; L515-I519 PolarHBondContact O-N 3.18Å; P516-I519 PolarHBondContact O-N 3Å; L517-I519 VanDerWaalsContact C-N 3.31Å; L517-I519 PolarHBondContact O-N 2.88Å; I519-P529 HydrophobicContact CB-CB 4.47Å; I519-P529 HydrophobicContact CG2-CB 3.79Å; I519-P529 HydrophobicContact CG2-CG 4.26Å; I519-V533 HydrophobicContact CD1-CG2 3.76Å
520	G	84.6	Confident	88.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-80.4	-30.8	-175.7	0	0	0	0	0	115.4	V441 P516 G522 E523	V441-G520 WeakPolarHBondContact CG2-O 3.47Å; P516-G520 PolarHBondContact O-N 3.19Å; G520-G522 VanDerWaalsContact C-N 3.3Å; G520-G522 PolarHBondContact O-N 3.01Å; G520-E523 PolarHBondContact O-N 2.92Å; G520-E523 VanDerWaalsContact O-N 3.11Å
521	A	82.9	Confident	88.3	Confident	5 Å²	5	37 Å²	37	4%	0.041	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.6	-168.8	0	0	0	0	0	115	F440 L517 T637 Q640 L641	F440-A521 HydrophobicContact CB-CB 4.46Å; F440-A521 HydrophobicContact CD2-CB 4.1Å; L517-A521 WeakPolarHBondContact O-CB 3.42Å; L517-A521 PolarHBondContact O-N 3.46Å; L517-A521 VanDerWaalsContact O-N 3.09Å; A521-T637 HydrophobicContact CB-CG2 3.71Å; A521-Q640 HydrophobicContact CB-CB 4.38Å; A521-L641 HydrophobicContact CB-CD2 4.23Å; A521-L641 HydrophobicContact CB-CG 4.15Å
522	G	75.5	Confident	88.2	Confident	30 Å²	30	41.5 Å²	41.5	31%	0.309	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.9	176.7	0	0	0	0	0	115	R444 G520	R444-G522 VanDerWaalsContact NH1-C 3.28Å; R444-G522 PolarHBondContact NH1-O 3.4Å; G520-G522 VanDerWaalsContact C-N 3.3Å; G520-G522 PolarHBondContact O-N 3.01Å
523	E	78.4	Confident	88.2	Confident	102 Å²	102	41.5 Å²	41.5	48%	0.477	25%	0.25	S	S	.	.			trans	-92.3	157.3	-165.5	-69.4	-63.4	153	0	0	113.6	R444 G520 P529	R444-E523 PolarHBondContact NH1-O 2.91Å; G520-E523 PolarHBondContact O-N 2.92Å; G520-E523 VanDerWaalsContact O-N 3.11Å; E523-P529 HydrophobicContact CB-CG 3.98Å; E523-P529 HydrophobicContact CG-CG 3.82Å
524	N	74	Confident	88.2	Confident	125 Å²	125	44 Å²	44	67%	0.668	27%	0.266	S	S	*	.	S	Bend	trans	-90.9	-21	176.1	-70.3	-18.2	0	0	0	112.5	R444	R444-N524 VanDerWaalsContact CZ-OD1 3.28Å; R444-N524 PolarHBondContact NH1-OD1 3.09Å
525	A	82.8	Confident	88.2	Confident	57 Å²	57	48.9 Å²	48.9	47%	0.471	29%	0.291	S	S	.	.			trans	-129.8	141.8	-176.7	0	0	0	0	0	110.8	P529	A525-P529 VanDerWaalsContact O-CD 3.27Å; A525-P529 WeakPolarHBondContact O-CD 3.49Å
526	V	83.7	Confident	88.2	Confident	37 Å²	37	50.5 Å²	50.5	22%	0.224	30%	0.296	C	S	.	.	S	Bend	trans	-79.4	-28	-176.7	177.3	0	0	0	0	112.4	E438 V441 V528 P529 T530	E438-V526 HydrophobicContact CG-CB 4.44Å; E438-V526 HydrophobicContact CG-CG1 3.51Å; E438-V526 HydrophobicContact CG-CG2 4.06Å; V441-V526 HydrophobicContact CB-CG2 3.78Å; V441-V526 HydrophobicContact CG1-CG2 3.55Å; V441-V526 HydrophobicContact CG2-CG2 4.23Å; V526-V528 PolarHBondContact O-N 3.38Å; V526-P529 WeakPolarHBondContact O-CD 3.38Å; V526-T530 WeakPolarHBondContact CG1-OG1 3.42Å; V526-T530 VanDerWaalsContact O-CB 3.28Å; V526-T530 WeakPolarHBondContact O-CB 3.5Å; V526-T530 PolarHBondContact O-N 2.79Å; V526-T530 PolarHBondContact O-OG1 3.03Å
527	A	89.1	Confident	88.3	Confident	74 Å²	74	50.5 Å²	50.5	61%	0.612	30%	0.295	S	S	*	.	H	α-helix	trans	-60.4	-49.9	-167.2	0	0	0	0	0	113.4	T530 L531	A527-T530 PolarHBondContact O-N 3.06Å; A527-L531 PolarHBondContact O-N 3.38Å
528	V	87.6	Confident	88.4	Confident	98 Å²	98	55.1 Å²	55.1	59%	0.594	32%	0.324	S	S	*	.	H	α-helix	trans	-67	-50.2	-178	176.3	0	0	0	0	111.7	V526 T530 L531 L532	V526-V528 PolarHBondContact O-N 3.38Å; V528-T530 VanDerWaalsContact C-N 3.29Å; V528-T530 PolarHBondContact O-N 3.47Å; V528-L531 PolarHBondContact O-N 3.49Å; V528-L532 HydrophobicContact CG1-CD1 4.25Å; V528-L532 PolarHBondContact O-N 3.38Å; V528-L532 VanDerWaalsContact O-N 3.11Å
529	P	89	Confident	88.4	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.045	34%	0.342	C	S	.	.	H	α-helix	trans	-53.1	-44.4	172.7	-32	38.2	0	0	0	113.8	I519 E523 A525 V526 L531 L532 V533	I519-P529 HydrophobicContact CB-CB 4.47Å; I519-P529 HydrophobicContact CG2-CB 3.79Å; I519-P529 HydrophobicContact CG2-CG 4.26Å; E523-P529 HydrophobicContact CB-CG 3.98Å; E523-P529 HydrophobicContact CG-CG 3.82Å; A525-P529 VanDerWaalsContact O-CD 3.27Å; A525-P529 WeakPolarHBondContact O-CD 3.49Å; V526-P529 WeakPolarHBondContact O-CD 3.38Å; P529-L531 PolarHBondContact O-N 3.12Å; P529-L532 PolarHBondContact O-N 3.31Å; P529-V533 WeakPolarHBondContact O-CG2 3.11Å; P529-V533 PolarHBondContact O-N 3.2Å
530	T	92	Very high	88.5	Confident	40 Å²	40	57.6 Å²	57.6	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-42.5	-177.9	-60	0	0	0	0	111.5	V434 V526 A527 V528 V533 T534	V434-T530 HydrophobicContact CG1-CG2 3.71Å; V526-T530 WeakPolarHBondContact CG1-OG1 3.42Å; V526-T530 VanDerWaalsContact O-CB 3.28Å; V526-T530 WeakPolarHBondContact O-CB 3.5Å; V526-T530 PolarHBondContact O-N 2.79Å; V526-T530 PolarHBondContact O-OG1 3.03Å; A527-T530 PolarHBondContact O-N 3.06Å; V528-T530 VanDerWaalsContact C-N 3.29Å; V528-T530 PolarHBondContact O-N 3.47Å; T530-V533 PolarHBondContact O-N 2.92Å; T530-T534 WeakPolarHBondContact O-CB 3.44Å; T530-T534 PolarHBondContact O-N 3Å; T530-T534 PolarHBondContact O-OG1 3.43Å
531	L	92.6	Very high	88.9	Confident	110 Å²	110	58.2 Å²	58.2	58%	0.576	34%	0.335	S	S	*	.	H	α-helix	trans	-61.4	-47.9	176.4	-178.6	65.2	0	0	0	111.5	A527 V528 P529 V533 T534 I535	A527-L531 PolarHBondContact O-N 3.38Å; V528-L531 PolarHBondContact O-N 3.49Å; P529-L531 PolarHBondContact O-N 3.12Å; L531-V533 PolarHBondContact O-N 3.32Å; L531-T534 PolarHBondContact O-N 2.97Å; L531-I535 HydrophobicContact CD1-CD1 4.12Å; L531-I535 HydrophobicContact CD1-CG1 4.46Å; L531-I535 HydrophobicContact CG-CD1 3.95Å; L531-I535 VanDerWaalsContact O-CG1 3.32Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.26Å
532	L	92.7	Very high	89.2	Confident	95 Å²	95	63.8 Å²	63.8	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-44.6	179.7	-70.7	174	0	0	0	112.2	V528 P529 T534 I535 Y536	V528-L532 HydrophobicContact CG1-CD1 4.25Å; V528-L532 PolarHBondContact O-N 3.38Å; V528-L532 VanDerWaalsContact O-N 3.11Å; P529-L532 PolarHBondContact O-N 3.31Å; L532-T534 VanDerWaalsContact C-N 3.34Å; L532-I535 PolarHBondContact O-N 3.11Å; L532-Y536 PolarHBondContact O-N 3.45Å
533	V	94.4	Very high	89.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.3	-40.1	178	175.4	0	0	0	0	110.9	V434 L515 P516 I519 P529 T530 L531 Y536 F537	V434-V533 HydrophobicContact CG2-CG1 4.23Å; L515-V533 HydrophobicContact CD2-CG1 4.43Å; P516-V533 HydrophobicContact CB-CB 4.38Å; P516-V533 HydrophobicContact CB-CG1 3.98Å; P516-V533 HydrophobicContact CB-CG2 3.81Å; P516-V533 HydrophobicContact CG-CG1 4.2Å; I519-V533 HydrophobicContact CD1-CG2 3.76Å; P529-V533 WeakPolarHBondContact O-CG2 3.11Å; P529-V533 PolarHBondContact O-N 3.2Å; T530-V533 PolarHBondContact O-N 2.92Å; L531-V533 PolarHBondContact O-N 3.32Å; V533-Y536 WeakPolarHBondContact O-CB 3.43Å; V533-Y536 PolarHBondContact O-N 3.46Å; V533-F537 HydrophobicContact CG1-CD2 3.61Å; V533-F537 HydrophobicContact CG1-CE2 3.39Å; V533-F537 HydrophobicContact CG1-CZ 4.4Å; V533-F537 WeakPolarHBondContact O-CD2 3.48Å; V533-F537 PolarHBondContact O-N 3.49Å
534	T	94.5	Very high	89.8	Confident	56 Å²	56	59 Å²	59	34%	0.344	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-45.4	178.5	-56	0	0	0	0	110.7	T530 L531 L532 Y536 F537 V538	T530-T534 WeakPolarHBondContact O-CB 3.44Å; T530-T534 PolarHBondContact O-N 3Å; T530-T534 PolarHBondContact O-OG1 3.43Å; L531-T534 PolarHBondContact O-N 2.97Å; L532-T534 VanDerWaalsContact C-N 3.34Å; T534-Y536 VanDerWaalsContact C-N 3.33Å; T534-Y536 PolarHBondContact O-N 2.84Å; T534-F537 PolarHBondContact O-N 3.42Å; T534-V538 HydrophobicContact CG2-CG2 4.45Å; T534-V538 VanDerWaalsContact O-CG2 3.32Å; T534-V538 WeakPolarHBondContact O-CG2 3.27Å; T534-V538 PolarHBondContact O-N 3.45Å
535	I	95	Very high	90.2	Very high	102 Å²	102	53.5 Å²	53.5	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-44.6	175.6	-68.1	167	0	0	0	110.5	L531 L532 F537 V538 F539	L531-I535 HydrophobicContact CD1-CD1 4.12Å; L531-I535 HydrophobicContact CD1-CG1 4.46Å; L531-I535 HydrophobicContact CG-CD1 3.95Å; L531-I535 VanDerWaalsContact O-CG1 3.32Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.26Å; L532-I535 PolarHBondContact O-N 3.11Å; I535-F537 PolarHBondContact O-N 3.45Å; I535-V538 PolarHBondContact O-N 2.96Å; I535-F539 VanDerWaalsContact O-CB 3.31Å; I535-F539 WeakPolarHBondContact O-CB 3.37Å; I535-F539 PolarHBondContact O-N 3.23Å
536	Y	95.3	Very high	90	Very high	55 Å²	55	53.9 Å²	53.9	22%	0.216	29%	0.294	C	S	.	.	H	α-helix	trans	-56.8	-50.4	175.2	166.3	-87.7	0	0	0	111.7	L515 L532 V533 T534 F539 M540 F563 I565	L515-Y536 HydrophobicContact CD2-CD1 3.18Å; L515-Y536 HydrophobicContact CD2-CD2 4.38Å; L515-Y536 HydrophobicContact CD2-CE1 3.28Å; L515-Y536 HydrophobicContact CD2-CE2 4.43Å; L515-Y536 HydrophobicContact CD2-CG 3.8Å; L532-Y536 PolarHBondContact O-N 3.45Å; V533-Y536 WeakPolarHBondContact O-CB 3.43Å; V533-Y536 PolarHBondContact O-N 3.46Å; T534-Y536 VanDerWaalsContact C-N 3.33Å; T534-Y536 PolarHBondContact O-N 2.84Å; Y536-F539 PolarHBondContact O-N 3.44Å; Y536-M540 HydrophobicContact CD1-CG 4.37Å; Y536-M540 HydrophobicContact CD2-CE 4.09Å; Y536-M540 HydrophobicContact CD2-CG 3.94Å; Y536-M540 HydrophobicContact CE1-CB 4.48Å; Y536-M540 HydrophobicContact CE1-CG 4Å; Y536-M540 HydrophobicContact CE2-CE 3.59Å; Y536-M540 HydrophobicContact CE2-CG 3.55Å; Y536-M540 HydrophobicContact CE2-SD 4.39Å; Y536-M540 HydrophobicContact CG-CG 4.34Å; Y536-M540 WeakPolarHBondContact O-CB 3.36Å; Y536-M540 WeakPolarHBondContact O-CG 3.34Å; Y536-M540 PolarHBondContact O-N 3.28Å; Y536-F563 PolarHBondContact OH-O 3.1Å; Y536-I565 HydrophobicContact CE1-CD1 4.48Å; Y536-I565 PolarHBondContact OH-N 3.47Å
537	F	95.6	Very high	89.6	Confident	3 Å²	3	52.7 Å²	52.7	1%	0.013	29%	0.288	C	S	.	.	H	α-helix	trans	-66.5	-41.2	-177.7	-78.6	-51.2	0	0	0	112.1	C430 V434 A512 L515 V533 T534 I535 F539 M540 L541	C430-F537 HydrophobicContact CB-CD1 3.72Å; C430-F537 HydrophobicContact CB-CE1 3.93Å; C430-F537 HydrophobicContact CB-CG 4.15Å; C430-F537 HydrophobicContact CB-CZ 4.49Å; C430-F537 WeakPolarHBondContact O-CE2 3.44Å; V434-F537 HydrophobicContact CG2-CD2 3.69Å; V434-F537 HydrophobicContact CG2-CE2 3.99Å; A512-F537 HydrophobicContact CB-CE1 4.2Å; A512-F537 HydrophobicContact CB-CZ 3.95Å; L515-F537 HydrophobicContact CD2-CZ 4.28Å; V533-F537 HydrophobicContact CG1-CD2 3.61Å; V533-F537 HydrophobicContact CG1-CE2 3.39Å; V533-F537 HydrophobicContact CG1-CZ 4.4Å; V533-F537 WeakPolarHBondContact O-CD2 3.48Å; V533-F537 PolarHBondContact O-N 3.49Å; T534-F537 PolarHBondContact O-N 3.42Å; I535-F537 PolarHBondContact O-N 3.45Å; F537-F539 VanDerWaalsContact C-N 3.31Å; F537-F539 PolarHBondContact O-N 3.46Å; F537-M540 PolarHBondContact O-N 3Å; F537-L541 WeakPolarHBondContact O-CB 3.16Å; F537-L541 WeakPolarHBondContact O-CD1 3.28Å; F537-L541 WeakPolarHBondContact O-CG 3.41Å; F537-L541 PolarHBondContact O-N 3.41Å
