A0A077Z6P7_TRITR Loading...

PHR and BACK and BTB domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6P7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 536 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	37.5	Very low	32.5	Very low	242 Å²	242	168.6 Å²	168.6	100%	1.192	82%	0.824	S	S	*	*				0	114	0	-74.7	179.6	-175.6	0	0	107
2	E	34.5	Very low	32.3	Very low	200 Å²	200	164.5 Å²	164.5	94%	0.935	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-56.5	135	178.7	-72.5	168.2	141.8	0	0	110.3
3	R	34.6	Very low	32	Very low	242 Å²	242	162.8 Å²	162.8	91%	0.913	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-75.8	123.6	177.6	-73.9	-177.7	-179.2	-178.6	0.1	108.7	P5	R3-P5 WeakPolarHBondContact O-CD 3.41Å
4	D	38.8	Very low	32.2	Very low	127 Å²	127	156.4 Å²	156.4	68%	0.679	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.7	120.7	175.7	-168.1	-14.5	0	0	0	110.6	Y6	D4-Y6 VanDerWaalsContact C-N 3.27Å; D4-Y6 PolarHBondContact O-N 3.29Å; D4-Y6 PolarHBondContact OD1-N 3.43Å
5	P	41.5	Very low	32.7	Very low	110 Å²	110	149.7 Å²	149.7	71%	0.714	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	8.1	-173.8	29.5	-32.6	0	0	0	115.4	R3	R3-P5 WeakPolarHBondContact O-CD 3.41Å
6	Y	32.8	Very low	33.1	Very low	201 Å²	201	151.2 Å²	151.2	79%	0.788	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	7.3	-174.8	-73	-75.9	0	0	0	117.5	D4 R8	D4-Y6 VanDerWaalsContact C-N 3.27Å; D4-Y6 PolarHBondContact O-N 3.29Å; D4-Y6 PolarHBondContact OD1-N 3.43Å; Y6-R8 PolarHBondContact O-N 3.06Å
7	F	29.9	Very low	33.4	Very low	190 Å²	190	150.7 Å²	150.7	83%	0.833	76%	0.756	S	S	*	*			trans	-84	87.4	174.8	-142.7	-94.5	0	0	0	111.8	P9	F7-P9 WeakPolarHBondContact O-CD 3.42Å
8	R	25.8	Very low	34.3	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	74%	0.744	S	S	*	*			trans	-80.6	115.8	168.5	-71.9	-174.7	177.9	-174.3	-0.3	109.6	Y6 A10	Y6-R8 PolarHBondContact O-N 3.06Å; R8-A10 PolarHBondContact O-N 3.47Å
9	P	28.1	Very low	35	Very low	108 Å²	108	147.2 Å²	147.2	70%	0.701	74%	0.735	S	S	*	*			trans	-69	130.2	166.3	-4.6	20.5	0	0	0	108.6	F7 V11	F7-P9 WeakPolarHBondContact O-CD 3.42Å; P9-V11 PolarHBondContact O-N 3.18Å
10	A	27.8	Very low	36	Very low	90 Å²	90	149.1 Å²	149.1	74%	0.744	73%	0.733	S	S	*	*			trans	-57.6	118.5	175.9	0	0	0	0	0	110.2	R8 V12	R8-A10 PolarHBondContact O-N 3.47Å; A10-V12 VanDerWaalsContact C-N 3.32Å; A10-V12 PolarHBondContact O-N 3.15Å
11	V	26.5	Very low	37.1	Very low	115 Å²	115	146.4 Å²	146.4	70%	0.697	72%	0.722	S	S	*	*			trans	-68.2	91.7	169.3	178.4	0	0	0	0	107.3	P9 N13	P9-V11 PolarHBondContact O-N 3.18Å; V11-N13 VanDerWaalsContact C-N 3.26Å; V11-N13 HydrophobicContact CG1-CB 4.34Å; V11-N13 WeakPolarHBondContact CG1-OD1 3.4Å; V11-N13 PolarHBondContact O-N 2.95Å; V11-N13 VanDerWaalsContact O-N 3.15Å
12	V	29.5	Very low	38.4	Very low	119 Å²	119	140.1 Å²	140.1	72%	0.721	69%	0.689	S	S	*	*			trans	-82.2	82.8	165.3	-175.9	0	0	0	0	106.6	A10 C14	A10-V12 VanDerWaalsContact C-N 3.32Å; A10-V12 PolarHBondContact O-N 3.15Å; V12-C14 HydrophobicContact CG1-CB 4.47Å; V12-C14 PolarHBondContact O-N 2.93Å
13	N	28.9	Very low	39.9	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	67%	0.668	S	S	*	*			trans	-70.3	76.7	164.7	-84.9	-15.4	0	0	0	108.6	V11	V11-N13 VanDerWaalsContact C-N 3.26Å; V11-N13 HydrophobicContact CG1-CB 4.34Å; V11-N13 WeakPolarHBondContact CG1-OD1 3.4Å; V11-N13 PolarHBondContact O-N 2.95Å; V11-N13 VanDerWaalsContact O-N 3.15Å
14	C	34.1	Very low	41.6	Very low	73 Å²	73	127 Å²	127	49%	0.493	65%	0.648	S	S	.	*			trans	-90.6	102.6	154.7	-104.3	0	0	0	0	105.9	V12 F16	V12-C14 HydrophobicContact CG1-CB 4.47Å; V12-C14 PolarHBondContact O-N 2.93Å; C14-F16 PolarHBondContact O-N 3.47Å
15	S	40.3	Very low	43	Very low	55 Å²	55	127.3 Å²	127.3	39%	0.385	65%	0.646	S	S	.	*			trans	-61	138.5	178.4	65.6	0	0	0	0	109.4	E17 Q18	S15-E17 PolarHBondContact O-N 2.88Å; S15-Q18 PolarHBondContact O-N 2.99Å
16	F	39.9	Very low	44.2	Very low	174 Å²	174	130.3 Å²	130.3	76%	0.763	64%	0.643	S	S	*	*	H	α-helix	trans	-50.1	-28.9	178.3	-153.1	-99	0	0	0	112.5	C14 Q19 R20	C14-F16 PolarHBondContact O-N 3.47Å; F16-Q19 PolarHBondContact O-N 3.48Å; F16-R20 PolarHBondContact O-N 2.9Å
17	E	37.7	Very low	45.4	Very low	143 Å²	143	123.3 Å²	123.3	67%	0.668	62%	0.623	S	S	*	*	H	α-helix	trans	-64.1	-37.1	174.8	-68.9	178.4	151.8	0	0	113.6	S15 R20 N21	S15-E17 PolarHBondContact O-N 2.88Å; E17-R20 PolarHBondContact O-N 2.91Å; E17-N21 WeakPolarHBondContact O-CB 3.15Å; E17-N21 PolarHBondContact O-N 3.42Å; E17-N21 PolarHBondContact O-ND2 3.45Å
18	Q	48.8	Very low	46.9	Very low	115 Å²	115	118.4 Å²	118.4	54%	0.537	60%	0.603	S	S	.	*	H	α-helix	trans	-67.6	-41.2	177.1	-74.5	179.3	-21.4	0	0	111.3	S15 N21 Q22	S15-Q18 PolarHBondContact O-N 2.99Å; Q18-N21 PolarHBondContact O-N 3.04Å; Q18-Q22 WeakPolarHBondContact O-CB 3.45Å; Q18-Q22 PolarHBondContact O-N 3.43Å
19	Q	47.4	Very low	48.4	Very low	120 Å²	120	110 Å²	110	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-65.6	-40	175.9	-71.6	-176.3	-2.9	0	0	111.7	F16 Q22 A23	F16-Q19 PolarHBondContact O-N 3.48Å; Q19-Q22 PolarHBondContact O-N 2.94Å; Q19-A23 WeakPolarHBondContact O-CB 3.35Å; Q19-A23 PolarHBondContact O-N 2.81Å
20	R	55.1	Low	49.4	Very low	184 Å²	184	108.9 Å²	108.9	69%	0.694	57%	0.573	S	S	*	*	H	α-helix	trans	-63.9	-45	175.8	-163.9	178.8	98.5	151	4.7	111.9	F16 E17 A23 H24	F16-R20 PolarHBondContact O-N 2.9Å; E17-R20 PolarHBondContact O-N 2.91Å; R20-A23 PolarHBondContact O-N 3.26Å; R20-H24 WeakPolarHBondContact O-CB 3.39Å; R20-H24 PolarHBondContact O-N 3.36Å