538	V	93.6	Very high	88.9	Confident	98 Å²	98	50.7 Å²	50.7	59%	0.594	27%	0.267	S	S	*	.	H	α-helix	trans	-59.3	-45.7	175.9	170.9	0	0	0	0	110.6	T534 I535 F542	T534-V538 HydrophobicContact CG2-CG2 4.45Å; T534-V538 VanDerWaalsContact O-CG2 3.32Å; T534-V538 WeakPolarHBondContact O-CG2 3.27Å; T534-V538 PolarHBondContact O-N 3.45Å; I535-V538 PolarHBondContact O-N 2.96Å; V538-F542 WeakPolarHBondContact O-CB 3.38Å; V538-F542 PolarHBondContact O-N 3.08Å
539	F	92.7	Very high	88	Confident	99 Å²	99	55.1 Å²	55.1	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-49.6	177.9	-173.6	-99.2	0	0	0	111.6	I535 Y536 F537 F542 F543 I560	I535-F539 VanDerWaalsContact O-CB 3.31Å; I535-F539 WeakPolarHBondContact O-CB 3.37Å; I535-F539 PolarHBondContact O-N 3.23Å; Y536-F539 PolarHBondContact O-N 3.44Å; F537-F539 VanDerWaalsContact C-N 3.31Å; F537-F539 PolarHBondContact O-N 3.46Å; F539-F542 WeakPolarHBondContact O-CB 3.44Å; F539-F542 PolarHBondContact O-N 3.29Å; F539-F543 AromaticContact CD1-CD2 3.9Å; F539-F543 HydrophobicContact CD1-CD2 3.9Å; F539-F543 AromaticContact CD1-CE2 3.75Å; F539-F543 HydrophobicContact CD1-CE2 3.75Å; F539-F543 AromaticContact CD2-CE2 3.81Å; F539-F543 HydrophobicContact CD2-CE2 3.81Å; F539-F543 AromaticContact CE1-CD2 3.82Å; F539-F543 HydrophobicContact CE1-CD2 3.82Å; F539-F543 AromaticContact CE1-CE2 3.36Å; F539-F543 HydrophobicContact CE1-CE2 3.36Å; F539-F543 HydrophobicContact CE1-CZ 4.34Å; F539-F543 HydrophobicContact CE2-CD2 4.49Å; F539-F543 AromaticContact CE2-CE2 3.45Å; F539-F543 HydrophobicContact CE2-CE2 3.45Å; F539-F543 VanDerWaalsContact CE2-CE2 3.45Å; F539-F543 HydrophobicContact CE2-CZ 4.1Å; F539-F543 HydrophobicContact CG-CD2 4.29Å; F539-F543 AromaticContact CG-CE2 3.97Å; F539-F543 HydrophobicContact CG-CE2 3.97Å; F539-F543 HydrophobicContact CZ-CD2 4.15Å; F539-F543 AromaticContact CZ-CE2 3.23Å; F539-F543 HydrophobicContact CZ-CE2 3.23Å; F539-F543 AromaticContact CZ-CZ 3.88Å; F539-F543 HydrophobicContact CZ-CZ 3.88Å; F539-F543 WeakPolarHBondContact O-CD2 3.41Å; F539-F543 PolarHBondContact O-N 3Å; F539-I560 HydrophobicContact CE1-CG2 4.1Å
540	M	93.5	Very high	86.8	Confident	15 Å²	15	57.3 Å²	57.3	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-70	-34.8	-177.6	-70	-56.1	177.5	0	0	113.5	Y536 F537 S544 I560 F563 P566	Y536-M540 HydrophobicContact CD1-CG 4.37Å; Y536-M540 HydrophobicContact CD2-CE 4.09Å; Y536-M540 HydrophobicContact CD2-CG 3.94Å; Y536-M540 HydrophobicContact CE1-CB 4.48Å; Y536-M540 HydrophobicContact CE1-CG 4Å; Y536-M540 HydrophobicContact CE2-CE 3.59Å; Y536-M540 HydrophobicContact CE2-CG 3.55Å; Y536-M540 HydrophobicContact CE2-SD 4.39Å; Y536-M540 HydrophobicContact CG-CG 4.34Å; Y536-M540 WeakPolarHBondContact O-CB 3.36Å; Y536-M540 WeakPolarHBondContact O-CG 3.34Å; Y536-M540 PolarHBondContact O-N 3.28Å; F537-M540 PolarHBondContact O-N 3Å; M540-S544 WeakPolarHBondContact O-CB 3.48Å; M540-S544 PolarHBondContact O-N 2.94Å; M540-I560 HydrophobicContact CE-CG2 3.94Å; M540-I560 HydrophobicContact SD-CG2 4Å; M540-F563 HydrophobicContact CE-CB 4.28Å; M540-P566 HydrophobicContact CB-CG 3.79Å
541	L	92.4	Very high	85.1	Confident	14 Å²	14	58.1 Å²	58.1	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-46.6	172.3	-74	169	0	0	0	110.2	Y423 I427 C430 F537 F543 S544 G545 P566	Y423-L541 HydrophobicContact CE2-CD2 4.49Å; Y423-L541 VanDerWaalsContact OH-C 3.29Å; Y423-L541 PolarHBondContact OH-O 3.17Å; I427-L541 HydrophobicContact CB-CD1 4.43Å; I427-L541 HydrophobicContact CB-CD2 4.39Å; I427-L541 HydrophobicContact CG1-CD1 4.14Å; I427-L541 HydrophobicContact CG1-CD2 3.74Å; I427-L541 HydrophobicContact CG1-CG 4.44Å; I427-L541 HydrophobicContact CG2-CD1 4.22Å; C430-L541 HydrophobicContact CB-CD1 4.41Å; F537-L541 WeakPolarHBondContact O-CB 3.16Å; F537-L541 WeakPolarHBondContact O-CD1 3.28Å; F537-L541 WeakPolarHBondContact O-CG 3.41Å; F537-L541 PolarHBondContact O-N 3.41Å; L541-F543 VanDerWaalsContact C-N 3.31Å; L541-F543 PolarHBondContact O-N 2.93Å; L541-S544 CarbonylContact O-C 3.58Å; L541-S544 PolarHBondContact O-N 2.95Å; L541-G545 PolarHBondContact O-N 3.48Å; L541-P566 HydrophobicContact CD2-CB 3.59Å; L541-P566 HydrophobicContact CD2-CG 4Å; L541-P566 HydrophobicContact CG-CB 4.39Å; L541-P566 HydrophobicContact CG-CG 4.27Å
542	F	88.6	Confident	83.2	Confident	123 Å²	123	57.8 Å²	57.8	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-52.4	-48.3	176.4	175.1	-102.4	0	0	0	112.2	V538 F539 G545 L546	V538-F542 WeakPolarHBondContact O-CB 3.38Å; V538-F542 PolarHBondContact O-N 3.08Å; F539-F542 WeakPolarHBondContact O-CB 3.44Å; F539-F542 PolarHBondContact O-N 3.29Å; F542-G545 PolarHBondContact O-N 3.27Å; F542-L546 HydrophobicContact CD1-CD1 4.02Å; F542-L546 HydrophobicContact CE1-CD1 3.47Å; F542-L546 VanDerWaalsContact CE1-CD1 3.47Å; F542-L546 HydrophobicContact CE1-CG 4.24Å; F542-L546 HydrophobicContact CE2-CD1 4.48Å; F542-L546 HydrophobicContact CE2-CD2 4.46Å; F542-L546 HydrophobicContact CE2-CG 4.44Å; F542-L546 HydrophobicContact CZ-CD1 3.74Å; F542-L546 HydrophobicContact CZ-CD2 4.23Å; F542-L546 HydrophobicContact CZ-CG 4.15Å; F542-L546 WeakPolarHBondContact O-CG 3.19Å; F542-L546 PolarHBondContact O-N 3.35Å
543	F	82.8	Confident	81.6	Confident	30 Å²	30	55.3 Å²	55.3	13%	0.132	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-37.2	176.7	-75.5	-67.2	0	0	0	113.9	F539 L541 G545 L546 F553	F539-F543 AromaticContact CD1-CD2 3.9Å; F539-F543 HydrophobicContact CD1-CD2 3.9Å; F539-F543 AromaticContact CD1-CE2 3.75Å; F539-F543 HydrophobicContact CD1-CE2 3.75Å; F539-F543 AromaticContact CD2-CE2 3.81Å; F539-F543 HydrophobicContact CD2-CE2 3.81Å; F539-F543 AromaticContact CE1-CD2 3.82Å; F539-F543 HydrophobicContact CE1-CD2 3.82Å; F539-F543 AromaticContact CE1-CE2 3.36Å; F539-F543 HydrophobicContact CE1-CE2 3.36Å; F539-F543 HydrophobicContact CE1-CZ 4.34Å; F539-F543 HydrophobicContact CE2-CD2 4.49Å; F539-F543 AromaticContact CE2-CE2 3.45Å; F539-F543 HydrophobicContact CE2-CE2 3.45Å; F539-F543 VanDerWaalsContact CE2-CE2 3.45Å; F539-F543 HydrophobicContact CE2-CZ 4.1Å; F539-F543 HydrophobicContact CG-CD2 4.29Å; F539-F543 AromaticContact CG-CE2 3.97Å; F539-F543 HydrophobicContact CG-CE2 3.97Å; F539-F543 HydrophobicContact CZ-CD2 4.15Å; F539-F543 AromaticContact CZ-CE2 3.23Å; F539-F543 HydrophobicContact CZ-CE2 3.23Å; F539-F543 AromaticContact CZ-CZ 3.88Å; F539-F543 HydrophobicContact CZ-CZ 3.88Å; F539-F543 WeakPolarHBondContact O-CD2 3.41Å; F539-F543 PolarHBondContact O-N 3Å; L541-F543 VanDerWaalsContact C-N 3.31Å; L541-F543 PolarHBondContact O-N 2.93Å; F543-G545 VanDerWaalsContact C-N 3.29Å; F543-G545 PolarHBondContact O-N 2.69Å; F543-L546 HydrophobicContact CD1-CD1 4.16Å; F543-L546 PolarHBondContact O-N 3.26Å; F543-F553 HydrophobicContact CB-CE2 4.48Å; F543-F553 HydrophobicContact CB-CZ 3.97Å; F543-F553 AromaticContact CD1-CE1 3.87Å; F543-F553 HydrophobicContact CD1-CE1 3.87Å; F543-F553 HydrophobicContact CD1-CE2 4.13Å; F543-F553 AromaticContact CD1-CZ 3.25Å; F543-F553 HydrophobicContact CD1-CZ 3.25Å; F543-F553 HydrophobicContact CE1-CE1 4.26Å; F543-F553 HydrophobicContact CE1-CZ 4.08Å; F543-F553 AromaticContact CG-CZ 3.94Å; F543-F553 HydrophobicContact CG-CZ 3.94Å
544	S	85.1	Confident	80	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.007	33%	0.329	C	S	.	.	H	α-helix	trans	-67.6	-30.2	174.4	-175.6	0	0	0	0	112.5	M540 L541 S547	M540-S544 WeakPolarHBondContact O-CB 3.48Å; M540-S544 PolarHBondContact O-N 2.94Å; L541-S544 CarbonylContact O-C 3.58Å; L541-S544 PolarHBondContact O-N 2.95Å; S544-S547 PolarHBondContact O-OG 2.85Å
545	G	82.3	Confident	78.7	Confident	10 Å²	10	63.6 Å²	63.6	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-77.7	-31.5	177.3	0	0	0	0	0	112.6	L541 F542 F543 S547 L548	L541-G545 PolarHBondContact O-N 3.48Å; F542-G545 PolarHBondContact O-N 3.27Å; F543-G545 VanDerWaalsContact C-N 3.29Å; F543-G545 PolarHBondContact O-N 2.69Å; G545-S547 PolarHBondContact O-N 3.11Å; G545-L548 WeakPolarHBondContact O-CB 3.25Å; G545-L548 PolarHBondContact O-N 3.39Å
546	L	78.2	Confident	77.6	Confident	64 Å²	64	67.8 Å²	67.8	34%	0.335	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-30.8	175.7	-76.2	174.3	0	0	0	112.8	F542 F543 L548 Y549 S550	F542-L546 HydrophobicContact CD1-CD1 4.02Å; F542-L546 HydrophobicContact CE1-CD1 3.47Å; F542-L546 VanDerWaalsContact CE1-CD1 3.47Å; F542-L546 HydrophobicContact CE1-CG 4.24Å; F542-L546 HydrophobicContact CE2-CD1 4.48Å; F542-L546 HydrophobicContact CE2-CD2 4.46Å; F542-L546 HydrophobicContact CE2-CG 4.44Å; F542-L546 HydrophobicContact CZ-CD1 3.74Å; F542-L546 HydrophobicContact CZ-CD2 4.23Å; F542-L546 HydrophobicContact CZ-CG 4.15Å; F542-L546 WeakPolarHBondContact O-CG 3.19Å; F542-L546 PolarHBondContact O-N 3.35Å; F543-L546 HydrophobicContact CD1-CD1 4.16Å; F543-L546 PolarHBondContact O-N 3.26Å; L546-L548 PolarHBondContact O-N 3.36Å; L546-Y549 PolarHBondContact O-N 2.86Å; L546-S550 PolarHBondContact O-N 2.8Å
547	S	74.1	Confident	76.6	Confident	12 Å²	12	68.2 Å²	68.2	8%	0.084	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.4	179.1	73.2	0	0	0	0	112.3	S544 G545 Y549 Q610	S544-S547 PolarHBondContact O-OG 2.85Å; G545-S547 PolarHBondContact O-N 3.11Å; S547-Y549 PolarHBondContact O-N 3.44Å; S547-Y549 VanDerWaalsContact O-N 3.17Å; S547-Q610 VanDerWaalsContact C-OE1 3.23Å; S547-Q610 PolarHBondContact O-NE2 3.14Å; S547-Q610 VanDerWaalsContact O-NE2 3.11Å; S547-Q610 PolarHBondContact O-OE1 3.21Å
548	L	74.6	Confident	75.7	Confident	33 Å²	33	70 Å²	70	17%	0.173	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.9	175.5	-75.5	169.6	0	0	0	113.3	A419 Y423 G545 L546 F570	A419-L548 HydrophobicContact CB-CD2 3.54Å; Y423-L548 HydrophobicContact CD1-CD1 4.35Å; Y423-L548 HydrophobicContact CG-CD1 4.16Å; G545-L548 WeakPolarHBondContact O-CB 3.25Å; G545-L548 PolarHBondContact O-N 3.39Å; L546-L548 PolarHBondContact O-N 3.36Å; L548-F570 HydrophobicContact CD1-CE1 4.36Å; L548-F570 HydrophobicContact CD1-CZ 4.07Å; L548-F570 HydrophobicContact CD2-CE1 3.98Å; L548-F570 HydrophobicContact CD2-CZ 3.59Å; L548-F570 HydrophobicContact CG-CE1 3.92Å; L548-F570 HydrophobicContact CG-CZ 3.88Å
549	Y	70.3	Confident	75.3	Confident	191 Å²	191	72.2 Å²	72.2	75%	0.749	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-24.9	-173.1	-65.3	-81.6	0	0	0	113.4	L546 S547	L546-Y549 PolarHBondContact O-N 2.86Å; S547-Y549 PolarHBondContact O-N 3.44Å; S547-Y549 VanDerWaalsContact O-N 3.17Å
550	S	62.5	Low	74.9	Confident	52 Å²	52	68.3 Å²	68.3	36%	0.364	36%	0.36	S	S	.	.			trans	-147.1	131.2	175.4	68.8	0	0	0	0	113.5	L546 S552	L546-S550 PolarHBondContact O-N 2.8Å; S550-S552 PolarHBondContact O-N 2.94Å
551	G	57.6	Low	74.4	Confident	58 Å²	58	69 Å²	69	60%	0.598	36%	0.363	S	S	*	.	S	Bend	trans	-71	-15.8	169.5	0	0	0	0	0	113.4	F553	G551-F553 PolarHBondContact O-N 3.01Å
552	S	52.7	Low	74.1	Confident	103 Å²	103	75.1 Å²	75.1	72%	0.72	39%	0.386	S	S	*	.			trans	-100.6	82.2	-178.2	23.7	0	0	0	0	111.3	S550	S550-S552 PolarHBondContact O-N 2.94Å
553	F	57.8	Low	74.2	Confident	43 Å²	43	75.8 Å²	75.8	19%	0.189	39%	0.389	C	S	.	.			trans	-62	146	162.3	-134	-96.7	0	0	0	109.6	F543 G551 P555 L557	F543-F553 HydrophobicContact CB-CE2 4.48Å; F543-F553 HydrophobicContact CB-CZ 3.97Å; F543-F553 AromaticContact CD1-CE1 3.87Å; F543-F553 HydrophobicContact CD1-CE1 3.87Å; F543-F553 HydrophobicContact CD1-CE2 4.13Å; F543-F553 AromaticContact CD1-CZ 3.25Å; F543-F553 HydrophobicContact CD1-CZ 3.25Å; F543-F553 HydrophobicContact CE1-CE1 4.26Å; F543-F553 HydrophobicContact CE1-CZ 4.08Å; F543-F553 AromaticContact CG-CZ 3.94Å; F543-F553 HydrophobicContact CG-CZ 3.94Å; G551-F553 PolarHBondContact O-N 3.01Å; F553-P555 WeakPolarHBondContact O-CD 3.43Å; F553-L557 HydrophobicContact CD1-CB 4.29Å; F553-L557 HydrophobicContact CE1-CB 4.13Å
554	L	60.7	Low	74.7	Confident	123 Å²	123	74.4 Å²	74.4	64%	0.644	38%	0.383	S	S	*	.			trans	-51.4	115.1	167.4	-82.2	162.4	0	0	0	107.9	K556 L557 S558	L554-K556 PolarHBondContact O-N 3.09Å; L554-L557 HydrophobicContact CB-CB 4.49Å; L554-L557 HydrophobicContact CB-CD1 4.35Å; L554-L557 HydrophobicContact CD1-CD1 4.01Å; L554-L557 PolarHBondContact O-N 3.47Å; L554-S558 PolarHBondContact O-N 2.56Å
555	P	66.8	Low	75.2	Confident	107 Å²	107	74.5 Å²	74.5	70%	0.695	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-55	-31.7	-170.1	-27.9	33.5	0	0	0	112.7	F553 L557 S558	F553-P555 WeakPolarHBondContact O-CD 3.43Å; P555-L557 VanDerWaalsContact C-N 3.33Å; P555-L557 PolarHBondContact O-N 3.14Å; P555-S558 WeakPolarHBondContact O-CB 3.42Å; P555-S558 PolarHBondContact O-N 3.29Å; P555-S558 PolarHBondContact O-OG 3.11Å
556	K	71.6	Confident	75.8	Confident	189 Å²	189	74 Å²	74	82%	0.822	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23	178	-63.8	-174.4	179.5	-179.4	0	115.1	L554 W559	L554-K556 PolarHBondContact O-N 3.09Å; K556-W559 PolarHBondContact O-NE1 3.27Å
557	L	75.2	Confident	76.4	Confident	65 Å²	65	71.4 Å²	71.4	34%	0.34	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-107.4	-1.5	-179.3	-72.2	162.2	0	0	0	112.9	F553 L554 P555 W559 I560	F553-L557 HydrophobicContact CD1-CB 4.29Å; F553-L557 HydrophobicContact CE1-CB 4.13Å; L554-L557 HydrophobicContact CB-CB 4.49Å; L554-L557 HydrophobicContact CB-CD1 4.35Å; L554-L557 HydrophobicContact CD1-CD1 4.01Å; L554-L557 PolarHBondContact O-N 3.47Å; P555-L557 VanDerWaalsContact C-N 3.33Å; P555-L557 PolarHBondContact O-N 3.14Å; L557-W559 PolarHBondContact O-N 3.24Å; L557-I560 HydrophobicContact CD2-CD1 3.53Å; L557-I560 WeakPolarHBondContact O-CB 3.35Å; L557-I560 PolarHBondContact O-N 3.2Å; L557-I560 VanDerWaalsContact O-N 3.07Å
558	S	77	Confident	77.4	Confident	41 Å²	41	72.3 Å²	72.3	29%	0.287	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.8	178.6	67.7	0	0	0	0	114.3	L554 P555 Q561	L554-S558 PolarHBondContact O-N 2.56Å; P555-S558 WeakPolarHBondContact O-CB 3.42Å; P555-S558 PolarHBondContact O-N 3.29Å; P555-S558 PolarHBondContact O-OG 3.11Å; S558-Q561 VanDerWaalsContact O-CD 3.3Å; S558-Q561 WeakPolarHBondContact O-CG 3.45Å; S558-Q561 PolarHBondContact O-NE2 2.8Å
559	W	83.9	Confident	78.3	Confident	144 Å²	144	70.8 Å²	70.8	55%	0.545	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.5	174.5	65.4	-93.4	0	0	0	112.3	K556 L557 Q561 Y562 F563	K556-W559 PolarHBondContact O-NE1 3.27Å; L557-W559 PolarHBondContact O-N 3.24Å; W559-Q561 VanDerWaalsContact C-N 3.32Å; W559-Q561 PolarHBondContact O-N 3.45Å; W559-Y562 WeakPolarHBondContact O-CD2 3.34Å; W559-Y562 PolarHBondContact O-N 2.84Å; W559-F563 AromaticContact CE3-CD2 3.92Å; W559-F563 HydrophobicContact CE3-CD2 3.92Å; W559-F563 AromaticContact CE3-CE2 3.71Å; W559-F563 HydrophobicContact CE3-CE2 3.71Å; W559-F563 AromaticContact CZ3-CD2 3.93Å; W559-F563 HydrophobicContact CZ3-CD2 3.93Å; W559-F563 AromaticContact CZ3-CE2 3.79Å; W559-F563 HydrophobicContact CZ3-CE2 3.79Å
560	I	84.9	Confident	79.4	Confident	16 Å²	16	61.7 Å²	61.7	8%	0.082	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-66.4	-35	-176.1	-65.5	179.6	0	0	0	111.4	F539 M540 L557 Y562 F563	F539-I560 HydrophobicContact CE1-CG2 4.1Å; M540-I560 HydrophobicContact CE-CG2 3.94Å; M540-I560 HydrophobicContact SD-CG2 4Å; L557-I560 HydrophobicContact CD2-CD1 3.53Å; L557-I560 WeakPolarHBondContact O-CB 3.35Å; L557-I560 PolarHBondContact O-N 3.2Å; L557-I560 VanDerWaalsContact O-N 3.07Å; I560-Y562 PolarHBondContact O-N 2.73Å; I560-Y562 VanDerWaalsContact O-N 3.14Å; I560-F563 PolarHBondContact O-N 3.18Å
561	Q	83.1	Confident	80.9	Confident	30 Å²	30	61.1 Å²	61.1	14%	0.14	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-57	-27.9	176.8	47.8	168.1	9.1	0	0	112.9	S558 W559 F563 S564 H567	S558-Q561 VanDerWaalsContact O-CD 3.3Å; S558-Q561 WeakPolarHBondContact O-CG 3.45Å; S558-Q561 PolarHBondContact O-NE2 2.8Å; W559-Q561 VanDerWaalsContact C-N 3.32Å; W559-Q561 PolarHBondContact O-N 3.45Å; Q561-F563 PolarHBondContact O-N 3.16Å; Q561-S564 VanDerWaalsContact O-CB 3.31Å; Q561-S564 WeakPolarHBondContact O-CB 3.32Å; Q561-S564 PolarHBondContact O-N 3.08Å; Q561-H567 PolarHBondContact OE1-CE1 3.5Å; Q561-H567 PolarHBondContact OE1-NE2 3.05Å
562	Y	86.4	Confident	82.6	Confident	143 Å²	143	58.3 Å²	58.3	56%	0.561	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20.6	178.2	-64.7	-70.9	0	0	0	113.4	W559 I560 Y568	W559-Y562 WeakPolarHBondContact O-CD2 3.34Å; W559-Y562 PolarHBondContact O-N 2.84Å; I560-Y562 PolarHBondContact O-N 2.73Å; I560-Y562 VanDerWaalsContact O-N 3.14Å; Y562-Y568 VanDerWaalsContact CA-OH 3.23Å; Y562-Y568 WeakPolarHBondContact CA-OH 3.44Å; Y562-Y568 VanDerWaalsContact O-CE2 3.3Å; Y562-Y568 WeakPolarHBondContact O-CE2 3.49Å; Y562-Y568 PolarHBondContact O-OH 3.48Å
563	F	90.2	Very high	84.5	Confident	136 Å²	136	53.5 Å²	53.5	60%	0.596	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-93.5	-0.8	173.8	-65.5	-81	0	0	0	112.7	Y536 M540 W559 I560 Q561 I565	Y536-F563 PolarHBondContact OH-O 3.1Å; M540-F563 HydrophobicContact CE-CB 4.28Å; W559-F563 AromaticContact CE3-CD2 3.92Å; W559-F563 HydrophobicContact CE3-CD2 3.92Å; W559-F563 AromaticContact CE3-CE2 3.71Å; W559-F563 HydrophobicContact CE3-CE2 3.71Å; W559-F563 AromaticContact CZ3-CD2 3.93Å; W559-F563 HydrophobicContact CZ3-CD2 3.93Å; W559-F563 AromaticContact CZ3-CE2 3.79Å; W559-F563 HydrophobicContact CZ3-CE2 3.79Å; I560-F563 PolarHBondContact O-N 3.18Å; Q561-F563 PolarHBondContact O-N 3.16Å; F563-I565 PolarHBondContact O-N 3.41Å
564	S	92.9	Very high	86.2	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.014	24%	0.241	C	C	.	.			trans	-90.1	106.4	-176	-179.2	0	0	0	0	110.9	Q561 P566 H567 Y568	Q561-S564 VanDerWaalsContact O-CB 3.31Å; Q561-S564 WeakPolarHBondContact O-CB 3.32Å; Q561-S564 PolarHBondContact O-N 3.08Å; S564-P566 WeakPolarHBondContact OG-CD 3.45Å; S564-P566 WeakPolarHBondContact OG-CG 3.27Å; S564-H567 WeakPolarHBondContact O-CB 3.4Å; S564-H567 PolarHBondContact O-N 2.93Å; S564-H567 WeakPolarHBondContact OG-CB 3.4Å; S564-H567 PolarHBondContact OG-N 3.4Å; S564-Y568 WeakPolarHBondContact O-CD2 3.36Å
565	I	95.6	Very high	87.7	Confident	2 Å²	2	46 Å²	46	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-55.1	-48.7	169.7	-63.7	168.9	0	0	0	112.1	L508 A512 L515 Y536 F563 H567 Y568 G569 L626 T629 L633	L508-I565 HydrophobicContact CD1-CG2 3.84Å; A512-I565 HydrophobicContact CB-CG2 4.14Å; L515-I565 HydrophobicContact CB-CD1 4.29Å; Y536-I565 HydrophobicContact CE1-CD1 4.48Å; Y536-I565 PolarHBondContact OH-N 3.47Å; F563-I565 PolarHBondContact O-N 3.41Å; I565-H567 VanDerWaalsContact C-N 3.26Å; I565-H567 PolarHBondContact O-N 3.36Å; I565-Y568 PolarHBondContact O-N 3.49Å; I565-G569 PolarHBondContact O-N 3.46Å; I565-L626 HydrophobicContact CG2-CD2 3.87Å; I565-T629 HydrophobicContact CD1-CG2 4.25Å; I565-T629 HydrophobicContact CG1-CG2 4.1Å; I565-L633 HydrophobicContact CD1-CD1 4.44Å
566	P	95	Very high	89	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-31.6	-179.7	19.7	-28.8	0	0	0	113.2	T426 M540 L541 S564 Y568 G569 F570	T426-P566 HydrophobicContact CG2-CB 3.72Å; M540-P566 HydrophobicContact CB-CG 3.79Å; L541-P566 HydrophobicContact CD2-CB 3.59Å; L541-P566 HydrophobicContact CD2-CG 4Å; L541-P566 HydrophobicContact CG-CB 4.39Å; L541-P566 HydrophobicContact CG-CG 4.27Å; S564-P566 WeakPolarHBondContact OG-CD 3.45Å; S564-P566 WeakPolarHBondContact OG-CG 3.27Å; P566-Y568 PolarHBondContact O-N 3.36Å; P566-G569 PolarHBondContact O-N 3.06Å; P566-F570 WeakPolarHBondContact O-CB 3.23Å; P566-F570 PolarHBondContact O-N 2.68Å
567	H	92.5	Very high	89.9	Confident	9 Å²	9	32.8 Å²	32.8	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-49.5	179.3	179.6	82.1	0	0	0	112.5	Q561 S564 I565 F570 R571	Q561-H567 PolarHBondContact OE1-CE1 3.5Å; Q561-H567 PolarHBondContact OE1-NE2 3.05Å; S564-H567 WeakPolarHBondContact O-CB 3.4Å; S564-H567 PolarHBondContact O-N 2.93Å; S564-H567 WeakPolarHBondContact OG-CB 3.4Å; S564-H567 PolarHBondContact OG-N 3.4Å; I565-H567 VanDerWaalsContact C-N 3.26Å; I565-H567 PolarHBondContact O-N 3.36Å; H567-F570 PolarHBondContact O-N 3.5Å; H567-R571 PolarHBondContact CE1-NE 3.1Å; H567-R571 WeakPolarHBondContact NE2-CD 3.49Å; H567-R571 PolarHBondContact NE2-NE 2.9Å; H567-R571 WeakPolarHBondContact O-CB 3.46Å; H567-R571 WeakPolarHBondContact O-CG 3.46Å; H567-R571 PolarHBondContact O-N 2.99Å
568	Y	94	Very high	90.6	Very high	32 Å²	32	29.7 Å²	29.7	13%	0.125	13%	0.129	C	C	.	.	H	α-helix	trans	-65.9	-43.1	179.1	-63.6	-66.9	0	0	0	112.2	Y562 S564 I565 P566 F570 A572 N622 A625	Y562-Y568 VanDerWaalsContact CA-OH 3.23Å; Y562-Y568 WeakPolarHBondContact CA-OH 3.44Å; Y562-Y568 VanDerWaalsContact O-CE2 3.3Å; Y562-Y568 WeakPolarHBondContact O-CE2 3.49Å; Y562-Y568 PolarHBondContact O-OH 3.48Å; S564-Y568 WeakPolarHBondContact O-CD2 3.36Å; I565-Y568 PolarHBondContact O-N 3.49Å; P566-Y568 PolarHBondContact O-N 3.36Å; Y568-F570 VanDerWaalsContact C-N 3.33Å; Y568-F570 PolarHBondContact O-N 3.48Å; Y568-A572 WeakPolarHBondContact O-CB 3.3Å; Y568-A572 PolarHBondContact O-N 2.96Å; Y568-N622 HydrophobicContact CD1-CB 4.48Å; Y568-N622 WeakPolarHBondContact CD1-OD1 3.33Å; Y568-N622 WeakPolarHBondContact O-CB 3.26Å; Y568-A625 HydrophobicContact CD1-CB 3.71Å; Y568-A625 HydrophobicContact CD2-CB 4.05Å; Y568-A625 HydrophobicContact CE1-CB 3.55Å; Y568-A625 HydrophobicContact CE2-CB 3.9Å; Y568-A625 HydrophobicContact CG-CB 3.95Å