21	N	60.2	Low	50.2	Low	94 Å²	94	109.5 Å²	109.5	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-66.7	-38.8	179.4	-70.8	-10.2	0	0	0	111.5	E17 Q18 H24 E25	E17-N21 WeakPolarHBondContact O-CB 3.15Å; E17-N21 PolarHBondContact O-N 3.42Å; E17-N21 PolarHBondContact O-ND2 3.45Å; Q18-N21 PolarHBondContact O-N 3.04Å; N21-H24 PolarHBondContact O-N 3.44Å; N21-E25 PolarHBondContact O-N 3.48Å
22	Q	65	Low	51	Low	109 Å²	109	113.2 Å²	113.2	51%	0.509	57%	0.565	S	S	.	*	H	α-helix	trans	-69.5	-34.8	177.8	-148.2	173.8	36	0	0	112.3	Q18 Q19 R26	Q18-Q22 WeakPolarHBondContact O-CB 3.45Å; Q18-Q22 PolarHBondContact O-N 3.43Å; Q19-Q22 PolarHBondContact O-N 2.94Å; Q22-R26 WeakPolarHBondContact O-CB 3.46Å; Q22-R26 VanDerWaalsContact O-CG 3.26Å; Q22-R26 WeakPolarHBondContact O-CG 3.21Å; Q22-R26 PolarHBondContact O-N 3.49Å
23	A	65.4	Low	51.5	Low	59 Å²	59	115.2 Å²	115.2	49%	0.488	57%	0.567	S	S	.	*	H	α-helix	trans	-67.2	-39.1	171.9	0	0	0	0	0	111.9	Q19 R20 R26 S27	Q19-A23 WeakPolarHBondContact O-CB 3.35Å; Q19-A23 PolarHBondContact O-N 2.81Å; R20-A23 PolarHBondContact O-N 3.26Å; A23-R26 PolarHBondContact O-N 2.98Å; A23-S27 PolarHBondContact O-N 2.94Å
24	H	70.2	Confident	51.7	Low	108 Å²	108	112.8 Å²	112.8	50%	0.5	56%	0.56	S	S	.	*	H	α-helix	trans	-69.4	-40.4	176.6	-164.4	71.7	0	0	0	112.5	R20 N21 R26 S27 Q28	R20-H24 WeakPolarHBondContact O-CB 3.39Å; R20-H24 PolarHBondContact O-N 3.36Å; N21-H24 PolarHBondContact O-N 3.44Å; H24-R26 VanDerWaalsContact C-N 3.34Å; H24-R26 PolarHBondContact O-N 3.46Å; H24-S27 PolarHBondContact O-N 2.88Å; H24-S27 PolarHBondContact O-OG 2.92Å; H24-Q28 PolarHBondContact NE2-NE2 2.75Å; H24-Q28 WeakPolarHBondContact O-CB 3.18Å; H24-Q28 WeakPolarHBondContact O-CG 3.49Å; H24-Q28 PolarHBondContact O-N 2.6Å
25	E	68.8	Low	51.6	Low	134 Å²	134	115.3 Å²	115.3	63%	0.626	57%	0.567	S	S	*	*	H	α-helix	trans	-64.5	-38.7	173.2	-80.9	-175.8	158.5	0	0	111.8	N21 Q28 A29	N21-E25 PolarHBondContact O-N 3.48Å; E25-Q28 PolarHBondContact O-N 2.88Å; E25-A29 VanDerWaalsContact O-CB 3.26Å; E25-A29 WeakPolarHBondContact O-CB 3.32Å; E25-A29 PolarHBondContact O-N 3.46Å
26	R	66.4	Low	51	Low	172 Å²	172	118.5 Å²	118.5	65%	0.649	58%	0.584	S	S	*	*	H	α-helix	trans	-65.2	-40.9	174.9	-76.6	176.5	-179.7	-175.3	2.3	112	Q22 A23 H24 A29 V30	Q22-R26 WeakPolarHBondContact O-CB 3.46Å; Q22-R26 VanDerWaalsContact O-CG 3.26Å; Q22-R26 WeakPolarHBondContact O-CG 3.21Å; Q22-R26 PolarHBondContact O-N 3.49Å; A23-R26 PolarHBondContact O-N 2.98Å; H24-R26 VanDerWaalsContact C-N 3.34Å; H24-R26 PolarHBondContact O-N 3.46Å; R26-A29 PolarHBondContact O-N 3.24Å; R26-V30 VanDerWaalsContact O-CG2 3.27Å; R26-V30 WeakPolarHBondContact O-CG2 3.25Å; R26-V30 PolarHBondContact O-N 3.37Å
27	S	58.2	Low	50.7	Low	55 Å²	55	115.5 Å²	115.5	39%	0.385	58%	0.58	S	S	.	*	H	α-helix	trans	-68.1	-39.2	176.5	70.1	0	0	0	0	111.9	A23 H24 V30 L31	A23-S27 PolarHBondContact O-N 2.94Å; H24-S27 PolarHBondContact O-N 2.88Å; H24-S27 PolarHBondContact O-OG 2.92Å; S27-V30 PolarHBondContact O-N 3.27Å; S27-L31 WeakPolarHBondContact O-CB 3.42Å; S27-L31 WeakPolarHBondContact O-CG 3.07Å; S27-L31 PolarHBondContact O-N 3.48Å
28	Q	60.3	Low	50.1	Low	87 Å²	87	114.7 Å²	114.7	41%	0.407	59%	0.585	S	S	.	*	H	α-helix	trans	-67.5	-36.1	174.1	-72.5	-162	4.2	0	0	112.8	H24 E25 L31 R32	H24-Q28 PolarHBondContact NE2-NE2 2.75Å; H24-Q28 WeakPolarHBondContact O-CB 3.18Å; H24-Q28 WeakPolarHBondContact O-CG 3.49Å; H24-Q28 PolarHBondContact O-N 2.6Å; E25-Q28 PolarHBondContact O-N 2.88Å; Q28-L31 PolarHBondContact O-N 3.47Å; Q28-R32 WeakPolarHBondContact O-CB 3.42Å; Q28-R32 WeakPolarHBondContact O-CG 3.32Å; Q28-R32 PolarHBondContact O-N 2.88Å
29	A	57.1	Low	49.1	Very low	52 Å²	52	114.8 Å²	114.8	43%	0.43	59%	0.594	S	S	.	*	H	α-helix	trans	-67.1	-40	175.3	0	0	0	0	0	111.8	E25 R26 R32 Q33	E25-A29 VanDerWaalsContact O-CB 3.26Å; E25-A29 WeakPolarHBondContact O-CB 3.32Å; E25-A29 PolarHBondContact O-N 3.46Å; R26-A29 PolarHBondContact O-N 3.24Å; A29-R32 PolarHBondContact O-N 3.36Å; A29-Q33 PolarHBondContact O-N 3.17Å
30	V	50.5	Low	48.2	Very low	85 Å²	85	114.6 Å²	114.6	52%	0.515	60%	0.6	S	S	.	*	H	α-helix	trans	-65.1	-43.1	173.5	172.7	0	0	0	0	110.6	R26 S27 R32 Q33 C34	R26-V30 VanDerWaalsContact O-CG2 3.27Å; R26-V30 WeakPolarHBondContact O-CG2 3.25Å; R26-V30 PolarHBondContact O-N 3.37Å; S27-V30 PolarHBondContact O-N 3.27Å; V30-R32 VanDerWaalsContact C-N 3.35Å; V30-R32 PolarHBondContact O-N 3.41Å; V30-Q33 PolarHBondContact O-N 3.22Å; V30-C34 PolarHBondContact O-N 3.06Å; V30-C34 PolarHBondContact O-SG 3.39Å; V30-C34 VanDerWaalsContact O-SG 3.34Å
31	L	44	Very low	46.9	Very low	104 Å²	104	111.5 Å²	111.5	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-61.8	-40.4	174	-82.2	160.4	0	0	0	112.2	S27 Q28 C34 I35	S27-L31 WeakPolarHBondContact O-CB 3.42Å; S27-L31 WeakPolarHBondContact O-CG 3.07Å; S27-L31 PolarHBondContact O-N 3.48Å; Q28-L31 PolarHBondContact O-N 3.47Å; L31-C34 PolarHBondContact O-N 3.38Å; L31-I35 WeakPolarHBondContact O-CD1 3.44Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.41Å; L31-I35 PolarHBondContact O-N 3.35Å
32	R	44	Very low	45.3	Very low	192 Å²	192	112.1 Å²	112.1	73%	0.725	61%	0.612	S	S	*	*	H	α-helix	trans	-67.9	-34.3	175.1	-76.9	-177.9	-178.6	-167.4	2	112.8	Q28 A29 V30 I35	Q28-R32 WeakPolarHBondContact O-CB 3.42Å; Q28-R32 WeakPolarHBondContact O-CG 3.32Å; Q28-R32 PolarHBondContact O-N 2.88Å; A29-R32 PolarHBondContact O-N 3.36Å; V30-R32 VanDerWaalsContact C-N 3.35Å; V30-R32 PolarHBondContact O-N 3.41Å; R32-I35 PolarHBondContact O-N 3.1Å