569	G	94.1	Very high	91.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-43.6	177.3	0	0	0	0	0	112	I565 P566 A572 L573	I565-G569 PolarHBondContact O-N 3.46Å; P566-G569 PolarHBondContact O-N 3.06Å; G569-A572 PolarHBondContact O-N 3.43Å; G569-L573 WeakPolarHBondContact O-CG 3.09Å; G569-L573 PolarHBondContact O-N 3.29Å; G569-L573 VanDerWaalsContact O-N 3.09Å
570	F	93.6	Very high	91.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.6	-46.9	179.8	-176.5	-132.3	0	0	0	112.2	A419 L422 Y423 T426 L548 P566 H567 Y568 A572 L573 L574	A419-F570 WeakPolarHBondContact O-CE2 3.43Å; L422-F570 HydrophobicContact CB-CD2 4.38Å; L422-F570 HydrophobicContact CB-CE2 4Å; Y423-F570 HydrophobicContact CD2-CD1 4.32Å; Y423-F570 HydrophobicContact CD2-CD2 4.37Å; Y423-F570 HydrophobicContact CD2-CE1 4.28Å; Y423-F570 HydrophobicContact CD2-CE2 4.37Å; Y423-F570 HydrophobicContact CD2-CG 4.37Å; Y423-F570 HydrophobicContact CD2-CZ 4.32Å; Y423-F570 HydrophobicContact CG-CE2 4.48Å; Y423-F570 HydrophobicContact CG-CZ 4.47Å; T426-F570 HydrophobicContact CG2-CB 4.17Å; L548-F570 HydrophobicContact CD1-CE1 4.36Å; L548-F570 HydrophobicContact CD1-CZ 4.07Å; L548-F570 HydrophobicContact CD2-CE1 3.98Å; L548-F570 HydrophobicContact CD2-CZ 3.59Å; L548-F570 HydrophobicContact CG-CE1 3.92Å; L548-F570 HydrophobicContact CG-CZ 3.88Å; P566-F570 WeakPolarHBondContact O-CB 3.23Å; P566-F570 PolarHBondContact O-N 2.68Å; H567-F570 PolarHBondContact O-N 3.5Å; Y568-F570 VanDerWaalsContact C-N 3.33Å; Y568-F570 PolarHBondContact O-N 3.48Å; F570-A572 VanDerWaalsContact C-N 3.33Å; F570-A572 PolarHBondContact O-N 2.85Å; F570-L573 WeakPolarHBondContact O-CB 3.31Å; F570-L573 PolarHBondContact O-N 3.27Å; F570-L573 VanDerWaalsContact O-N 3.16Å; F570-L574 HydrophobicContact CD1-CD1 4.11Å; F570-L574 HydrophobicContact CD2-CG 4.2Å; F570-L574 HydrophobicContact CE1-CD1 3.68Å; F570-L574 HydrophobicContact CE1-CG 4.3Å; F570-L574 HydrophobicContact CE2-CD1 4.11Å; F570-L574 HydrophobicContact CE2-CD2 3.76Å; F570-L574 HydrophobicContact CE2-CG 3.82Å; F570-L574 HydrophobicContact CZ-CD1 3.68Å; F570-L574 HydrophobicContact CZ-CD2 3.81Å; F570-L574 HydrophobicContact CZ-CG 3.88Å; F570-L574 WeakPolarHBondContact O-CG 3.19Å; F570-L574 PolarHBondContact O-N 3.32Å
571	R	92.5	Very high	91.6	Very high	40 Å²	40	27.2 Å²	27.2	15%	0.151	14%	0.135	C	C	.	.	H	α-helix	trans	-60	-41	176.5	-77.3	-172	162.6	-160.2	-7.4	113	H567 L573 L574 H575 Q610 I612	H567-R571 PolarHBondContact CE1-NE 3.1Å; H567-R571 WeakPolarHBondContact NE2-CD 3.49Å; H567-R571 PolarHBondContact NE2-NE 2.9Å; H567-R571 WeakPolarHBondContact O-CB 3.46Å; H567-R571 WeakPolarHBondContact O-CG 3.46Å; H567-R571 PolarHBondContact O-N 2.99Å; R571-L573 VanDerWaalsContact C-N 3.34Å; R571-L573 PolarHBondContact O-N 2.9Å; R571-L574 PolarHBondContact O-N 3.23Å; R571-H575 WeakPolarHBondContact O-CB 3.35Å; R571-H575 PolarHBondContact O-N 3.35Å; R571-Q610 PolarHBondContact NH2-O 3.16Å; R571-I612 HydrophobicContact CB-CD1 4.24Å; R571-I612 HydrophobicContact CG-CD1 3.97Å; R571-I612 HydrophobicContact CG-CG1 4.11Å
572	A	94.4	Very high	91.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-41.3	175.4	0	0	0	0	0	112.2	T504 Y568 G569 F570 N576 F619 N622	T504-A572 HydrophobicContact CG2-CB 3.52Å; Y568-A572 WeakPolarHBondContact O-CB 3.3Å; Y568-A572 PolarHBondContact O-N 2.96Å; G569-A572 PolarHBondContact O-N 3.43Å; F570-A572 VanDerWaalsContact C-N 3.33Å; F570-A572 PolarHBondContact O-N 2.85Å; A572-N576 WeakPolarHBondContact O-CB 3.19Å; A572-N576 PolarHBondContact O-N 3.06Å; A572-N576 VanDerWaalsContact O-N 3.1Å; A572-F619 HydrophobicContact CB-CE2 4.28Å; A572-F619 WeakPolarHBondContact O-CE2 3.43Å; A572-N622 HydrophobicContact CB-CB 3.91Å
573	L	93.3	Very high	91.5	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-65.5	-43.5	175.7	-72.6	174.3	0	0	0	112	L422 M501 T504 I505 G569 F570 R571 N576 E577	L422-L573 HydrophobicContact CB-CB 4.3Å; L422-L573 HydrophobicContact CD1-CB 4.33Å; L422-L573 HydrophobicContact CD2-CB 4.26Å; M501-L573 HydrophobicContact CG-CD2 3.76Å; T504-L573 HydrophobicContact CG2-CD2 4Å; T504-L573 HydrophobicContact CG2-CG 4Å; I505-L573 HydrophobicContact CD1-CD2 4.5Å; I505-L573 HydrophobicContact CG1-CD2 4.07Å; G569-L573 WeakPolarHBondContact O-CG 3.09Å; G569-L573 PolarHBondContact O-N 3.29Å; G569-L573 VanDerWaalsContact O-N 3.09Å; F570-L573 WeakPolarHBondContact O-CB 3.31Å; F570-L573 PolarHBondContact O-N 3.27Å; F570-L573 VanDerWaalsContact O-N 3.16Å; R571-L573 VanDerWaalsContact C-N 3.34Å; R571-L573 PolarHBondContact O-N 2.9Å; L573-N576 PolarHBondContact O-N 3.36Å; L573-E577 WeakPolarHBondContact O-CB 3.39Å; L573-E577 PolarHBondContact O-N 2.95Å; L573-E577 VanDerWaalsContact O-N 3.1Å
574	L	92.2	Very high	91	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-49.8	175.9	-69.9	179.2	0	0	0	111.2	A419 L422 F570 R571 N576 E577 F578 F606 L607 I612	A419-L574 HydrophobicContact CB-CD2 3.95Å; L422-L574 HydrophobicContact CD1-CD2 4.01Å; F570-L574 HydrophobicContact CD1-CD1 4.11Å; F570-L574 HydrophobicContact CD2-CG 4.2Å; F570-L574 HydrophobicContact CE1-CD1 3.68Å; F570-L574 HydrophobicContact CE1-CG 4.3Å; F570-L574 HydrophobicContact CE2-CD1 4.11Å; F570-L574 HydrophobicContact CE2-CD2 3.76Å; F570-L574 HydrophobicContact CE2-CG 3.82Å; F570-L574 HydrophobicContact CZ-CD1 3.68Å; F570-L574 HydrophobicContact CZ-CD2 3.81Å; F570-L574 HydrophobicContact CZ-CG 3.88Å; F570-L574 WeakPolarHBondContact O-CG 3.19Å; F570-L574 PolarHBondContact O-N 3.32Å; R571-L574 PolarHBondContact O-N 3.23Å; L574-N576 PolarHBondContact O-N 2.87Å; L574-E577 PolarHBondContact O-N 3.39Å; L574-F578 HydrophobicContact CB-CD2 4.33Å; L574-F578 HydrophobicContact CD2-CD2 3.96Å; L574-F578 HydrophobicContact CD2-CE2 3.59Å; L574-F578 WeakPolarHBondContact O-CB 3.12Å; L574-F578 WeakPolarHBondContact O-CD2 3.49Å; L574-F578 PolarHBondContact O-N 2.81Å; L574-F606 HydrophobicContact CD2-CE1 4.17Å; L574-L607 HydrophobicContact CB-CD2 4.09Å; L574-I612 HydrophobicContact CB-CD1 4.02Å; L574-I612 HydrophobicContact CD1-CD1 3.88Å
575	H	93.2	Very high	89.7	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-58.2	-47	-179.8	-172.5	-72	0	0	0	111.7	R571 E577 L579 I612 D613 L614 S615 F619	R571-H575 WeakPolarHBondContact O-CB 3.35Å; R571-H575 PolarHBondContact O-N 3.35Å; H575-E577 VanDerWaalsContact C-N 3.32Å; H575-E577 PolarHBondContact O-N 3.3Å; H575-L579 WeakPolarHBondContact O-CB 3.41Å; H575-L579 PolarHBondContact O-N 3.38Å; H575-I612 HydrophobicContact CB-CG2 4.32Å; H575-D613 PolarHBondContact CD2-O 2.92Å; H575-D613 PolarHBondContact NE2-O 2.98Å; H575-D613 VanDerWaalsContact NE2-O 3.16Å; H575-L614 PolarHBondContact NE2-O 3Å; H575-S615 PolarHBondContact NE2-O 2.89Å; H575-F619 HydrophobicContact CB-CD2 4.15Å; H575-F619 AromaticContact ND1-CD2 3.75Å
576	N	92.8	Very high	88	Confident	16 Å²	16	27.2 Å²	27.2	9%	0.086	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-35.4	179.4	-179	56.5	0	0	0	113.4	C497 T500 A572 L573 L574 F619	C497-N576 WeakPolarHBondContact CA-OD1 3.45Å; C497-N576 PolarHBondContact O-ND2 3.49Å; T500-N576 WeakPolarHBondContact CB-OD1 3.26Å; T500-N576 HydrophobicContact CG2-CB 4.31Å; T500-N576 WeakPolarHBondContact CG2-OD1 3.5Å; A572-N576 WeakPolarHBondContact O-CB 3.19Å; A572-N576 PolarHBondContact O-N 3.06Å; A572-N576 VanDerWaalsContact O-N 3.1Å; L573-N576 PolarHBondContact O-N 3.36Å; L574-N576 PolarHBondContact O-N 2.87Å; N576-F619 HydrophobicContact CB-CE2 4.04Å
577	E	90.7	Very high	86	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-80.6	-49.3	-178.3	175.6	52.9	-163.1	0	0	112.9	R418 L422 V491 K492 L573 L574 H575 Q581	R418-E577 IonicContact CZ-OE1 3.9Å; R418-E577 IonicContact NH1-OE1 2.98Å; R418-E577 PolarHBondContact NH1-OE1 3.39Å; L422-E577 HydrophobicContact CD1-CB 3.73Å; L422-E577 HydrophobicContact CD1-CG 4.08Å; V491-E577 HydrophobicContact CG1-CG 4.03Å; V491-E577 WeakPolarHBondContact CG1-OE1 3.39Å; V491-E577 WeakPolarHBondContact CG1-OE2 3.43Å; K492-E577 WeakPolarHBondContact CB-OE2 3.46Å; K492-E577 PolarHBondContact N-OE2 3.49Å; L573-E577 WeakPolarHBondContact O-CB 3.39Å; L573-E577 PolarHBondContact O-N 2.95Å; L573-E577 VanDerWaalsContact O-N 3.1Å; L574-E577 PolarHBondContact O-N 3.39Å; H575-E577 VanDerWaalsContact C-N 3.32Å; H575-E577 PolarHBondContact O-N 3.3Å; E577-Q581 WeakPolarHBondContact O-CG 3.2Å
578	F	91	Very high	83.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-83.2	-27	-169.3	-75	-75.8	0	0	0	113.5	V415 R418 A419 L422 L574 G580 Q581 F583 G603 F606 L607	V415-F578 HydrophobicContact CB-CE1 4.4Å; V415-F578 HydrophobicContact CG1-CE1 3.77Å; V415-F578 HydrophobicContact CG1-CZ 4.18Å; V415-F578 WeakPolarHBondContact O-CZ 3.34Å; R418-F578 HydrophobicContact CB-CE1 4.41Å; R418-F578 HydrophobicContact CB-CZ 3.8Å; A419-F578 HydrophobicContact CB-CE2 4.18Å; A419-F578 HydrophobicContact CB-CZ 4.18Å; L422-F578 HydrophobicContact CD1-CE2 4.42Å; L574-F578 HydrophobicContact CB-CD2 4.33Å; L574-F578 HydrophobicContact CD2-CD2 3.96Å; L574-F578 HydrophobicContact CD2-CE2 3.59Å; L574-F578 WeakPolarHBondContact O-CB 3.12Å; L574-F578 WeakPolarHBondContact O-CD2 3.49Å; L574-F578 PolarHBondContact O-N 2.81Å; F578-G580 PolarHBondContact O-N 3.44Å; F578-G580 VanDerWaalsContact O-N 3.17Å; F578-Q581 WeakPolarHBondContact O-CB 3.41Å; F578-Q581 PolarHBondContact O-N 3.27Å; F578-F583 AromaticContact CD1-CE2 3.7Å; F578-F583 HydrophobicContact CD1-CE2 3.7Å; F578-F583 AromaticContact CD1-CZ 3.62Å; F578-F583 HydrophobicContact CD1-CZ 3.62Å; F578-F583 AromaticContact CE1-CE2 3.95Å; F578-F583 HydrophobicContact CE1-CE2 3.95Å; F578-F583 AromaticContact CE1-CZ 3.6Å; F578-F583 HydrophobicContact CE1-CZ 3.6Å; F578-G603 WeakPolarHBondContact O-CA 3.4Å; F578-F606 HydrophobicContact CD1-CD1 4.06Å; F578-F606 AromaticContact CD2-CD1 3.83Å; F578-F606 HydrophobicContact CD2-CD1 3.83Å; F578-F606 AromaticContact CD2-CE1 3.97Å; F578-F606 HydrophobicContact CD2-CE1 3.97Å; F578-F606 HydrophobicContact CE1-CD1 4.19Å; F578-F606 AromaticContact CE2-CD1 3.97Å; F578-F606 HydrophobicContact CE2-CD1 3.97Å; F578-F606 AromaticContact CE2-CE1 3.73Å; F578-F606 HydrophobicContact CE2-CE1 3.73Å; F578-F606 AromaticContact CG-CD1 3.89Å; F578-F606 HydrophobicContact CG-CD1 3.89Å; F578-F606 HydrophobicContact CG-CE1 4.47Å; F578-F606 HydrophobicContact CZ-CD1 4.13Å; F578-F606 HydrophobicContact CZ-CE1 4.01Å; F578-L607 HydrophobicContact CB-CD1 4.09Å; F578-L607 HydrophobicContact CB-CD2 4.2Å; F578-L607 HydrophobicContact CB-CG 3.98Å