33	Q	39.2	Very low	43.6	Very low	161 Å²	161	112.7 Å²	112.7	75%	0.752	62%	0.619	S	S	*	*	H	α-helix	trans	-71.2	-32.3	173.4	-81.9	-173.7	-22.5	0	0	112.5	A29 V30 I35	A29-Q33 PolarHBondContact O-N 3.17Å; V30-Q33 PolarHBondContact O-N 3.22Å; Q33-I35 VanDerWaalsContact C-N 3.31Å; Q33-I35 PolarHBondContact O-N 3.23Å
34	C	33.5	Very low	42.2	Very low	93 Å²	93	114.7 Å²	114.7	63%	0.628	63%	0.627	S	S	*	*	H	α-helix	trans	-75.5	-15.5	175.9	-70.7	0	0	0	0	114	V30 L31	V30-C34 PolarHBondContact O-N 3.06Å; V30-C34 PolarHBondContact O-SG 3.39Å; V30-C34 VanDerWaalsContact O-SG 3.34Å; L31-C34 PolarHBondContact O-N 3.38Å
35	I	30.8	Very low	40.3	Very low	125 Å²	125	116.8 Å²	116.8	64%	0.641	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	16.1	-178.9	-61	166.9	0	0	0	112.1	L31 R32 Q33 T37	L31-I35 WeakPolarHBondContact O-CD1 3.44Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.41Å; L31-I35 PolarHBondContact O-N 3.35Å; R32-I35 PolarHBondContact O-N 3.1Å; Q33-I35 VanDerWaalsContact C-N 3.31Å; Q33-I35 PolarHBondContact O-N 3.23Å; I35-T37 PolarHBondContact O-N 2.83Å
36	V	29	Very low	38.4	Very low	122 Å²	122	116.6 Å²	116.6	74%	0.739	65%	0.645	S	S	*	*			trans	-82.7	61.4	165.1	-164.9	0	0	0	0	109.6
37	T	32.3	Very low	36.8	Very low	112 Å²	112	114.4 Å²	114.4	69%	0.687	65%	0.65	S	S	*	*	S	Bend	trans	-109.6	117.9	161.1	-48	0	0	0	0	106	I35 V39	I35-T37 PolarHBondContact O-N 2.83Å; T37-V39 PolarHBondContact O-N 3.47Å
38	T	27.1	Very low	35.4	Very low	126 Å²	126	119.7 Å²	119.7	77%	0.773	67%	0.669	S	S	*	*			trans	-39.8	95.3	-176.5	-49.4	0	0	0	0	113	V40	T38-V40 HydrophobicContact CG2-CG2 4.16Å; T38-V40 PolarHBondContact O-N 3.27Å
39	V	26.8	Very low	34	Very low	117 Å²	117	119.9 Å²	119.9	71%	0.709	68%	0.68	S	S	*	*			trans	-76.9	106.5	159.6	179.6	0	0	0	0	105.5	T37 V41	T37-V39 PolarHBondContact O-N 3.47Å; V39-V41 VanDerWaalsContact C-N 3.28Å; V39-V41 HydrophobicContact CG1-CG2 4.04Å; V39-V41 PolarHBondContact O-N 2.96Å
40	V	28.8	Very low	33	Very low	115 Å²	115	123.1 Å²	123.1	70%	0.697	70%	0.697	S	S	*	*			trans	-68	96.2	164.6	179.9	0	0	0	0	105.9	T38 C42	T38-V40 HydrophobicContact CG2-CG2 4.16Å; T38-V40 PolarHBondContact O-N 3.27Å; V40-C42 PolarHBondContact O-N 3.38Å; V40-C42 VanDerWaalsContact O-N 3.13Å
41	V	27	Very low	32.1	Very low	120 Å²	120	127.8 Å²	127.8	73%	0.727	71%	0.713	S	S	*	*			trans	-71.5	101.9	168.9	-179.7	0	0	0	0	106.1	V39 D43	V39-V41 VanDerWaalsContact C-N 3.28Å; V39-V41 HydrophobicContact CG1-CG2 4.04Å; V39-V41 PolarHBondContact O-N 2.96Å; V41-D43 PolarHBondContact O-N 2.99Å
42	C	26.3	Very low	31.2	Very low	106 Å²	106	131.7 Å²	131.7	72%	0.716	73%	0.728	S	S	*	*			trans	-67.9	115.9	166.7	-65.3	0	0	0	0	107.7	V40	V40-C42 PolarHBondContact O-N 3.38Å; V40-C42 VanDerWaalsContact O-N 3.13Å
43	D	30.7	Very low	30.4	Very low	122 Å²	122	133.7 Å²	133.7	65%	0.652	74%	0.736	S	S	*	*			trans	-63.4	122.9	176.9	-148.2	-18.1	0	0	0	109.2	V41 D45	V41-D43 PolarHBondContact O-N 2.99Å; D43-D45 PolarHBondContact O-N 3.04Å; D43-D45 VanDerWaalsContact O-N 3.14Å
44	P	34.6	Very low	29.8	Very low	101 Å²	101	134.7 Å²	134.7	66%	0.656	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-9	-172.4	22.2	-31.8	0	0	0	115.2
45	D	32	Very low	29.5	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	3	-177.5	-72.5	-24.4	0	0	0	114.6	D43	D43-D45 PolarHBondContact O-N 3.04Å; D43-D45 VanDerWaalsContact O-N 3.14Å
46	N	28.8	Very low	29.3	Very low	129 Å²	129	138.3 Å²	138.3	69%	0.69	75%	0.75	S	S	*	*			trans	-112.4	44.2	177.2	-135.8	47.6	0	0	0	113.2	E48	N46-E48 VanDerWaalsContact C-N 3.33Å; N46-E48 PolarHBondContact O-N 3.49Å
47	V	31.3	Very low	29.1	Very low	127 Å²	127	141.6 Å²	141.6	77%	0.77	76%	0.758	S	S	*	*			trans	-83.6	80	168.7	-175.6	0	0	0	0	108.3
48	E	28.4	Very low	28.9	Very low	165 Å²	165	145.5 Å²	145.5	77%	0.771	76%	0.761	S	S	*	*			trans	-69.7	132.5	164.7	-78.5	-180	162.1	0	0	109.3	N46	N46-E48 VanDerWaalsContact C-N 3.33Å; N46-E48 PolarHBondContact O-N 3.49Å
49	S	31.5	Very low	28.8	Very low	91 Å²	91	147 Å²	147	64%	0.636	76%	0.763	S	S	*	*			trans	-63.3	150.6	-167.7	48.4	0	0	0	0	114.3	E51	S49-E51 VanDerWaalsContact C-N 3.28Å; S49-E51 PolarHBondContact O-N 3.44Å
50	P	37.1	Very low	28.8	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	16.8	-163.2	-17.1	33.2	0	0	0	118.1
51	E	30.3	Very low	28.7	Very low	182 Å²	182	146.8 Å²	146.8	85%	0.85	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-2.4	-171.2	-74.5	-170.5	163.1	0	0	116.2	S49	S49-E51 VanDerWaalsContact C-N 3.28Å; S49-E51 PolarHBondContact O-N 3.44Å
52	E	26.7	Very low	28.6	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	77%	0.773	S	S	*	*	S	Bend	trans	-109.8	12.6	-175.8	-69.8	-165.1	154.6	0	0	116.9
53	W	25.9	Very low	28.6	Very low	234 Å²	234	153.9 Å²	153.9	89%	0.886	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	20.1	-177.8	-70	62.4	0	0	0	115.1
54	E	27.6	Very low	28.6	Very low	183 Å²	183	153.7 Å²	153.7	86%	0.855	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-3.6	179.4	-112.6	-173	177.8	0	0	115.4
55	N	26.1	Very low	28.1	Very low	152 Å²	152	160.2 Å²	160.2	81%	0.813	80%	0.802	S	S	*	*			trans	-140.1	65.4	-175.3	-79.7	-48.5	0	0	0	114.6
56	Q	26.3	Very low	27.8	Very low	141 Å²	141	164.4 Å²	164.4	66%	0.659	81%	0.807	S	S	*	*			trans	-132.7	98.8	155.7	-68.6	-168.4	6.9	0	0	111.1	Y58	Q56-Y58 VanDerWaalsContact C-N 3.32Å; Q56-Y58 HydrophobicContact CB-CD2 4Å; Q56-Y58 HydrophobicContact CB-CE2 3.73Å; Q56-Y58 PolarHBondContact O-N 2.83Å; Q56-Y58 PolarHBondContact OE1-OH 3.44Å
57	Q	26	Very low	27.6	Very low	191 Å²	191	163 Å²	163	89%	0.893	81%	0.808	S	S	*	*			trans	-64.9	88.4	167.9	-70.9	176.6	-6.4	0	0	109.6	L59	Q57-L59 PolarHBondContact O-N 2.99Å; Q57-L59 VanDerWaalsContact O-N 3.14Å
58	Y	28.2	Very low	27.3	Very low	194 Å²	194	162.2 Å²	162.2	76%	0.761	81%	0.808	S	S	*	*			trans	-75.8	99.7	168.5	-81.3	-84.6	0	0	0	109.7	Q56	Q56-Y58 VanDerWaalsContact C-N 3.32Å; Q56-Y58 HydrophobicContact CB-CD2 4Å; Q56-Y58 HydrophobicContact CB-CE2 3.73Å; Q56-Y58 PolarHBondContact O-N 2.83Å; Q56-Y58 PolarHBondContact OE1-OH 3.44Å
59	L	25.1	Very low	27.2	Very low	157 Å²	157	159 Å²	159	82%	0.822	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-64.7	131.7	168	-74.4	165	0	0	0	109.6	Q57	Q57-L59 PolarHBondContact O-N 2.99Å; Q57-L59 VanDerWaalsContact O-N 3.14Å
60	P	26.3	Very low	26.8	Very low	112 Å²	112	161.8 Å²	161.8	73%	0.727	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.5	150.3	-178.6	27.8	-33.1	0	0	0	111.8
61	P	27.2	Very low	26.2	Very low	117 Å²	117	162.3 Å²	162.3	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.7	149.8	-176.5	27.3	-32.8	0	0	0	111.9	R63	P61-R63 PolarHBondContact O-N 3.37Å
62	P	25.3	Very low	25.7	Very low	129 Å²	129	163.1 Å²	163.1	84%	0.838	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.5	133.2	-171.6	27.5	-32.3	0	0	0	112.1	S64	P62-S64 PolarHBondContact O-N 3.29Å
63	R	26.1	Very low	25.6	Very low	245 Å²	245	160.6 Å²	160.6	93%	0.925	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-58.9	117.1	177	-75.7	177.4	169.9	174.1	-3.5	111.5	P61 R65	P61-R63 PolarHBondContact O-N 3.37Å; R63-R65 PolarHBondContact O-N 3.26Å
64	S	29.7	Very low	25.4	Very low	119 Å²	119	160.5 Å²	160.5	83%	0.832	79%	0.789	S	S	*	*			trans	-66.9	108.8	164.5	177.1	0	0	0	0	109.9	P62	P62-S64 PolarHBondContact O-N 3.29Å
65	R	23.6	Very low	25.1	Very low	237 Å²	237	156.1 Å²	156.1	89%	0.894	78%	0.778	S	S	*	*			trans	-78.3	114.8	163.8	-84.7	177.8	161.8	-178.1	-4.2	108.1	R63	R63-R65 PolarHBondContact O-N 3.26Å
66	R	27.4	Very low	25	Very low	240 Å²	240	153.6 Å²	153.6	91%	0.906	77%	0.773	S	S	*	*			trans	-137.6	118.7	147	-110.2	179.6	-176.2	-174.5	0.8	111.2
67	S	23.3	Very low	24.8	Very low	101 Å²	101	152 Å²	152	71%	0.706	78%	0.777	S	S	*	*			trans	-87.3	165.8	178.4	39.7	0	0	0	0	111.8
68	S	26	Very low	24.9	Very low	110 Å²	110	152.4 Å²	152.4	77%	0.769	78%	0.779	S	S	*	*			trans	72.5	143.8	157.6	73.3	0	0	0	0	117.1
69	S	25.5	Very low	24.6	Very low	97 Å²	97	154.3 Å²	154.3	68%	0.678	79%	0.785	S	S	*	*			cis	174.6	141.7	-24.2	44.7	0	0	0	0	105.5
70	L	24.2	Very low	24.6	Very low	149 Å²	149	153.4 Å²	153.4	78%	0.78	78%	0.781	S	S	*	*			trans	64.2	135	142.5	-75.7	156.3	0	0	0	122.2
71	N	23.8	Very low	24.5	Very low	133 Å²	133	154.8 Å²	154.8	71%	0.711	78%	0.782	S	S	*	*			trans	85.2	118	149.5	-67.2	-22.2	0	0	0	118.1
72	R	20	Very low	24.6	Very low	199 Å²	199	158.3 Å²	158.3	75%	0.751	79%	0.79	S	S	*	*			cis	94.8	122.9	46.9	-162	-169.9	-167.5	-160.7	-0.8	111.1
73	H	23.6	Very low	24.5	Very low	132 Å²	132	159.3 Å²	159.3	61%	0.611	79%	0.789	S	S	*	*			trans	103.7	121.6	155.6	-71.2	-48.9	0	0	0	120.9
74	R	21.5	Very low	24.6	Very low	232 Å²	232	154.2 Å²	154.2	88%	0.875	79%	0.785	S	S	*	*			trans	60	149.6	132.6	-82.8	-175.9	164.8	176.9	-5.6	117.6
75	S	22.1	Very low	24.5	Very low	91 Å²	91	155 Å²	155	64%	0.636	79%	0.787	S	S	*	*			cis	-176.4	162.6	-10.6	45.2	0	0	0	0	105.9
76	S	22.9	Very low	24.6	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	78%	0.782	S	S	*	*			trans	70.9	112.9	150.9	59.8	0	0	0	0	121.3
77	S	24	Very low	24.6	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	78%	0.775	S	S	*	*				71.4	102.8	126.5	67	0	0	0	0	119.9
78	E	27.9	Very low	24.9	Very low	201 Å²	201	145.9 Å²	145.9	94%	0.939	79%	0.786	S	S	*	*			trans	-134.7	121.3	137.9	-74.9	-173.9	145.1	0	0	109.4
79	R	21.4	Very low	24.9	Very low	233 Å²	233	151.5 Å²	151.5	88%	0.879	79%	0.79	S	S	*	*			trans	-84.9	134	161.3	-70.3	173.8	174.5	167	-2.7	106.2
80	D	25.2	Very low	25.1	Very low	138 Å²	138	151.1 Å²	151.1	74%	0.738	79%	0.793	S	S	*	*				163.9	125.7	118.9	-84.9	-25.5	0	0	0	112.3
81	L	23.3	Very low	25.3	Very low	142 Å²	142	148.7 Å²	148.7	74%	0.743	79%	0.789	S	S	*	*			trans	52.7	112.5	135.5	-63.9	158.5	0	0	0	119.5
82	M	29	Very low	25.4	Very low	191 Å²	191	148.4 Å²	148.4	94%	0.941	79%	0.791	S	S	*	*				-163.2	114.5	119.6	-91.6	-109.2	172.1	0	0	110.6
83	N	23	Very low	25.9	Very low	150 Å²	150	143.5 Å²	143.5	80%	0.802	78%	0.783	S	S	*	*			trans	-65.9	131.8	167.4	-80	-30.5	0	0	0	110.5
84	T	28.8	Very low	26.2	Very low	137 Å²	137	144.8 Å²	144.8	84%	0.84	79%	0.794	S	S	*	*			trans	-142.3	137.3	145	39.9	0	0	0	0	109.8
85	P	29	Very low	26.7	Very low	135 Å²	135	140.3 Å²	140.3	88%	0.877	79%	0.788	S	S	*	*			trans	-97.4	144.9	-173.4	36.3	-30.1	0	0	0	111.7
86	G	24.8	Very low	27	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	79%	0.792	S	S	*	*			trans	144.2	93.8	160.3	0	0	0	0	0	114.8
87	S	27.6	Very low	27.4	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	80%	0.799	S	S	*	*			trans	164.8	75.2	135.7	-179.9	0	0	0	0	108.8	R89	S87-R89 PolarHBondContact O-N 2.81Å; S87-R89 VanDerWaalsContact O-N 3.09Å
88	H	30	Very low	27.6	Very low	202 Å²	202	146 Å²	146	94%	0.935	81%	0.808	S	S	*	*			trans	-78.8	91.2	168.4	-72.4	-67.7	0	0	0	108.7