579	L	90.8	Very high	81.9	Confident	60 Å²	60	44.9 Å²	44.9	31%	0.314	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	123.1	-178.9	-166.9	76.8	0	0	0	111.1	K492 H575 E604 L607 L614	K492-L579 PolarHBondContact NZ-O 2.56Å; H575-L579 WeakPolarHBondContact O-CB 3.41Å; H575-L579 PolarHBondContact O-N 3.38Å; L579-E604 HydrophobicContact CD1-CG 4.3Å; L579-L607 HydrophobicContact CB-CD1 4.33Å; L579-L607 HydrophobicContact CD1-CD1 4.33Å; L579-L614 HydrophobicContact CD1-CD2 4.16Å
580	G	87.1	Confident	79.9	Confident	57 Å²	57	52.6 Å²	52.6	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	15.9	-177.6	0	0	0	0	0	115.3	F578 E604	F578-G580 PolarHBondContact O-N 3.44Å; F578-G580 VanDerWaalsContact O-N 3.17Å; G580-E604 VanDerWaalsContact CA-OE1 3.3Å; G580-E604 WeakPolarHBondContact CA-OE1 3.31Å; G580-E604 PolarHBondContact N-OE1 3.41Å
581	Q	87.3	Confident	77.8	Confident	32 Å²	32	57.5 Å²	57.5	15%	0.15	31%	0.309	C	S	.	.			trans	-93	142.1	173.4	-67.3	-69.7	-3.5	0	0	111.6	K492 E577 F578 F583 G603	K492-Q581 VanDerWaalsContact CD-NE2 3.34Å; E577-Q581 WeakPolarHBondContact O-CG 3.2Å; F578-Q581 WeakPolarHBondContact O-CB 3.41Å; F578-Q581 PolarHBondContact O-N 3.27Å; Q581-F583 HydrophobicContact CB-CE1 4.48Å; Q581-F583 HydrophobicContact CB-CE2 3.68Å; Q581-F583 HydrophobicContact CB-CZ 3.66Å; Q581-F583 HydrophobicContact CG-CZ 4.27Å; Q581-G603 PolarHBondContact O-N 3.49Å
582	N	84.8	Confident	75.9	Confident	75 Å²	75	59.2 Å²	59.2	40%	0.401	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-121.7	124.5	172.2	-174.8	1.3	0	0	0	109.4	C584 C601	N582-C584 PolarHBondContact OD1-N 2.86Å; N582-C584 PolarHBondContact OD1-O 3.45Å; N582-C601 PolarHBondContact OD1-O 3.33Å; N582-C601 VanDerWaalsContact OD1-O 3.1Å
583	F	82.8	Confident	73.7	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.018	35%	0.35	C	S	.	.	S	Bend	trans	-107	3.7	-179.4	-55.3	-81.5	0	0	0	112.6	N410 V415 F578 Q581 P585 C601	N410-F583 CarbonylContact O-C 3.51Å; V415-F583 HydrophobicContact CG2-CB 4.15Å; V415-F583 HydrophobicContact CG2-CD1 3.9Å; V415-F583 HydrophobicContact CG2-CD2 3.6Å; V415-F583 HydrophobicContact CG2-CE1 4.17Å; V415-F583 HydrophobicContact CG2-CE2 3.9Å; V415-F583 HydrophobicContact CG2-CG 3.6Å; V415-F583 HydrophobicContact CG2-CZ 4.18Å; F578-F583 AromaticContact CD1-CE2 3.7Å; F578-F583 HydrophobicContact CD1-CE2 3.7Å; F578-F583 AromaticContact CD1-CZ 3.62Å; F578-F583 HydrophobicContact CD1-CZ 3.62Å; F578-F583 AromaticContact CE1-CE2 3.95Å; F578-F583 HydrophobicContact CE1-CE2 3.95Å; F578-F583 AromaticContact CE1-CZ 3.6Å; F578-F583 HydrophobicContact CE1-CZ 3.6Å; Q581-F583 HydrophobicContact CB-CE1 4.48Å; Q581-F583 HydrophobicContact CB-CE2 3.68Å; Q581-F583 HydrophobicContact CB-CZ 3.66Å; Q581-F583 HydrophobicContact CG-CZ 4.27Å; F583-P585 VanDerWaalsContact C-CD 3.44Å; F583-C601 PolarHBondContact N-O 3.2Å
584	C	79.6	Confident	71.8	Confident	29 Å²	29	71 Å²	71	20%	0.196	38%	0.38	C	S	.	.			trans	-126.9	64.4	171.5	-59.6	0	0	0	0	109.7	N582 E586 C601	N582-C584 PolarHBondContact OD1-N 2.86Å; N582-C584 PolarHBondContact OD1-O 3.45Å; C584-E586 VanDerWaalsContact C-N 3.27Å; C584-E586 PolarHBondContact O-N 2.98Å; C584-C601 HydrophobicContact CB-CB 3.61Å; C584-C601 WeakPolarHBondContact CB-SG 2.97Å; C584-C601 WeakPolarHBondContact SG-CA 3.41Å; C584-C601 WeakPolarHBondContact SG-CB 3.37Å; C584-C601 CovalentContact SG-SG 2.06Å; C584-C601 PolarHBondContact SG-SG 3.3Å
585	P	66.7	Low	69.9	Low	89 Å²	89	72 Å²	72	58%	0.578	39%	0.386	S	S	*	.			trans	-68.1	-25	-175	26.7	-33.2	0	0	0	113.3	F583	F583-P585 VanDerWaalsContact C-CD 3.44Å
586	E	58.6	Low	67.7	Low	116 Å²	116	79.6 Å²	79.6	54%	0.542	42%	0.422	S	S	.	.			trans	-116.5	114.5	176	-68.4	-170.8	-174.9	0	0	110.5	C584 N588	C584-E586 VanDerWaalsContact C-N 3.27Å; C584-E586 PolarHBondContact O-N 2.98Å; E586-N588 HydrophobicContact CB-CB 4.3Å; E586-N588 PolarHBondContact O-N 2.94Å; E586-N588 PolarHBondContact OE2-ND2 3.17Å
587	H	54.3	Low	65.8	Low	181 Å²	181	86.1 Å²	86.1	84%	0.838	46%	0.457	S	S	*	.			trans	-70.7	31.8	167.1	-111.9	-48.5	0	0	0	111.9	T589	H587-T589 PolarHBondContact O-N 3.45Å
588	N	46.2	Very low	64.2	Low	100 Å²	100	94.2 Å²	94.2	54%	0.535	49%	0.488	S	S	.	.			trans	-82.9	117.7	175.5	-72.2	-23.2	0	0	0	107.7	E586 E590 E591	E586-N588 HydrophobicContact CB-CB 4.3Å; E586-N588 PolarHBondContact O-N 2.94Å; E586-N588 PolarHBondContact OE2-ND2 3.17Å; N588-E590 PolarHBondContact O-N 2.9Å; N588-E591 PolarHBondContact O-N 3.44Å
589	T	54.2	Low	63.2	Low	130 Å²	130	96.2 Å²	96.2	80%	0.798	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-5.5	-168.9	36.2	0	0	0	0	116.5	H587	H587-T589 PolarHBondContact O-N 3.45Å
590	E	52.7	Low	62.4	Low	163 Å²	163	94.9 Å²	94.9	76%	0.762	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-31.8	-176.1	-64.6	-169	167.5	0	0	114.1	N588 S593	N588-E590 PolarHBondContact O-N 2.9Å; E590-S593 WeakPolarHBondContact O-CB 3.34Å; E590-S593 PolarHBondContact O-OG 3.06Å
591	E	49.5	Very low	62	Low	103 Å²	103	93.9 Å²	93.9	48%	0.481	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-79.4	-25.2	-179.3	-74.6	-165.4	147.6	0	0	113.8	N588 S593 R594	N588-E591 PolarHBondContact O-N 3.44Å; E591-S593 PolarHBondContact O-N 3.32Å; E591-S593 VanDerWaalsContact O-N 3.08Å; E591-R594 PolarHBondContact O-N 3.38Å; E591-R594 VanDerWaalsContact O-N 3.12Å
592	V	51.4	Low	62	Low	75 Å²	75	94.9 Å²	94.9	46%	0.455	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.5	174.6	-178.3	0	0	0	0	111.5	R594 C595 V599	V592-R594 VanDerWaalsContact C-N 3.26Å; V592-R594 PolarHBondContact O-N 2.87Å; V592-C595 PolarHBondContact O-N 2.94Å; V592-V599 HydrophobicContact CG1-CG2 4.27Å
593	S	49.5	Very low	62.2	Low	77 Å²	77	91.3 Å²	91.3	54%	0.538	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-65.8	-19.9	178.4	71.2	0	0	0	0	114.7	E590 E591 C595	E590-S593 WeakPolarHBondContact O-CB 3.34Å; E590-S593 PolarHBondContact O-OG 3.06Å; E591-S593 PolarHBondContact O-N 3.32Å; E591-S593 VanDerWaalsContact O-N 3.08Å; S593-C595 VanDerWaalsContact C-N 3.31Å
594	R	52.1	Low	62.5	Low	174 Å²	174	93.7 Å²	93.7	66%	0.657	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-76.2	-18	175.3	-76.2	-171.9	-170.9	148.4	9.4	113.6	E591 V592	E591-R594 PolarHBondContact O-N 3.38Å; E591-R594 VanDerWaalsContact O-N 3.12Å; V592-R594 VanDerWaalsContact C-N 3.26Å; V592-R594 PolarHBondContact O-N 2.87Å
595	C	53.6	Low	63	Low	20 Å²	20	95.1 Å²	95.1	14%	0.135	48%	0.481	C	S	.	.			trans	-107.1	78.2	-175.2	-72.5	0	0	0	0	110	C412 V592 S593 N597 V599	C412-C595 HydrophobicContact CB-CB 4.05Å; C412-C595 WeakPolarHBondContact CB-SG 3.4Å; C412-C595 WeakPolarHBondContact SG-CB 3.37Å; C412-C595 CovalentContact SG-SG 2.02Å; C412-C595 PolarHBondContact SG-SG 3.24Å; V592-C595 PolarHBondContact O-N 2.94Å; S593-C595 VanDerWaalsContact C-N 3.31Å; C595-N597 PolarHBondContact O-N 3.23Å; C595-V599 HydrophobicContact CB-CG2 3.98Å
596	H	46.8	Very low	64	Low	169 Å²	169	91.3 Å²	91.3	78%	0.782	46%	0.455	S	S	*	.			trans	-72.1	112.3	172.1	-86.1	-45.4	0	0	0	110.1
597	N	51.4	Low	65.5	Low	153 Å²	153	85.8 Å²	85.8	82%	0.818	43%	0.43	S	S	*	.	S	Bend	trans	88.7	121.3	-179.6	-56.5	-33.9	0	0	0	115.4	C595	C595-N597 PolarHBondContact O-N 3.23Å
598	Y	58.6	Low	67.1	Low	171 Å²	171	83 Å²	83	67%	0.671	42%	0.419	S	S	*	.			trans	39.8	89.7	173	-152.9	-92.1	0	0	0	115.4	I600 I609	Y598-I600 HydrophobicContact CD1-CG1 4.18Å; Y598-I600 HydrophobicContact CE1-CG1 4.42Å; Y598-I600 PolarHBondContact O-N 3.23Å; Y598-I609 HydrophobicContact CE1-CD1 3.83Å
599	V	68.5	Low	68.9	Low	42 Å²	42	81.2 Å²	81.2	26%	0.255	41%	0.408	S	S	.	.			trans	-79.7	113.8	-178.7	-172.5	0	0	0	0	109.7	C412 V592 C595 C601	C412-V599 HydrophobicContact CB-CG1 4.14Å; V592-V599 HydrophobicContact CG1-CG2 4.27Å; C595-V599 HydrophobicContact CB-CG2 3.98Å; V599-C601 VanDerWaalsContact CG1-SG 3.6Å
600	I	75.1	Confident	70.3	Confident	33 Å²	33	75.6 Å²	75.6	17%	0.169	37%	0.373	C	S	.	.			trans	-86.5	108.1	171.2	-58.8	177.3	0	0	0	107.6	Y598 E605 F606 I609	Y598-I600 HydrophobicContact CD1-CG1 4.18Å; Y598-I600 HydrophobicContact CE1-CG1 4.42Å; Y598-I600 PolarHBondContact O-N 3.23Å; I600-E605 HydrophobicContact CG2-CB 4.4Å; I600-E605 HydrophobicContact CG2-CG 4.43Å; I600-F606 HydrophobicContact CD1-CD2 3.88Å; I600-F606 HydrophobicContact CG2-CB 3.79Å; I600-F606 HydrophobicContact CG2-CD2 4.5Å; I600-I609 HydrophobicContact CD1-CD1 3.78Å; I600-I609 HydrophobicContact CG1-CD1 4.02Å
601	C	78.9	Confident	71.8	Confident	35 Å²	35	70.2 Å²	70.2	24%	0.236	36%	0.361	C	S	.	.			trans	-95.9	-30.4	-174.7	-80.5	0	0	0	0	113.6	N582 F583 C584 V599 E605	N582-C601 PolarHBondContact OD1-O 3.33Å; N582-C601 VanDerWaalsContact OD1-O 3.1Å; F583-C601 PolarHBondContact N-O 3.2Å; C584-C601 HydrophobicContact CB-CB 3.61Å; C584-C601 WeakPolarHBondContact CB-SG 2.97Å; C584-C601 WeakPolarHBondContact SG-CA 3.41Å; C584-C601 WeakPolarHBondContact SG-CB 3.37Å; C584-C601 CovalentContact SG-SG 2.06Å; C584-C601 PolarHBondContact SG-SG 3.3Å; V599-C601 VanDerWaalsContact CG1-SG 3.6Å; C601-E605 PolarHBondContact N-OE2 2.75Å
602	T	87.1	Confident	73.7	Confident	53 Å²	53	65.7 Å²	65.7	33%	0.325	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-113.7	146.4	-179.7	63.1	0	0	0	0	111	E604 E605 F606	T602-E604 PolarHBondContact O-N 3.14Å; T602-E605 PolarHBondContact O-N 3.43Å; T602-E605 VanDerWaalsContact OG1-CB 3.24Å; T602-E605 WeakPolarHBondContact OG1-CB 3.16Å; T602-E605 PolarHBondContact OG1-N 3.15Å; T602-F606 PolarHBondContact O-N 3.03Å
603	G	87.8	Confident	75.5	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.4	-28.2	174	0	0	0	0	0	112.5	F578 Q581 F606 L607	F578-G603 WeakPolarHBondContact O-CA 3.4Å; Q581-G603 PolarHBondContact O-N 3.49Å; G603-F606 WeakPolarHBondContact O-CB 3.18Å; G603-F606 PolarHBondContact O-N 3.5Å; G603-L607 VanDerWaalsContact O-CG 3.26Å; G603-L607 WeakPolarHBondContact O-CG 3.48Å; G603-L607 PolarHBondContact O-N 3.41Å
604	E	91	Very high	77.5	Confident	54 Å²	54	64.2 Å²	64.2	25%	0.252	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-44.5	172.7	-70.2	73.7	-166.8	0	0	111.9	L579 G580 T602 F606 L607 M608 L614	L579-E604 HydrophobicContact CD1-CG 4.3Å; G580-E604 VanDerWaalsContact CA-OE1 3.3Å; G580-E604 WeakPolarHBondContact CA-OE1 3.31Å; G580-E604 PolarHBondContact N-OE1 3.41Å; T602-E604 PolarHBondContact O-N 3.14Å; E604-F606 VanDerWaalsContact C-N 3.34Å; E604-L607 PolarHBondContact O-N 3.31Å; E604-M608 WeakPolarHBondContact O-CG 3.45Å; E604-M608 PolarHBondContact O-N 2.95Å; E604-L614 HydrophobicContact CB-CD1 4.06Å; E604-L614 HydrophobicContact CB-CD2 4.11Å; E604-L614 HydrophobicContact CG-CD1 4.21Å; E604-L614 HydrophobicContact CG-CD2 4.18Å