89	R	24.7	Very low	27.7	Very low	227 Å²	227	141.4 Å²	141.4	86%	0.857	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.4	126.6	163.6	-173.6	175	-178.2	173.5	0.4	107.6	S87 S91	S87-R89 PolarHBondContact O-N 2.81Å; S87-R89 VanDerWaalsContact O-N 3.09Å; R89-S91 PolarHBondContact O-N 3.26Å
90	A	29.6	Very low	28.1	Very low	90 Å²	90	136.1 Å²	136.1	74%	0.744	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.6	120.9	177.8	0	0	0	0	0	110
91	S	28.8	Very low	28.5	Very low	98 Å²	98	136 Å²	136	69%	0.685	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-93.3	122.4	176.3	50.3	0	0	0	0	109.6	R89 T93	R89-S91 PolarHBondContact O-N 3.26Å; S91-T93 PolarHBondContact O-N 3.2Å
92	V	25.6	Very low	28.8	Very low	127 Å²	127	134.3 Å²	134.3	77%	0.77	80%	0.8	S	S	*	*			trans	-69.1	112.9	166.9	179.2	0	0	0	0	107.4
93	T	31.6	Very low	28.7	Very low	95 Å²	95	130.5 Å²	130.5	58%	0.583	80%	0.799	S	S	*	*			trans	-109.9	125	174.3	45.1	0	0	0	0	110.1	S91	S91-T93 PolarHBondContact O-N 3.2Å
94	L	29.4	Very low	29	Very low	159 Å²	159	128.5 Å²	128.5	83%	0.832	80%	0.797	S	S	*	*			trans	-79.5	147.5	176.2	-70.1	162.1	0	0	0	111.2
95	N	31.4	Very low	29.1	Very low	139 Å²	139	128.6 Å²	128.6	74%	0.743	80%	0.798	S	S	*	*			trans	-47.5	140.4	-168.7	-76	-27.2	0	0	0	116.5
96	A	29.4	Very low	29.3	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	80%	0.796	S	S	*	*			trans	-118.2	148.5	156.4	0	0	0	0	0	109.3
97	P	30.2	Very low	30	Very low	130 Å²	130	135.1 Å²	135.1	84%	0.844	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.8	144.4	-159.2	-9.5	26.3	0	0	0	114	S99	P97-S99 PolarHBondContact O-N 2.98Å
98	E	29.7	Very low	30.9	Very low	198 Å²	198	134.8 Å²	134.8	93%	0.925	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.4	116.5	177.2	-63.3	-178.1	152	0	0	111.8
99	S	30.3	Very low	31.9	Very low	104 Å²	104	131.9 Å²	131.9	73%	0.727	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-81.1	119.7	168	56.5	0	0	0	0	110.1	P97 V101	P97-S99 PolarHBondContact O-N 2.98Å; S99-V101 PolarHBondContact O-N 3.35Å
100	S	28.1	Very low	33.5	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.2	171.2	43.9	0	0	0	0	111.2
101	V	35.1	Very low	35.3	Very low	136 Å²	136	128.1 Å²	128.1	82%	0.824	76%	0.762	S	S	*	*			trans	-90.6	114.4	175	178.7	0	0	0	0	108.8	S99	S99-V101 PolarHBondContact O-N 3.35Å
102	S	28.4	Very low	37.4	Very low	106 Å²	106	127.8 Å²	127.8	74%	0.741	75%	0.752	S	S	*	*			trans	-69.9	137.7	170.8	40.9	0	0	0	0	111.4	S104	S102-S104 PolarHBondContact O-N 3.03Å
103	A	28.5	Very low	40	Very low	111 Å²	111	127.5 Å²	127.5	92%	0.917	74%	0.74	S	S	*	*			trans	-76.1	109.4	-179.2	0	0	0	0	0	111.6
104	S	27.8	Very low	42.2	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	75%	0.753	S	S	*	*			trans	-113.3	119.4	156.9	55.7	0	0	0	0	109	S102 E106	S102-S104 PolarHBondContact O-N 3.03Å; S104-E106 PolarHBondContact O-N 3.46Å
105	T	32.1	Very low	45	Very low	139 Å²	139	126.6 Å²	126.6	85%	0.853	75%	0.748	S	S	*	*			trans	-59.8	115.3	169.9	11.1	0	0	0	0	111.5
106	E	32.9	Very low	47.6	Very low	179 Å²	179	121.2 Å²	121.2	84%	0.836	72%	0.718	S	S	*	*	S	Bend	trans	160	134.8	142	-86.4	169.7	-175.4	0	0	109.3	S104	S104-E106 PolarHBondContact O-N 3.46Å
107	D	38.8	Very low	50.5	Low	169 Å²	169	120.7 Å²	120.7	90%	0.904	71%	0.714	S	S	*	*			trans	78.9	35.6	177.5	-61.7	-18.4	0	0	0	120.7
108	S	45.8	Very low	53.4	Low	103 Å²	103	117.4 Å²	117.4	72%	0.72	69%	0.692	S	S	*	*			trans	-92.7	108.7	172.2	-61.8	0	0	0	0	112.2
109	N	51.8	Low	56.3	Low	140 Å²	140	113.5 Å²	113.5	75%	0.749	68%	0.677	S	S	*	*			trans	177.6	10.3	142	-94.7	-4.6	0	0	0	118.9	V111	N109-V111 PolarHBondContact O-N 3.47Å
110	Y	58.7	Low	59.3	Low	203 Å²	203	113.8 Å²	113.8	80%	0.796	66%	0.662	S	S	*	*			trans	-81.2	71.4	170.3	-69.5	-78.3	0	0	0	111.7	I112	Y110-I112 PolarHBondContact O-N 2.79Å
111	V	67.9	Low	62.3	Low	35 Å²	35	111.8 Å²	111.8	21%	0.212	64%	0.639	C	S	.	*			trans	-56.7	-35	168.4	177.8	0	0	0	0	110.3	N109 S125 M126 V131	N109-V111 PolarHBondContact O-N 3.47Å; V111-S125 WeakPolarHBondContact CG1-O 3.26Å; V111-S125 WeakPolarHBondContact O-CB 3.34Å; V111-S125 PolarHBondContact O-OG 2.84Å; V111-M126 HydrophobicContact CG1-SD 3.89Å; V111-V131 HydrophobicContact CB-CG2 4.42Å; V111-V131 HydrophobicContact CG2-CG2 3.89Å
112	I	72.1	Confident	65	Low	92 Å²	92	110.5 Å²	110.5	47%	0.472	62%	0.619	S	S	.	*	S	Bend	trans	-97.1	109.6	176	-56.2	172.5	0	0	0	108.4	Y110 M126	Y110-I112 PolarHBondContact O-N 2.79Å; I112-M126 HydrophobicContact CG1-SD 4.2Å
113	K	79.8	Confident	68.1	Low	121 Å²	121	107.5 Å²	107.5	53%	0.526	60%	0.595	S	S	.	*			trans	-100.3	122.2	176.5	-66.4	-178.6	-177.5	176.5	0	109.6	S115 Q116	K113-S115 PolarHBondContact O-N 3.28Å; K113-Q116 HydrophobicContact CB-CG 4.2Å; K113-Q116 WeakPolarHBondContact O-CB 3.42Å; K113-Q116 PolarHBondContact O-N 3.37Å; K113-Q116 PolarHBondContact O-OE1 2.59Å
114	P	78.9	Confident	71.2	Confident	132 Å²	132	104.2 Å²	104.2	86%	0.857	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-20	176.1	-24.4	33.1	0	0	0	114	Q116	P114-Q116 VanDerWaalsContact C-N 3.3Å; P114-Q116 PolarHBondContact O-N 3.21Å
115	S	86.9	Confident	74.2	Confident	103 Å²	103	100.5 Å²	100.5	72%	0.72	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.4	177.8	61.3	0	0	0	0	114.7	K113 A117	K113-S115 PolarHBondContact O-N 3.28Å; S115-A117 PolarHBondContact O-N 3.27Å