605	E	88.2	Confident	79.5	Confident	59 Å²	59	58 Å²	58	28%	0.276	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-43.1	175.9	-178	176.2	-157	0	0	111	I600 C601 T602 L607 M608 I609	I600-E605 HydrophobicContact CG2-CB 4.4Å; I600-E605 HydrophobicContact CG2-CG 4.43Å; C601-E605 PolarHBondContact N-OE2 2.75Å; T602-E605 PolarHBondContact O-N 3.43Å; T602-E605 VanDerWaalsContact OG1-CB 3.24Å; T602-E605 WeakPolarHBondContact OG1-CB 3.16Å; T602-E605 PolarHBondContact OG1-N 3.15Å; E605-L607 VanDerWaalsContact C-N 3.35Å; E605-L607 PolarHBondContact O-N 3.34Å; E605-M608 PolarHBondContact O-N 3.21Å; E605-I609 HydrophobicContact CG-CD1 4.1Å; E605-I609 WeakPolarHBondContact O-CD1 3.33Å; E605-I609 VanDerWaalsContact O-CG1 3.26Å; E605-I609 WeakPolarHBondContact O-CG1 3.36Å; E605-I609 PolarHBondContact O-N 3.17Å
606	F	88.4	Confident	81.3	Confident	9 Å²	9	61.5 Å²	61.5	4%	0.039	33%	0.332	C	S	.	.	H	α-helix	trans	-56.7	-48.2	172.9	-175.5	-105.6	0	0	0	111.8	V415 A419 L574 F578 I600 T602 G603 E604 M608 I609 Q610	V415-F606 HydrophobicContact CG1-CB 4.37Å; V415-F606 HydrophobicContact CG1-CD1 4.39Å; V415-F606 HydrophobicContact CG1-CD2 3.38Å; V415-F606 HydrophobicContact CG1-CE2 3.68Å; V415-F606 HydrophobicContact CG1-CG 3.78Å; V415-F606 HydrophobicContact CG1-CZ 4.3Å; A419-F606 HydrophobicContact CB-CE1 4.25Å; A419-F606 HydrophobicContact CB-CZ 3.89Å; L574-F606 HydrophobicContact CD2-CE1 4.17Å; F578-F606 HydrophobicContact CD1-CD1 4.06Å; F578-F606 AromaticContact CD2-CD1 3.83Å; F578-F606 HydrophobicContact CD2-CD1 3.83Å; F578-F606 AromaticContact CD2-CE1 3.97Å; F578-F606 HydrophobicContact CD2-CE1 3.97Å; F578-F606 HydrophobicContact CE1-CD1 4.19Å; F578-F606 AromaticContact CE2-CD1 3.97Å; F578-F606 HydrophobicContact CE2-CD1 3.97Å; F578-F606 AromaticContact CE2-CE1 3.73Å; F578-F606 HydrophobicContact CE2-CE1 3.73Å; F578-F606 AromaticContact CG-CD1 3.89Å; F578-F606 HydrophobicContact CG-CD1 3.89Å; F578-F606 HydrophobicContact CG-CE1 4.47Å; F578-F606 HydrophobicContact CZ-CD1 4.13Å; F578-F606 HydrophobicContact CZ-CE1 4.01Å; I600-F606 HydrophobicContact CD1-CD2 3.88Å; I600-F606 HydrophobicContact CG2-CB 3.79Å; I600-F606 HydrophobicContact CG2-CD2 4.5Å; T602-F606 PolarHBondContact O-N 3.03Å; G603-F606 WeakPolarHBondContact O-CB 3.18Å; G603-F606 PolarHBondContact O-N 3.5Å; E604-F606 VanDerWaalsContact C-N 3.34Å; F606-M608 PolarHBondContact O-N 3.23Å; F606-I609 PolarHBondContact O-N 3.3Å; F606-Q610 HydrophobicContact CD1-CG 4.35Å; F606-Q610 HydrophobicContact CE1-CG 3.97Å; F606-Q610 HydrophobicContact CE2-CG 4.4Å; F606-Q610 HydrophobicContact CZ-CG 4Å; F606-Q610 VanDerWaalsContact O-CG 3.27Å; F606-Q610 WeakPolarHBondContact O-CG 3.45Å; F606-Q610 PolarHBondContact O-N 3.17Å; F606-Q610 VanDerWaalsContact O-N 3.12Å
607	L	89.8	Confident	83.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-39.3	-180	-69.8	172.1	0	0	0	112.2	L574 F578 L579 G603 E604 E605 Q610 G611 I612 L614	L574-L607 HydrophobicContact CB-CD2 4.09Å; F578-L607 HydrophobicContact CB-CD1 4.09Å; F578-L607 HydrophobicContact CB-CD2 4.2Å; F578-L607 HydrophobicContact CB-CG 3.98Å; L579-L607 HydrophobicContact CB-CD1 4.33Å; L579-L607 HydrophobicContact CD1-CD1 4.33Å; G603-L607 VanDerWaalsContact O-CG 3.26Å; G603-L607 WeakPolarHBondContact O-CG 3.48Å; G603-L607 PolarHBondContact O-N 3.41Å; E604-L607 PolarHBondContact O-N 3.31Å; E605-L607 VanDerWaalsContact C-N 3.35Å; E605-L607 PolarHBondContact O-N 3.34Å; L607-Q610 CarbonylContact O-C 3.56Å; L607-Q610 PolarHBondContact O-N 2.95Å; L607-G611 PolarHBondContact O-N 2.95Å; L607-I612 HydrophobicContact CB-CB 4.35Å; L607-I612 HydrophobicContact CD2-CB 4.27Å; L607-I612 HydrophobicContact CD2-CD1 3.77Å; L607-I612 HydrophobicContact CD2-CG2 4.27Å; L607-I612 PolarHBondContact O-N 3.07Å; L607-L614 HydrophobicContact CB-CD2 3.69Å; L607-L614 HydrophobicContact CD1-CD2 3.82Å; L607-L614 HydrophobicContact CG-CD2 4.42Å
608	M	87.7	Confident	85.4	Confident	124 Å²	124	53.1 Å²	53.1	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-63.6	-42.4	175.4	-73.2	-165.3	-158.4	0	0	112	E604 E605 F606 Q610 G611 L614	E604-M608 WeakPolarHBondContact O-CG 3.45Å; E604-M608 PolarHBondContact O-N 2.95Å; E605-M608 PolarHBondContact O-N 3.21Å; F606-M608 PolarHBondContact O-N 3.23Å; M608-Q610 PolarHBondContact O-N 3.13Å; M608-G611 PolarHBondContact O-N 2.9Å; M608-L614 HydrophobicContact CE-CD1 3.35Å; M608-L614 HydrophobicContact CG-CD1 4.09Å; M608-L614 HydrophobicContact CG-CG 4.42Å
609	I	84.6	Confident	87	Confident	62 Å²	62	45.8 Å²	45.8	32%	0.318	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-35.3	176.4	-67.7	162.1	0	0	0	111	Y598 I600 E605 F606 G611	Y598-I609 HydrophobicContact CE1-CD1 3.83Å; I600-I609 HydrophobicContact CD1-CD1 3.78Å; I600-I609 HydrophobicContact CG1-CD1 4.02Å; E605-I609 HydrophobicContact CG-CD1 4.1Å; E605-I609 WeakPolarHBondContact O-CD1 3.33Å; E605-I609 VanDerWaalsContact O-CG1 3.26Å; E605-I609 WeakPolarHBondContact O-CG1 3.36Å; E605-I609 PolarHBondContact O-N 3.17Å; F606-I609 PolarHBondContact O-N 3.3Å; I609-G611 PolarHBondContact O-N 3.4Å
610	Q	84.1	Confident	88.3	Confident	12 Å²	12	50.7 Å²	50.7	6%	0.056	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4	176.1	-65.4	-64.6	-43.9	0	0	113.6	S547 R571 F606 L607 M608 I612	S547-Q610 VanDerWaalsContact C-OE1 3.23Å; S547-Q610 PolarHBondContact O-NE2 3.14Å; S547-Q610 VanDerWaalsContact O-NE2 3.11Å; S547-Q610 PolarHBondContact O-OE1 3.21Å; R571-Q610 PolarHBondContact NH2-O 3.16Å; F606-Q610 HydrophobicContact CD1-CG 4.35Å; F606-Q610 HydrophobicContact CE1-CG 3.97Å; F606-Q610 HydrophobicContact CE2-CG 4.4Å; F606-Q610 HydrophobicContact CZ-CG 4Å; F606-Q610 VanDerWaalsContact O-CG 3.27Å; F606-Q610 WeakPolarHBondContact O-CG 3.45Å; F606-Q610 PolarHBondContact O-N 3.17Å; F606-Q610 VanDerWaalsContact O-N 3.12Å; L607-Q610 CarbonylContact O-C 3.56Å; L607-Q610 PolarHBondContact O-N 2.95Å; M608-Q610 PolarHBondContact O-N 3.13Å; Q610-I612 VanDerWaalsContact C-N 3.34Å; Q610-I612 HydrophobicContact CB-CD1 3.98Å; Q610-I612 HydrophobicContact CB-CG1 4.05Å
611	G	84.9	Confident	89.2	Confident	50 Å²	50	52.3 Å²	52.3	52%	0.515	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	35.2	-177.2	0	0	0	0	0	113	L607 M608 I609	L607-G611 PolarHBondContact O-N 2.95Å; M608-G611 PolarHBondContact O-N 2.9Å; I609-G611 PolarHBondContact O-N 3.4Å
612	I	87.4	Confident	90	Very high	7 Å²	7	50.7 Å²	50.7	4%	0.036	26%	0.263	C	S	.	.			trans	-99.9	128.2	176.7	-60	173.9	0	0	0	108.5	R571 L574 H575 L607 Q610 L614	R571-I612 HydrophobicContact CB-CD1 4.24Å; R571-I612 HydrophobicContact CG-CD1 3.97Å; R571-I612 HydrophobicContact CG-CG1 4.11Å; L574-I612 HydrophobicContact CB-CD1 4.02Å; L574-I612 HydrophobicContact CD1-CD1 3.88Å; H575-I612 HydrophobicContact CB-CG2 4.32Å; L607-I612 HydrophobicContact CB-CB 4.35Å; L607-I612 HydrophobicContact CD2-CB 4.27Å; L607-I612 HydrophobicContact CD2-CD1 3.77Å; L607-I612 HydrophobicContact CD2-CG2 4.27Å; L607-I612 PolarHBondContact O-N 3.07Å; Q610-I612 VanDerWaalsContact C-N 3.34Å; Q610-I612 HydrophobicContact CB-CD1 3.98Å; Q610-I612 HydrophobicContact CB-CG1 4.05Å; I612-L614 PolarHBondContact O-N 3.05Å
613	D	90.1	Very high	90.4	Very high	72 Å²	72	48.9 Å²	48.9	39%	0.385	25%	0.251	S	S	.	.			trans	-67.5	127.7	175.5	176.7	18.3	0	0	0	110.7	H575 S615	H575-D613 PolarHBondContact CD2-O 2.92Å; H575-D613 PolarHBondContact NE2-O 2.98Å; H575-D613 VanDerWaalsContact NE2-O 3.16Å; D613-S615 VanDerWaalsContact CG-OG 3.27Å; D613-S615 PolarHBondContact O-N 2.68Å; D613-S615 WeakPolarHBondContact OD1-CB 3.37Å; D613-S615 PolarHBondContact OD1-N 2.93Å; D613-S615 PolarHBondContact OD1-OG 3.41Å; D613-S615 WeakPolarHBondContact OD2-CB 3.32Å; D613-S615 PolarHBondContact OD2-OG 3.21Å
614	L	91.9	Very high	90.8	Very high	49 Å²	49	53.2 Å²	53.2	26%	0.257	27%	0.274	S	S	.	.			trans	-73.2	-16.9	179.9	-62	178.3	0	0	0	112.8	H575 L579 E604 L607 M608 I612	H575-L614 PolarHBondContact NE2-O 3Å; L579-L614 HydrophobicContact CD1-CD2 4.16Å; E604-L614 HydrophobicContact CB-CD1 4.06Å; E604-L614 HydrophobicContact CB-CD2 4.11Å; E604-L614 HydrophobicContact CG-CD1 4.21Å; E604-L614 HydrophobicContact CG-CD2 4.18Å; L607-L614 HydrophobicContact CB-CD2 3.69Å; L607-L614 HydrophobicContact CD1-CD2 3.82Å; L607-L614 HydrophobicContact CG-CD2 4.42Å; M608-L614 HydrophobicContact CE-CD1 3.35Å; M608-L614 HydrophobicContact CG-CD1 4.09Å; M608-L614 HydrophobicContact CG-CG 4.42Å; I612-L614 PolarHBondContact O-N 3.05Å
615	S	93.8	Very high	91	Very high	44 Å²	44	51.6 Å²	51.6	31%	0.308	27%	0.27	S	S	.	.	S	Bend	trans	-61.9	161.4	179.6	87.2	0	0	0	0	111.7	H575 D613 W617 G618	H575-S615 PolarHBondContact NE2-O 2.89Å; D613-S615 VanDerWaalsContact CG-OG 3.27Å; D613-S615 PolarHBondContact O-N 2.68Å; D613-S615 WeakPolarHBondContact OD1-CB 3.37Å; D613-S615 PolarHBondContact OD1-N 2.93Å; D613-S615 PolarHBondContact OD1-OG 3.41Å; D613-S615 WeakPolarHBondContact OD2-CB 3.32Å; D613-S615 PolarHBondContact OD2-OG 3.21Å; S615-W617 PolarHBondContact O-N 2.79Å; S615-W617 WeakPolarHBondContact OG-CB 3.35Å; S615-W617 PolarHBondContact OG-N 2.77Å; S615-W617 VanDerWaalsContact OG-N 3.09Å; S615-G618 PolarHBondContact O-N 3.05Å; S615-G618 PolarHBondContact OG-N 3.41Å; S615-G618 VanDerWaalsContact OG-N 3.11Å
616	S	92.2	Very high	91.4	Very high	94 Å²	94	48.8 Å²	48.8	66%	0.657	26%	0.257	S	S	*	.	H	α-helix	trans	-61.3	-27.3	170.2	-65	0	0	0	0	111.9	F619 W620	S616-F619 PolarHBondContact O-N 3.45Å; S616-W620 PolarHBondContact O-N 3.25Å
617	W	93.6	Very high	91.8	Very high	146 Å²	146	50.8 Å²	50.8	55%	0.553	27%	0.269	S	S	*	.	H	α-helix	trans	-68	-41.2	175.7	175.1	-106.3	0	0	0	111.6	S615 F619 W620 E621 L624	S615-W617 PolarHBondContact O-N 2.79Å; S615-W617 WeakPolarHBondContact OG-CB 3.35Å; S615-W617 PolarHBondContact OG-N 2.77Å; S615-W617 VanDerWaalsContact OG-N 3.09Å; W617-F619 PolarHBondContact O-N 3.21Å; W617-F619 VanDerWaalsContact O-N 3.08Å; W617-W620 PolarHBondContact O-N 3.33Å; W617-E621 HydrophobicContact CD2-CB 4.45Å; W617-E621 HydrophobicContact CZ2-CB 4.02Å; W617-E621 WeakPolarHBondContact O-CB 3.35Å; W617-E621 PolarHBondContact O-N 2.88Å; W617-L624 HydrophobicContact CH2-CD2 3.85Å
618	G	89.4	Confident	92.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.1	-25.2	173.9	0	0	0	0	0	114.1	S615 E621 N622	S615-G618 PolarHBondContact O-N 3.05Å; S615-G618 PolarHBondContact OG-N 3.41Å; S615-G618 VanDerWaalsContact OG-N 3.11Å; G618-E621 WeakPolarHBondContact O-CG 3.43Å; G618-N622 PolarHBondContact O-ND2 3.28Å
619	F	93	Very high	92.5	Very high	16 Å²	16	49.7 Å²	49.7	7%	0.07	27%	0.272	C	S	.	.	H	α-helix	trans	-79.4	-50	171	179.2	-103.7	0	0	0	112.9	T500 A572 H575 N576 S616 W617 H623	T500-F619 HydrophobicContact CG2-CE1 3.75Å; T500-F619 HydrophobicContact CG2-CE2 3.8Å; T500-F619 HydrophobicContact CG2-CZ 3.08Å; A572-F619 HydrophobicContact CB-CE2 4.28Å; A572-F619 WeakPolarHBondContact O-CE2 3.43Å; H575-F619 HydrophobicContact CB-CD2 4.15Å; H575-F619 AromaticContact ND1-CD2 3.75Å; N576-F619 HydrophobicContact CB-CE2 4.04Å; S616-F619 PolarHBondContact O-N 3.45Å; W617-F619 PolarHBondContact O-N 3.21Å; W617-F619 VanDerWaalsContact O-N 3.08Å; F619-H623 AromaticContact CE1-CE1 3.59Å; F619-H623 AromaticContact CE1-ND1 3.87Å; F619-H623 AromaticContact CE2-CE1 3.63Å; F619-H623 AromaticContact CZ-CE1 3.11Å; F619-H623 WeakPolarHBondContact CZ-CE1 3.45Å; F619-H623 AromaticContact CZ-ND1 3.81Å; F619-H623 AromaticContact CZ-NE2 3.89Å; F619-H623 PolarHBondContact O-ND1 3.03Å
620	W	94.7	Very high	93	Very high	145 Å²	145	48.6 Å²	48.6	55%	0.549	27%	0.266	S	S	.	.	H	α-helix	trans	-76.6	-24.1	-173	-69.7	115.8	0	0	0	113.8	S616 W617 N622 H623 L624	S616-W620 PolarHBondContact O-N 3.25Å; W617-W620 PolarHBondContact O-N 3.33Å; W620-N622 PolarHBondContact O-N 2.55Å; W620-H623 HydrophobicContact CE3-CB 4.17Å; W620-H623 PolarHBondContact O-N 3.07Å; W620-H623 VanDerWaalsContact O-N 3.16Å; W620-L624 PolarHBondContact O-N 3.05Å
621	E	94.9	Very high	93.6	Very high	67 Å²	67	52.3 Å²	52.3	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-58.3	-37.8	175.2	69.3	176.6	-170.4	0	0	111.6	W617 G618 L624 A625	W617-E621 HydrophobicContact CD2-CB 4.45Å; W617-E621 HydrophobicContact CZ2-CB 4.02Å; W617-E621 WeakPolarHBondContact O-CB 3.35Å; W617-E621 PolarHBondContact O-N 2.88Å; G618-E621 WeakPolarHBondContact O-CG 3.43Å; E621-L624 PolarHBondContact O-N 3.22Å; E621-A625 WeakPolarHBondContact O-CB 3.3Å; E621-A625 PolarHBondContact O-N 3.4Å
622	N	94.7	Very high	94.2	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-41.7	178.3	-65.5	-64.2	0	0	0	111.4	Y568 A572 G618 W620 A625 L626	Y568-N622 HydrophobicContact CD1-CB 4.48Å; Y568-N622 WeakPolarHBondContact CD1-OD1 3.33Å; Y568-N622 WeakPolarHBondContact O-CB 3.26Å; A572-N622 HydrophobicContact CB-CB 3.91Å; G618-N622 PolarHBondContact O-ND2 3.28Å; W620-N622 PolarHBondContact O-N 2.55Å; N622-A625 PolarHBondContact O-N 3.31Å; N622-L626 WeakPolarHBondContact O-CB 3.48Å; N622-L626 VanDerWaalsContact O-CG 3.28Å; N622-L626 WeakPolarHBondContact O-CG 3.44Å; N622-L626 PolarHBondContact O-N 3.31Å
623	H	96	Very high	94.6	Very high	15 Å²	15	55.6 Å²	55.6	7%	0.069	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-42.9	177	-71.6	76.6	0	0	0	111.1	T504 F619 W620 L626 V627	T504-H623 WeakPolarHBondContact CA-NE2 3.43Å; T504-H623 PolarHBondContact OG1-CE1 2.83Å; T504-H623 PolarHBondContact OG1-NE2 2.72Å; F619-H623 AromaticContact CE1-CE1 3.59Å; F619-H623 AromaticContact CE1-ND1 3.87Å; F619-H623 AromaticContact CE2-CE1 3.63Å; F619-H623 AromaticContact CZ-CE1 3.11Å; F619-H623 WeakPolarHBondContact CZ-CE1 3.45Å; F619-H623 AromaticContact CZ-ND1 3.81Å; F619-H623 AromaticContact CZ-NE2 3.89Å; F619-H623 PolarHBondContact O-ND1 3.03Å; W620-H623 HydrophobicContact CE3-CB 4.17Å; W620-H623 PolarHBondContact O-N 3.07Å; W620-H623 VanDerWaalsContact O-N 3.16Å; H623-L626 PolarHBondContact O-N 2.94Å; H623-V627 WeakPolarHBondContact O-CB 3.15Å; H623-V627 VanDerWaalsContact O-CG2 3.27Å; H623-V627 WeakPolarHBondContact O-CG2 3.43Å; H623-V627 PolarHBondContact O-N 3.4Å
624	L	96.3	Very high	94.8	Very high	90 Å²	90	53.6 Å²	53.6	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-60.5	-46.6	176.3	-179.3	62.6	0	0	0	110.8	W617 W620 E621 L626 V627 C628	W617-L624 HydrophobicContact CH2-CD2 3.85Å; W620-L624 PolarHBondContact O-N 3.05Å; E621-L624 PolarHBondContact O-N 3.22Å; L624-L626 PolarHBondContact O-N 3.24Å; L624-V627 PolarHBondContact O-N 3.29Å; L624-C628 WeakPolarHBondContact O-CB 3.47Å; L624-C628 PolarHBondContact O-N 2.89Å; L624-C628 PolarHBondContact O-SG 3.25Å
625	A	96.1	Very high	95	Very high	21 Å²	21	54.9 Å²	54.9	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-49.1	176.8	0	0	0	0	0	111.5	Y568 E621 N622 V627 C628 T629	Y568-A625 HydrophobicContact CD1-CB 3.71Å; Y568-A625 HydrophobicContact CD2-CB 4.05Å; Y568-A625 HydrophobicContact CE1-CB 3.55Å; Y568-A625 HydrophobicContact CE2-CB 3.9Å; Y568-A625 HydrophobicContact CG-CB 3.95Å; E621-A625 WeakPolarHBondContact O-CB 3.3Å; E621-A625 PolarHBondContact O-N 3.4Å; N622-A625 PolarHBondContact O-N 3.31Å; A625-V627 PolarHBondContact O-N 3.01Å; A625-C628 PolarHBondContact O-N 3.12Å; A625-T629 WeakPolarHBondContact O-CB 2.88Å; A625-T629 PolarHBondContact O-N 3.33Å; A625-T629 PolarHBondContact O-OG1 3.48Å; A625-T629 VanDerWaalsContact O-OG1 3.05Å
626	L	96.7	Very high	95.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.9	-44.1	177.4	-73.9	172.2	0	0	0	112.5	V507 L508 S511 I565 N622 H623 L624 T629 M630	V507-L626 HydrophobicContact CG1-CB 3.62Å; V507-L626 HydrophobicContact CG1-CD1 4Å; V507-L626 HydrophobicContact CG1-CG 4.46Å; L508-L626 HydrophobicContact CD1-CD2 4.44Å; S511-L626 VanDerWaalsContact OG-C 3.26Å; S511-L626 PolarHBondContact OG-O 3.2Å; I565-L626 HydrophobicContact CG2-CD2 3.87Å; N622-L626 WeakPolarHBondContact O-CB 3.48Å; N622-L626 VanDerWaalsContact O-CG 3.28Å; N622-L626 WeakPolarHBondContact O-CG 3.44Å; N622-L626 PolarHBondContact O-N 3.31Å; H623-L626 PolarHBondContact O-N 2.94Å; L624-L626 PolarHBondContact O-N 3.24Å; L626-T629 PolarHBondContact O-N 3.03Å; L626-M630 WeakPolarHBondContact O-CB 3.48Å; L626-M630 PolarHBondContact O-N 3.35Å
627	V	96.5	Very high	95.2	Very high	50 Å²	50	51.9 Å²	51.9	30%	0.303	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-43.2	178.6	169.9	0	0	0	0	111.1	V507 H623 L624 A625 M630 I631	V507-V627 HydrophobicContact CG1-CG2 4.06Å; H623-V627 WeakPolarHBondContact O-CB 3.15Å; H623-V627 VanDerWaalsContact O-CG2 3.27Å; H623-V627 WeakPolarHBondContact O-CG2 3.43Å; H623-V627 PolarHBondContact O-N 3.4Å; L624-V627 PolarHBondContact O-N 3.29Å; A625-V627 PolarHBondContact O-N 3.01Å; V627-M630 HydrophobicContact CG1-CE 4.31Å; V627-M630 WeakPolarHBondContact O-CB 3.46Å; V627-M630 PolarHBondContact O-N 3.24Å; V627-I631 HydrophobicContact CG1-CD1 3.8Å; V627-I631 HydrophobicContact CG1-CG1 4.43Å; V627-I631 VanDerWaalsContact O-CG1 3.31Å; V627-I631 WeakPolarHBondContact O-CG1 3.46Å; V627-I631 PolarHBondContact O-N 3.43Å
628	C	96.6	Very high	95.2	Very high	59 Å²	59	48.2 Å²	48.2	40%	0.399	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-48	175.5	-74.5	0	0	0	0	111.3	L624 A625 M630 I631 I632	L624-C628 WeakPolarHBondContact O-CB 3.47Å; L624-C628 PolarHBondContact O-N 2.89Å; L624-C628 PolarHBondContact O-SG 3.25Å; A625-C628 PolarHBondContact O-N 3.12Å; C628-M630 VanDerWaalsContact C-N 3.33Å; C628-M630 PolarHBondContact O-N 2.96Å; C628-I631 PolarHBondContact O-N 3.39Å; C628-I632 VanDerWaalsContact O-CG1 3.3Å; C628-I632 WeakPolarHBondContact O-CG1 3.4Å; C628-I632 PolarHBondContact O-N 3.36Å
629	T	95.6	Very high	95.4	Very high	42 Å²	42	51 Å²	51	26%	0.258	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-44.4	175.7	-59.4	0	0	0	0	111.4	I565 A625 L626 I631 I632 L633	I565-T629 HydrophobicContact CD1-CG2 4.25Å; I565-T629 HydrophobicContact CG1-CG2 4.1Å; A625-T629 WeakPolarHBondContact O-CB 2.88Å; A625-T629 PolarHBondContact O-N 3.33Å; A625-T629 PolarHBondContact O-OG1 3.48Å; A625-T629 VanDerWaalsContact O-OG1 3.05Å; L626-T629 PolarHBondContact O-N 3.03Å; T629-I631 PolarHBondContact O-N 3.24Å; T629-I632 PolarHBondContact O-N 3.1Å; T629-L633 HydrophobicContact CG2-CD1 3.64Å; T629-L633 HydrophobicContact CG2-CG 4.31Å; T629-L633 WeakPolarHBondContact O-CB 3.19Å; T629-L633 VanDerWaalsContact O-CG 3.27Å; T629-L633 WeakPolarHBondContact O-CG 3.27Å; T629-L633 PolarHBondContact O-N 2.89Å
630	M	95.3	Very high	95.3	Very high	39 Å²	39	52.6 Å²	52.6	19%	0.192	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-48.7	176.2	178.3	-170.4	66.9	0	0	111.7	Y510 L626 V627 C628 I632 L633 L634	Y510-M630 HydrophobicContact CD1-SD 4.34Å; Y510-M630 HydrophobicContact CG-SD 4.39Å; L626-M630 WeakPolarHBondContact O-CB 3.48Å; L626-M630 PolarHBondContact O-N 3.35Å; V627-M630 HydrophobicContact CG1-CE 4.31Å; V627-M630 WeakPolarHBondContact O-CB 3.46Å; V627-M630 PolarHBondContact O-N 3.24Å; C628-M630 VanDerWaalsContact C-N 3.33Å; C628-M630 PolarHBondContact O-N 2.96Å; M630-I632 PolarHBondContact O-N 2.9Å; M630-L633 PolarHBondContact O-N 2.85Å; M630-L634 HydrophobicContact CG-CD1 3.78Å; M630-L634 HydrophobicContact CG-CG 4.28Å; M630-L634 VanDerWaalsContact O-CB 3.29Å; M630-L634 WeakPolarHBondContact O-CB 3.39Å; M630-L634 VanDerWaalsContact O-CG 3.28Å; M630-L634 WeakPolarHBondContact O-CG 3.27Å; M630-L634 PolarHBondContact O-N 3.11Å; M630-L634 HydrophobicContact SD-CD1 4.44Å
631	I	96.1	Very high	95	Very high	90 Å²	90	46 Å²	46	46%	0.462	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-45.3	-179.1	-69.9	167.8	0	0	0	110.6	V627 C628 T629 T635	V627-I631 HydrophobicContact CG1-CD1 3.8Å; V627-I631 HydrophobicContact CG1-CG1 4.43Å; V627-I631 VanDerWaalsContact O-CG1 3.31Å; V627-I631 WeakPolarHBondContact O-CG1 3.46Å; V627-I631 PolarHBondContact O-N 3.43Å; C628-I631 PolarHBondContact O-N 3.39Å; T629-I631 PolarHBondContact O-N 3.24Å; I631-T635 VanDerWaalsContact O-CB 3.32Å; I631-T635 WeakPolarHBondContact O-CB 3.47Å; I631-T635 PolarHBondContact O-N 3.41Å; I631-T635 PolarHBondContact O-OG1 3.46Å
632	I	96.8	Very high	94.7	Very high	103 Å²	103	47.1 Å²	47.1	53%	0.528	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-50.8	178.9	-68.3	165.5	0	0	0	110.3	C628 T629 M630 T635 I636	C628-I632 VanDerWaalsContact O-CG1 3.3Å; C628-I632 WeakPolarHBondContact O-CG1 3.4Å; C628-I632 PolarHBondContact O-N 3.36Å; T629-I632 PolarHBondContact O-N 3.1Å; M630-I632 PolarHBondContact O-N 2.9Å; I632-T635 WeakPolarHBondContact O-CB 3.44Å; I632-T635 PolarHBondContact O-N 3.17Å; I632-I636 HydrophobicContact CG2-CD1 4.08Å; I632-I636 WeakPolarHBondContact O-CG1 3.39Å; I632-I636 PolarHBondContact O-N 3.49Å
633	L	96.4	Very high	94.2	Very high	23 Å²	23	53.7 Å²	53.7	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-42	-177.2	-67.9	172.6	0	0	0	112.2	S514 L515 S518 I565 T629 M630 T635 I636 T637	S514-L633 WeakPolarHBondContact OG-CB 3.46Å; S514-L633 VanDerWaalsContact OG-CD1 3.26Å; S514-L633 WeakPolarHBondContact OG-CD1 3.3Å; L515-L633 HydrophobicContact CB-CD1 4.04Å; L515-L633 HydrophobicContact CD1-CD1 4.19Å; L515-L633 HydrophobicContact CD1-CD2 4.12Å; S518-L633 WeakPolarHBondContact CB-O 3.15Å; I565-L633 HydrophobicContact CD1-CD1 4.44Å; T629-L633 HydrophobicContact CG2-CD1 3.64Å; T629-L633 HydrophobicContact CG2-CG 4.31Å; T629-L633 WeakPolarHBondContact O-CB 3.19Å; T629-L633 VanDerWaalsContact O-CG 3.27Å; T629-L633 WeakPolarHBondContact O-CG 3.27Å; T629-L633 PolarHBondContact O-N 2.89Å; M630-L633 PolarHBondContact O-N 2.85Å; L633-T635 VanDerWaalsContact C-N 3.3Å; L633-T635 PolarHBondContact O-N 3.32Å; L633-I636 HydrophobicContact CD2-CD1 4.48Å; L633-I636 WeakPolarHBondContact O-CB 3.26Å; L633-I636 PolarHBondContact O-N 3.15Å; L633-T637 PolarHBondContact O-N 2.88Å; L633-T637 PolarHBondContact O-OG1 2.76Å