116	Q	86.8	Confident	77.2	Confident	25 Å²	25	94.9 Å²	94.9	12%	0.117	51%	0.506	C	S	.	.			trans	-71.3	120.1	178.2	-70.3	167.2	-42.8	0	0	110.3	K113 P114 E121 R122 S125	K113-Q116 HydrophobicContact CB-CG 4.2Å; K113-Q116 WeakPolarHBondContact O-CB 3.42Å; K113-Q116 PolarHBondContact O-N 3.37Å; K113-Q116 PolarHBondContact O-OE1 2.59Å; P114-Q116 VanDerWaalsContact C-N 3.3Å; P114-Q116 PolarHBondContact O-N 3.21Å; Q116-E121 WeakPolarHBondContact CA-OE2 3.49Å; Q116-E121 HydrophobicContact CB-CB 3.91Å; Q116-E121 HydrophobicContact CG-CB 4.06Å; Q116-E121 PolarHBondContact NE2-O 2.77Å; Q116-R122 HydrophobicContact CB-CG 3.73Å; Q116-R122 PolarHBondContact O-NE 2.98Å; Q116-R122 PolarHBondContact O-NH2 3.42Å; Q116-S125 PolarHBondContact NE2-OG 3.42Å; Q116-S125 VanDerWaalsContact NE2-OG 3.08Å
117	A	89.1	Confident	80.1	Confident	77 Å²	77	87.4 Å²	87.4	64%	0.636	47%	0.472	S	S	*	.			trans	-81.6	-41.2	-170.7	0	0	0	0	0	112.1	S115 E121 R122	S115-A117 PolarHBondContact O-N 3.27Å; A117-E121 PolarHBondContact N-OE2 2.97Å; A117-R122 PolarHBondContact O-NH2 3.44Å
118	T	92.2	Very high	82.6	Confident	61 Å²	61	84 Å²	84	37%	0.374	45%	0.447	S	S	.	.	S	Bend	trans	-102.6	154.7	-173.4	64.5	0	0	0	0	112.5	R120 E121 R122	T118-R120 PolarHBondContact O-N 2.89Å; T118-E121 PolarHBondContact O-N 3.39Å; T118-E121 VanDerWaalsContact OG1-CD 3.23Å; T118-E121 VanDerWaalsContact OG1-CG 3.27Å; T118-E121 WeakPolarHBondContact OG1-CG 3.49Å; T118-E121 PolarHBondContact OG1-N 2.78Å; T118-E121 VanDerWaalsContact OG1-N 3.12Å; T118-E121 PolarHBondContact OG1-OE1 3.05Å; T118-R122 WeakPolarHBondContact O-CG 3.26Å; T118-R122 PolarHBondContact O-N 3.11Å
119	L	90.9	Very high	84.8	Confident	117 Å²	117	79.8 Å²	79.8	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-59.7	-36.1	170.9	-178.6	62.2	0	0	0	111	R122 N123	L119-R122 PolarHBondContact O-N 3.25Å; L119-N123 WeakPolarHBondContact O-CB 3.29Å; L119-N123 PolarHBondContact O-N 3.19Å
120	R	92.1	Very high	86.7	Confident	110 Å²	110	78.8 Å²	78.8	42%	0.415	41%	0.412	S	S	.	.	H	α-helix	trans	-55.4	-50.3	174.1	-178.3	-178.8	-64.9	-165.8	-3.3	112.3	T118 R122 N123 A124 T198 D199	T118-R120 PolarHBondContact O-N 2.89Å; R120-R122 VanDerWaalsContact C-N 3.31Å; R120-R122 PolarHBondContact O-N 3.47Å; R120-N123 PolarHBondContact O-N 3.02Å; R120-A124 VanDerWaalsContact O-CB 3.3Å; R120-A124 WeakPolarHBondContact O-CB 3.5Å; R120-A124 PolarHBondContact O-N 3.29Å; R120-T198 WeakPolarHBondContact CD-O 3.36Å; R120-T198 VanDerWaalsContact CG-O 3.29Å; R120-T198 WeakPolarHBondContact CG-O 3.31Å; R120-T198 VanDerWaalsContact CZ-O 3.28Å; R120-T198 PolarHBondContact NE-O 2.95Å; R120-D199 IonicContact CZ-OD2 3.14Å; R120-D199 IonicContact NE-OD2 2.73Å; R120-D199 IonicContact NH2-OD2 2.72Å; R120-D199 PolarHBondContact NH2-OD2 3.12Å
121	E	91.9	Very high	88.3	Confident	79 Å²	79	71.4 Å²	71.4	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-38.8	178.4	-76.4	156.1	-132.8	0	0	112.4	Q116 A117 T118 A124 S125	Q116-E121 WeakPolarHBondContact CA-OE2 3.49Å; Q116-E121 HydrophobicContact CB-CB 3.91Å; Q116-E121 HydrophobicContact CG-CB 4.06Å; Q116-E121 PolarHBondContact NE2-O 2.77Å; A117-E121 PolarHBondContact N-OE2 2.97Å; T118-E121 PolarHBondContact O-N 3.39Å; T118-E121 VanDerWaalsContact OG1-CD 3.23Å; T118-E121 VanDerWaalsContact OG1-CG 3.27Å; T118-E121 WeakPolarHBondContact OG1-CG 3.49Å; T118-E121 PolarHBondContact OG1-N 2.78Å; T118-E121 VanDerWaalsContact OG1-N 3.12Å; T118-E121 PolarHBondContact OG1-OE1 3.05Å; E121-A124 PolarHBondContact O-N 3.12Å; E121-S125 PolarHBondContact O-N 3.24Å
122	R	91.9	Very high	89.4	Confident	110 Å²	110	76.6 Å²	76.6	42%	0.415	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-41.7	177.5	-63.8	174.8	-165.2	134.7	9.1	111.5	Q116 A117 T118 L119 R120 S125 M126	Q116-R122 HydrophobicContact CB-CG 3.73Å; Q116-R122 PolarHBondContact O-NE 2.98Å; Q116-R122 PolarHBondContact O-NH2 3.42Å; A117-R122 PolarHBondContact O-NH2 3.44Å; T118-R122 WeakPolarHBondContact O-CG 3.26Å; T118-R122 PolarHBondContact O-N 3.11Å; L119-R122 PolarHBondContact O-N 3.25Å; R120-R122 VanDerWaalsContact C-N 3.31Å; R120-R122 PolarHBondContact O-N 3.47Å; R122-S125 PolarHBondContact O-N 3.17Å; R122-S125 PolarHBondContact O-OG 3.41Å; R122-M126 WeakPolarHBondContact O-CG 3.46Å; R122-M126 PolarHBondContact O-N 2.94Å
123	N	93.1	Very high	90.4	Very high	43 Å²	43	72.9 Å²	72.9	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-66.8	-38.7	173.9	-73.2	-4.8	0	0	0	111.2	L119 R120 S125 M126 L127 Y197	L119-N123 WeakPolarHBondContact O-CB 3.29Å; L119-N123 PolarHBondContact O-N 3.19Å; R120-N123 PolarHBondContact O-N 3.02Å; N123-S125 PolarHBondContact O-N 2.99Å; N123-M126 WeakPolarHBondContact O-CA 3.5Å; N123-M126 WeakPolarHBondContact O-CB 3.42Å; N123-M126 PolarHBondContact O-N 2.95Å; N123-L127 PolarHBondContact O-N 3.35Å; N123-Y197 HydrophobicContact CB-CD1 4.26Å; N123-Y197 WeakPolarHBondContact CB-O 3.28Å; N123-Y197 VanDerWaalsContact O-CD1 3.29Å; N123-Y197 WeakPolarHBondContact O-CD1 3.31Å
124	A	93.2	Very high	91.1	Very high	42 Å²	42	70.7 Å²	70.7	35%	0.347	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-35.1	177.3	0	0	0	0	0	112.6	R120 E121 M126 L127 T198	R120-A124 VanDerWaalsContact O-CB 3.3Å; R120-A124 WeakPolarHBondContact O-CB 3.5Å; R120-A124 PolarHBondContact O-N 3.29Å; E121-A124 PolarHBondContact O-N 3.12Å; A124-M126 VanDerWaalsContact C-N 3.33Å; A124-L127 WeakPolarHBondContact O-CB 3.47Å; A124-L127 PolarHBondContact O-N 2.9Å; A124-T198 HydrophobicContact CB-CG2 3.65Å