634	L	95.3	Very high	93.3	Very high	31 Å²	31	54 Å²	54	16%	0.162	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-33.1	174.8	-72.7	-178.8	0	0	0	112.5	F462 L466 L517 M630 T637 Y638	F462-L634 HydrophobicContact CZ-CB 4.13Å; F462-L634 HydrophobicContact CZ-CD2 4.17Å; F462-L634 WeakPolarHBondContact CZ-O 3.4Å; L466-L634 HydrophobicContact CD1-CD2 4.3Å; L466-L634 HydrophobicContact CD2-CD2 4.23Å; L517-L634 HydrophobicContact CD1-CD2 4.2Å; M630-L634 HydrophobicContact CG-CD1 3.78Å; M630-L634 HydrophobicContact CG-CG 4.28Å; M630-L634 VanDerWaalsContact O-CB 3.29Å; M630-L634 WeakPolarHBondContact O-CB 3.39Å; M630-L634 VanDerWaalsContact O-CG 3.28Å; M630-L634 WeakPolarHBondContact O-CG 3.27Å; M630-L634 PolarHBondContact O-N 3.11Å; M630-L634 HydrophobicContact SD-CD1 4.44Å; L634-T637 WeakPolarHBondContact O-CB 3.24Å; L634-T637 PolarHBondContact O-N 3.35Å; L634-Y638 WeakPolarHBondContact O-CB 3.48Å; L634-Y638 PolarHBondContact O-N 3.04Å
635	T	96.1	Very high	91.7	Very high	75 Å²	75	56 Å²	56	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-66.1	-42.6	173.7	-56.4	0	0	0	0	110.5	I631 I632 L633 T637 Y638 V639	I631-T635 VanDerWaalsContact O-CB 3.32Å; I631-T635 WeakPolarHBondContact O-CB 3.47Å; I631-T635 PolarHBondContact O-N 3.41Å; I631-T635 PolarHBondContact O-OG1 3.46Å; I632-T635 WeakPolarHBondContact O-CB 3.44Å; I632-T635 PolarHBondContact O-N 3.17Å; L633-T635 VanDerWaalsContact C-N 3.3Å; L633-T635 PolarHBondContact O-N 3.32Å; T635-T637 PolarHBondContact O-N 3.03Å; T635-Y638 PolarHBondContact O-N 3.44Å; T635-V639 WeakPolarHBondContact O-CG2 3.04Å; T635-V639 PolarHBondContact O-N 3.42Å
636	I	94.9	Very high	89.8	Confident	75 Å²	75	57.6 Å²	57.6	39%	0.385	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-47	173.3	-66.6	165.4	0	0	0	110.4	I632 L633 Y638 V639 Q640	I632-I636 HydrophobicContact CG2-CD1 4.08Å; I632-I636 WeakPolarHBondContact O-CG1 3.39Å; I632-I636 PolarHBondContact O-N 3.49Å; L633-I636 HydrophobicContact CD2-CD1 4.48Å; L633-I636 WeakPolarHBondContact O-CB 3.26Å; L633-I636 PolarHBondContact O-N 3.15Å; I636-Y638 VanDerWaalsContact C-N 3.31Å; I636-Y638 PolarHBondContact O-N 3.39Å; I636-V639 PolarHBondContact O-N 3.47Å; I636-Q640 HydrophobicContact CG2-CG 4.45Å; I636-Q640 WeakPolarHBondContact O-CG 3.41Å; I636-Q640 PolarHBondContact O-N 3.38Å
637	T	94.1	Very high	87.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-55.3	-46.5	175.5	-54	0	0	0	0	111.8	F440 F462 L517 S518 A521 L633 L634 T635 Q640 L641	F440-T637 HydrophobicContact CD2-CG2 4Å; F440-T637 HydrophobicContact CE2-CG2 3.63Å; F462-T637 HydrophobicContact CD2-CG2 4.5Å; F462-T637 HydrophobicContact CE2-CG2 3.81Å; L517-T637 HydrophobicContact CB-CG2 4.16Å; S518-T637 WeakPolarHBondContact CA-OG1 3.42Å; S518-T637 PolarHBondContact N-OG1 3.23Å; S518-T637 VanDerWaalsContact N-OG1 3.16Å; A521-T637 HydrophobicContact CB-CG2 3.71Å; L633-T637 PolarHBondContact O-N 2.88Å; L633-T637 PolarHBondContact O-OG1 2.76Å; L634-T637 WeakPolarHBondContact O-CB 3.24Å; L634-T637 PolarHBondContact O-N 3.35Å; T635-T637 PolarHBondContact O-N 3.03Å; T637-Q640 PolarHBondContact O-N 3.24Å; T637-L641 HydrophobicContact CG2-CD1 4.45Å; T637-L641 WeakPolarHBondContact O-CG 3.33Å; T637-L641 PolarHBondContact O-N 3.21Å
638	Y	94.7	Very high	84.8	Confident	69 Å²	69	65.4 Å²	65.4	27%	0.271	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-44.5	179.5	177.1	-110.3	0	0	0	112.1	V458 F462 L634 T635 I636 Q640 L641 L642	V458-Y638 HydrophobicContact CB-CE2 4.45Å; V458-Y638 HydrophobicContact CG1-CD2 4.41Å; V458-Y638 HydrophobicContact CG1-CE2 4.05Å; F462-Y638 HydrophobicContact CB-CD2 4.13Å; F462-Y638 HydrophobicContact CD1-CD2 4.13Å; F462-Y638 HydrophobicContact CG-CD2 4.02Å; L634-Y638 WeakPolarHBondContact O-CB 3.48Å; L634-Y638 PolarHBondContact O-N 3.04Å; T635-Y638 PolarHBondContact O-N 3.44Å; I636-Y638 VanDerWaalsContact C-N 3.31Å; I636-Y638 PolarHBondContact O-N 3.39Å; Y638-Q640 VanDerWaalsContact C-N 3.34Å; Y638-Q640 PolarHBondContact O-N 2.91Å; Y638-L641 PolarHBondContact O-N 3.34Å; Y638-L642 HydrophobicContact CD1-CD1 3.93Å; Y638-L642 HydrophobicContact CE1-CD1 3.41Å; Y638-L642 VanDerWaalsContact CE1-CD1 3.41Å; Y638-L642 HydrophobicContact CE1-CG 4.18Å; Y638-L642 HydrophobicContact CE2-CD1 4.42Å; Y638-L642 HydrophobicContact CE2-CG 4.34Å; Y638-L642 WeakPolarHBondContact O-CG 3.11Å; Y638-L642 PolarHBondContact O-N 3.48Å
639	V	92.6	Very high	81.9	Confident	59 Å²	59	67.6 Å²	67.6	36%	0.358	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.6	172.2	0	0	0	0	111.2	T635 I636 L641 L642 Q643	T635-V639 WeakPolarHBondContact O-CG2 3.04Å; T635-V639 PolarHBondContact O-N 3.42Å; I636-V639 PolarHBondContact O-N 3.47Å; V639-L641 PolarHBondContact O-N 2.95Å; V639-L642 WeakPolarHBondContact O-CB 3.34Å; V639-L642 PolarHBondContact O-N 2.81Å; V639-Q643 HydrophobicContact CG1-CG 4.46Å; V639-Q643 WeakPolarHBondContact O-CG 3.19Å; V639-Q643 PolarHBondContact O-N 2.06Å
640	Q	90.7	Very high	78.6	Confident	50 Å²	50	77.9 Å²	77.9	23%	0.234	38%	0.377	C	S	.	.	H	α-helix	trans	-60.2	-46.5	174.6	-75.3	179.2	-3.9	0	0	111.4	S518 A521 I636 T637 Y638 L642 Q643 V644	S518-Q640 PolarHBondContact O-NE2 2.02Å; S518-Q640 PolarHBondContact O-OE1 3.47Å; A521-Q640 HydrophobicContact CB-CB 4.38Å; I636-Q640 HydrophobicContact CG2-CG 4.45Å; I636-Q640 WeakPolarHBondContact O-CG 3.41Å; I636-Q640 PolarHBondContact O-N 3.38Å; T637-Q640 PolarHBondContact O-N 3.24Å; Y638-Q640 VanDerWaalsContact C-N 3.34Å; Y638-Q640 PolarHBondContact O-N 2.91Å; Q640-L642 VanDerWaalsContact C-N 3.27Å; Q640-L642 PolarHBondContact O-N 3.4Å; Q640-Q643 CarbonylContact O-C 3.58Å; Q640-Q643 WeakPolarHBondContact O-CA 3.07Å; Q640-Q643 PolarHBondContact O-N 3.2Å; Q640-V644 VanDerWaalsContact O-CG2 3.3Å; Q640-V644 WeakPolarHBondContact O-CG2 3.04Å; Q640-V644 PolarHBondContact O-N 2.87Å
641	L	89.7	Confident	77.8	Confident	6 Å²	6	79.8 Å²	79.8	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-61	-34	177.1	-72.8	171.1	0	0	0	113	F440 F447 V458 F462 A521 T637 Y638 V639 Q643	F440-L641 HydrophobicContact CB-CD2 4.26Å; F440-L641 HydrophobicContact CD1-CD1 4.12Å; F440-L641 HydrophobicContact CD1-CD2 4.37Å; F440-L641 HydrophobicContact CD2-CD1 4.28Å; F440-L641 HydrophobicContact CE1-CD1 3.96Å; F440-L641 HydrophobicContact CE2-CD1 4.13Å; F440-L641 HydrophobicContact CG-CD1 4.27Å; F440-L641 HydrophobicContact CG-CD2 4.22Å; F440-L641 HydrophobicContact CZ-CD1 3.97Å; F447-L641 HydrophobicContact CE1-CD2 4.38Å; V458-L641 HydrophobicContact CG1-CB 3.81Å; F462-L641 HydrophobicContact CB-CD1 4.49Å; F462-L641 HydrophobicContact CD2-CD1 3.76Å; A521-L641 HydrophobicContact CB-CD2 4.23Å; A521-L641 HydrophobicContact CB-CG 4.15Å; T637-L641 HydrophobicContact CG2-CD1 4.45Å; T637-L641 WeakPolarHBondContact O-CG 3.33Å; T637-L641 PolarHBondContact O-N 3.21Å; Y638-L641 PolarHBondContact O-N 3.34Å; V639-L641 PolarHBondContact O-N 2.95Å; L641-Q643 VanDerWaalsContact C-N 3.34Å
642	L	87.8	Confident	76.8	Confident	91 Å²	91	79.3 Å²	79.3	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-67.8	-34.9	172.6	-73.3	171.5	0	0	0	112.4	V458 Y638 V639 Q640	V458-L642 HydrophobicContact CB-CD2 3.79Å; V458-L642 HydrophobicContact CG1-CD2 4.01Å; V458-L642 HydrophobicContact CG1-CG 4.24Å; V458-L642 HydrophobicContact CG2-CD2 3.91Å; Y638-L642 HydrophobicContact CD1-CD1 3.93Å; Y638-L642 HydrophobicContact CE1-CD1 3.41Å; Y638-L642 VanDerWaalsContact CE1-CD1 3.41Å; Y638-L642 HydrophobicContact CE1-CG 4.18Å; Y638-L642 HydrophobicContact CE2-CD1 4.42Å; Y638-L642 HydrophobicContact CE2-CG 4.34Å; Y638-L642 WeakPolarHBondContact O-CG 3.11Å; Y638-L642 PolarHBondContact O-N 3.48Å; V639-L642 WeakPolarHBondContact O-CB 3.34Å; V639-L642 PolarHBondContact O-N 2.81Å; Q640-L642 VanDerWaalsContact C-N 3.27Å; Q640-L642 PolarHBondContact O-N 3.4Å
643	Q	84	Confident	75.7	Confident	139 Å²	139	77.9 Å²	77.9	65%	0.65	37%	0.374	S	S	*	.	H	α-helix	trans	-83.8	-11.6	-179.4	-71.2	-179.4	-9.4	0	0	113.7	V639 Q640 L641 K645	V639-Q643 HydrophobicContact CG1-CG 4.46Å; V639-Q643 WeakPolarHBondContact O-CG 3.19Å; V639-Q643 PolarHBondContact O-N 2.06Å; Q640-Q643 CarbonylContact O-C 3.58Å; Q640-Q643 WeakPolarHBondContact O-CA 3.07Å; Q640-Q643 PolarHBondContact O-N 3.2Å; L641-Q643 VanDerWaalsContact C-N 3.34Å; Q643-K645 PolarHBondContact O-N 3.27Å
644	V	77.6	Confident	74.5	Confident	21 Å²	21	81.2 Å²	81.2	13%	0.127	39%	0.389	C	S	.	.			trans	-64.3	86.7	174.1	167.4	0	0	0	0	108.5	L448 Q640	L448-V644 HydrophobicContact CD1-CG1 4Å; L448-V644 HydrophobicContact CD2-CG1 3.8Å; L448-V644 HydrophobicContact CG-CG1 4.18Å; Q640-V644 VanDerWaalsContact O-CG2 3.3Å; Q640-V644 WeakPolarHBondContact O-CG2 3.04Å; Q640-V644 PolarHBondContact O-N 2.87Å
645	K	63.3	Low	73.2	Confident	133 Å²	133	84.3 Å²	84.3	58%	0.578	40%	0.403	S	S	*	.			trans	-74.1	153.8	174.4	-74.1	-174.1	176.3	-172.4	0	110.1	Q643	Q643-K645 PolarHBondContact O-N 3.27Å
646	N	55.3	Low	71.7	Confident	55 Å²	55	84.9 Å²	84.9	29%	0.294	40%	0.399	S	S	.	.	S	Bend	trans	-40.2	137.6	-178	-76.9	-3.8	0	0	0	112.6	R96 T452 R648	R96-N646 PolarHBondContact O-ND2 3.26Å; T452-N646 WeakPolarHBondContact CG2-OD1 3.35Å; N646-R648 PolarHBondContact O-N 3.08Å
647	I	49.5	Very low	70	Confident	61 Å²	61	85.6 Å²	85.6	31%	0.313	40%	0.4	S	S	.	.			trans	-48.7	123.6	-168.1	-48.7	168.8	0	0	0	110.9	L448 N649	L448-I647 HydrophobicContact CB-CD1 4.42Å; L448-I647 HydrophobicContact CB-CG1 4.43Å; L448-I647 HydrophobicContact CD1-CD1 4.04Å; L448-I647 HydrophobicContact CD1-CG1 3.38Å; L448-I647 HydrophobicContact CG-CG1 4.47Å; I647-N649 HydrophobicContact CG2-CB 4.42Å; I647-N649 WeakPolarHBondContact CG2-OD1 3.48Å; I647-N649 PolarHBondContact O-N 2.67Å
648	R	38.6	Very low	68.2	Low	153 Å²	153	92.2 Å²	92.2	58%	0.577	43%	0.431	S	S	*	.			trans	-66.2	87.2	149.8	-89.8	-179.5	171.9	166.1	-3.8	106.1	N646 F650	N646-R648 PolarHBondContact O-N 3.08Å; R648-F650 PolarHBondContact O-N 3.12Å
649	N	35.8	Very low	66	Low	105 Å²	105	94.2 Å²	94.2	56%	0.561	44%	0.444	S	S	*	.			trans	-77.3	113.8	166.2	-81.7	-24.9	0	0	0	106	I647	I647-N649 HydrophobicContact CG2-CB 4.42Å; I647-N649 WeakPolarHBondContact CG2-OD1 3.48Å; I647-N649 PolarHBondContact O-N 2.67Å
650	F	26.9	Very low	63.6	Low	257 Å²	257	97.4 Å²	97.4	100%	1.127	45%	0.452	S	S	*	.			trans	-68	0	157.9	-89.3	-87.5	0	0	0	109.5	R648	R648-F650 PolarHBondContact O-N 3.12Å

Retrieved 650 of 650 residues in 1535.4 ms (Link to these results)

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