125	S	92	Very high	91.8	Very high	31 Å²	31	64.4 Å²	64.4	22%	0.217	35%	0.348	C	S	.	.	H	α-helix	trans	-75.3	-20.6	174.8	60.1	0	0	0	0	113.9	V111 Q116 E121 R122 N123 L127	V111-S125 WeakPolarHBondContact CG1-O 3.26Å; V111-S125 WeakPolarHBondContact O-CB 3.34Å; V111-S125 PolarHBondContact O-OG 2.84Å; Q116-S125 PolarHBondContact NE2-OG 3.42Å; Q116-S125 VanDerWaalsContact NE2-OG 3.08Å; E121-S125 PolarHBondContact O-N 3.24Å; R122-S125 PolarHBondContact O-N 3.17Å; R122-S125 PolarHBondContact O-OG 3.41Å; N123-S125 PolarHBondContact O-N 2.99Å; S125-L127 VanDerWaalsContact C-N 3.35Å
126	M	93.8	Very high	92.3	Very high	21 Å²	21	62.4 Å²	62.4	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-80.7	-16.1	172.9	-58.8	-55.8	-61.1	0	0	112.9	V111 I112 R122 N123 A124 Y128 S129 V131 M132 H154 Y197	V111-M126 HydrophobicContact CG1-SD 3.89Å; I112-M126 HydrophobicContact CG1-SD 4.2Å; R122-M126 WeakPolarHBondContact O-CG 3.46Å; R122-M126 PolarHBondContact O-N 2.94Å; N123-M126 WeakPolarHBondContact O-CA 3.5Å; N123-M126 WeakPolarHBondContact O-CB 3.42Å; N123-M126 PolarHBondContact O-N 2.95Å; A124-M126 VanDerWaalsContact C-N 3.33Å; M126-Y128 PolarHBondContact O-N 2.92Å; M126-S129 PolarHBondContact O-N 3.42Å; M126-S129 VanDerWaalsContact O-N 3.12Å; M126-V131 HydrophobicContact CE-CB 4.1Å; M126-V131 HydrophobicContact CE-CG1 4.1Å; M126-V131 WeakPolarHBondContact CE-O 3.41Å; M126-M132 HydrophobicContact CE-CB 4.13Å; M126-H154 WeakPolarHBondContact CE-NE2 3.41Å; M126-H154 PolarHBondContact O-CE1 2.84Å; M126-Y197 HydrophobicContact CB-CD1 4.43Å; M126-Y197 HydrophobicContact CB-CE1 4.16Å
127	L	93.5	Very high	92.7	Very high	22 Å²	22	61.2 Å²	61.2	12%	0.115	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	124.6	176.7	-177.5	66.8	0	0	0	110.1	N123 A124 S125 S129 L193 R194 Y197	N123-L127 PolarHBondContact O-N 3.35Å; A124-L127 WeakPolarHBondContact O-CB 3.47Å; A124-L127 PolarHBondContact O-N 2.9Å; S125-L127 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 2.81Å; L127-S129 VanDerWaalsContact O-N 3.13Å; L127-L193 HydrophobicContact CD1-CB 3.86Å; L127-R194 HydrophobicContact CD2-CB 3.96Å; L127-R194 HydrophobicContact CD2-CG 4.05Å; L127-Y197 HydrophobicContact CB-CD1 4.42Å; L127-Y197 HydrophobicContact CB-CG 4.38Å; L127-Y197 HydrophobicContact CD1-CD2 3.89Å; L127-Y197 HydrophobicContact CD1-CE2 4.3Å; L127-Y197 HydrophobicContact CD1-CG 4.07Å
128	Y	92.1	Very high	93	Very high	97 Å²	97	58.3 Å²	58.3	38%	0.38	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	4	-175.4	-42.1	-46	0	0	0	115.9	M126 I151 P152 K190 L193	M126-Y128 PolarHBondContact O-N 2.92Å; Y128-I151 HydrophobicContact CD1-CG2 4.03Å; Y128-I151 HydrophobicContact CE1-CG2 4.4Å; Y128-P152 WeakPolarHBondContact O-CG 3.34Å; Y128-K190 HydrophobicContact CE1-CB 4.31Å; Y128-K190 HydrophobicContact CE1-CG 3.81Å; Y128-K190 WeakPolarHBondContact OH-CA 3.4Å; Y128-K190 WeakPolarHBondContact OH-CB 3.41Å; Y128-K190 PolarHBondContact OH-O 3.29Å; Y128-K190 VanDerWaalsContact OH-O 3.12Å; Y128-L193 HydrophobicContact CE1-CD1 4.24Å
129	S	91.8	Very high	93.1	Very high	15 Å²	15	55.4 Å²	55.4	11%	0.105	28%	0.276	C	S	.	.			trans	-79.6	142.8	171.4	-172	0	0	0	0	110.5	M126 L127 V131	M126-S129 PolarHBondContact O-N 3.42Å; M126-S129 VanDerWaalsContact O-N 3.12Å; L127-S129 PolarHBondContact O-N 2.81Å; L127-S129 VanDerWaalsContact O-N 3.13Å; S129-V131 VanDerWaalsContact C-N 3.34Å; S129-V131 WeakPolarHBondContact OG-CB 3.42Å; S129-V131 WeakPolarHBondContact OG-CG2 3.4Å; S129-V131 PolarHBondContact OG-N 3.42Å
130	D	92.1	Very high	93.2	Very high	118 Å²	118	49.9 Å²	49.9	63%	0.631	25%	0.247	S	C	*	.			trans	-82.5	-13.5	170.4	62.9	-22.3	0	0	0	112.8	M132 A133	D130-M132 PolarHBondContact O-N 3.34Å; D130-A133 WeakPolarHBondContact O-CB 3.48Å; D130-A133 PolarHBondContact O-N 3.42Å
131	V	91.7	Very high	93	Very high	49 Å²	49	47.5 Å²	47.5	30%	0.297	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	123	175.4	177.7	0	0	0	0	108.6	V111 M126 S129 A133 H154	V111-V131 HydrophobicContact CB-CG2 4.42Å; V111-V131 HydrophobicContact CG2-CG2 3.89Å; M126-V131 HydrophobicContact CE-CB 4.1Å; M126-V131 HydrophobicContact CE-CG1 4.1Å; M126-V131 WeakPolarHBondContact CE-O 3.41Å; S129-V131 VanDerWaalsContact C-N 3.34Å; S129-V131 WeakPolarHBondContact OG-CB 3.42Å; S129-V131 WeakPolarHBondContact OG-CG2 3.4Å; S129-V131 PolarHBondContact OG-N 3.42Å; V131-A133 PolarHBondContact O-N 3.25Å; V131-H154 PolarHBondContact O-NE2 2.83Å
132	M	91.1	Very high	92.4	Very high	144 Å²	144	52.1 Å²	52.1	71%	0.709	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	7.4	-179.1	-58.9	172.1	61.9	0	0	115.8	M126 D130 D134 H154	M126-M132 HydrophobicContact CE-CB 4.13Å; D130-M132 PolarHBondContact O-N 3.34Å; M132-D134 PolarHBondContact O-N 2.96Å; M132-H154 PolarHBondContact O-CD2 2.85Å
133	A	93.3	Very high	91.6	Very high	14 Å²	14	51.9 Å²	51.9	12%	0.116	28%	0.279	C	S	.	.			trans	-63.9	128.6	174.7	0	0	0	0	0	110	D130 V131 W136 P152 A153 H154	D130-A133 WeakPolarHBondContact O-CB 3.48Å; D130-A133 PolarHBondContact O-N 3.42Å; V131-A133 PolarHBondContact O-N 3.25Å; A133-W136 HydrophobicContact CB-CZ2 4.35Å; A133-W136 WeakPolarHBondContact O-CH2 3.45Å; A133-P152 HydrophobicContact CB-CB 3.8Å; A133-A153 WeakPolarHBondContact CA-O 3.4Å; A133-H154 PolarHBondContact N-NE2 2.81Å
134	D	94.3	Very high	90.5	Very high	74 Å²	74	51.1 Å²	51.1	40%	0.396	28%	0.277	S	S	.	.			trans	-115.1	2.5	-178.1	61.7	-9	0	0	0	112.5	M132 A153 H154 T155	M132-D134 PolarHBondContact O-N 2.96Å; D134-A153 PolarHBondContact N-O 3.49Å; D134-H154 VanDerWaalsContact OD1-CA 3.25Å; D134-H154 WeakPolarHBondContact OD1-CA 3.5Å; D134-T155 WeakPolarHBondContact OD1-CG2 3.47Å; D134-T155 PolarHBondContact OD1-N 2.97Å; D134-T155 WeakPolarHBondContact OD2-CB 3.49Å; D134-T155 PolarHBondContact OD2-OG1 3.2Å
135	V	94.9	Very high	89.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	148.6	174.7	64.7	0	0	0	0	111.7	F137 A153 T155 L158 F169 T177 I179	V135-F137 HydrophobicContact CG1-CE2 3.94Å; V135-F137 HydrophobicContact CG2-CE2 4.17Å; V135-F137 HydrophobicContact CG2-CZ 4.44Å; V135-A153 HydrophobicContact CG1-CB 4.06Å; V135-A153 WeakPolarHBondContact CG1-O 3.29Å; V135-A153 PolarHBondContact N-O 3.08Å; V135-A153 PolarHBondContact O-N 2.92Å; V135-T155 HydrophobicContact CB-CG2 4Å; V135-T155 HydrophobicContact CG1-CG2 3.85Å; V135-L158 HydrophobicContact CG1-CD1 4.29Å; V135-F169 HydrophobicContact CB-CE1 4.4Å; V135-F169 HydrophobicContact CG1-CZ 4.26Å; V135-F169 HydrophobicContact CG2-CE1 3.89Å; V135-F169 HydrophobicContact CG2-CZ 4.03Å; V135-T177 CarbonylContact C-O 3.58Å; V135-I179 HydrophobicContact CG2-CD1 3.7Å; V135-I179 HydrophobicContact CG2-CG1 4.22Å
136	W	95.9	Very high	88.4	Confident	60 Å²	60	59.7 Å²	59.7	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.7	174.6	-69.3	-95.9	0	0	0	110.3	A133 R150 I151 T177 E178 I179	A133-W136 HydrophobicContact CB-CZ2 4.35Å; A133-W136 WeakPolarHBondContact O-CH2 3.45Å; W136-R150 HydrophobicContact CB-CG 4.45Å; W136-R150 VanDerWaalsContact CG-NH2 3.31Å; W136-I151 WeakPolarHBondContact CA-O 3.44Å; W136-T177 PolarHBondContact N-O 3.19Å; W136-E178 CarbonylContact O-C 3.53Å; W136-E178 WeakPolarHBondContact O-CA 3.43Å; W136-I179 PolarHBondContact O-N 3.5Å
137	F	95.8	Very high	88	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.8	172.9	-68.1	-89.9	0	0	0	110.1	V135 V139 R150 I151 A153 L158 F165 F169 I179 V181 F189	V135-F137 HydrophobicContact CG1-CE2 3.94Å; V135-F137 HydrophobicContact CG2-CE2 4.17Å; V135-F137 HydrophobicContact CG2-CZ 4.44Å; F137-V139 HydrophobicContact CB-CG2 3.78Å; F137-R150 CarbonylContact O-C 3.56Å; F137-R150 VanDerWaalsContact O-CA 3.31Å; F137-R150 WeakPolarHBondContact O-CA 3.44Å; F137-I151 PolarHBondContact N-O 3.39Å; F137-I151 PolarHBondContact O-N 2.79Å; F137-A153 HydrophobicContact CD2-CB 4.1Å; F137-A153 HydrophobicContact CE2-CB 3.95Å; F137-L158 HydrophobicContact CE2-CD1 3.54Å; F137-L158 HydrophobicContact CZ-CD1 3.78Å; F137-F165 AromaticContact CE1-CE1 3.86Å; F137-F165 HydrophobicContact CE1-CE1 3.86Å; F137-F165 HydrophobicContact CE1-CZ 4.43Å; F137-F165 HydrophobicContact CZ-CD1 4.37Å; F137-F165 AromaticContact CZ-CE1 3.69Å; F137-F165 HydrophobicContact CZ-CE1 3.69Å; F137-F165 HydrophobicContact CZ-CZ 4.21Å; F137-F169 HydrophobicContact CZ-CZ 4Å; F137-I179 CarbonylContact C-O 3.54Å; F137-I179 VanDerWaalsContact CA-O 3.31Å; F137-I179 WeakPolarHBondContact CA-O 3.27Å; F137-I179 HydrophobicContact CD1-CB 3.77Å; F137-I179 HydrophobicContact CD1-CD1 4.41Å; F137-I179 HydrophobicContact CD1-CG2 3.84Å; F137-I179 HydrophobicContact CE1-CB 3.89Å; F137-I179 HydrophobicContact CE1-CD1 3.71Å; F137-I179 HydrophobicContact CE1-CG1 4.41Å; F137-I179 HydrophobicContact CE1-CG2 3.82Å; F137-I179 HydrophobicContact CZ-CD1 3.94Å; F137-V181 HydrophobicContact CD1-CG2 3.72Å; F137-V181 HydrophobicContact CE1-CG2 4.46Å; F137-F189 HydrophobicContact CB-CE1 3.87Å; F137-F189 HydrophobicContact CB-CZ 3.99Å; F137-F189 HydrophobicContact CD1-CE1 4.37Å; F137-F189 HydrophobicContact CD1-CE2 4.36Å; F137-F189 AromaticContact CD1-CZ 3.64Å; F137-F189 HydrophobicContact CD1-CZ 3.64Å; F137-F189 HydrophobicContact CD2-CE1 4.01Å; F137-F189 AromaticContact CD2-CZ 3.86Å; F137-F189 HydrophobicContact CD2-CZ 3.86Å; F137-F189 HydrophobicContact CE1-CZ 4Å; F137-F189 HydrophobicContact CE2-CZ 4.22Å; F137-F189 AromaticContact CG-CE1 3.83Å; F137-F189 HydrophobicContact CG-CE1 3.83Å; F137-F189 AromaticContact CG-CZ 3.54Å; F137-F189 HydrophobicContact CG-CZ 3.54Å; F137-F189 HydrophobicContact CZ-CZ 4.27Å
138	V	95.1	Very high	87.8	Confident	17 Å²	17	63.4 Å²	63.4	10%	0.103	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	100.1	168.8	-177.3	0	0	0	0	106.9	Q148 R150 E178 I179 L180 V181	V138-Q148 HydrophobicContact CG1-CB 4.03Å; V138-Q148 HydrophobicContact CG1-CG 4.49Å; V138-R150 HydrophobicContact CG2-CG 4.36Å; V138-E178 HydrophobicContact CG2-CG 3.81Å; V138-I179 PolarHBondContact N-O 3.09Å; V138-L180 HydrophobicContact CB-CD2 3.69Å; V138-L180 HydrophobicContact CG1-CD2 4.23Å; V138-L180 HydrophobicContact CG2-CD2 3.96Å; V138-V181 PolarHBondContact O-N 2.66Å
139	V	95.4	Very high	87.9	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.5	-170.4	-172.9	0	0	0	0	110.6	F137 Q148 K149 I151 V181 V184 P186 F189	F137-V139 HydrophobicContact CB-CG2 3.78Å; V139-Q148 WeakPolarHBondContact O-CA 2.91Å; V139-K149 PolarHBondContact N-O 3.26Å; V139-K149 PolarHBondContact O-N 3.43Å; V139-I151 HydrophobicContact CB-CD1 4.4Å; V139-I151 HydrophobicContact CG2-CD1 4.03Å; V139-V181 WeakPolarHBondContact CA-O 3.47Å; V139-V181 HydrophobicContact CG2-CB 4.34Å; V139-V184 HydrophobicContact CG1-CB 4.13Å; V139-V184 HydrophobicContact CG1-CG1 3.96Å; V139-V184 VanDerWaalsContact CG1-O 3.27Å; V139-V184 WeakPolarHBondContact CG1-O 3.44Å; V139-P186 HydrophobicContact CG1-CB 4.46Å; V139-P186 HydrophobicContact CG1-CG 4.38Å; V139-F189 HydrophobicContact CG1-CB 3.87Å; V139-F189 HydrophobicContact CG1-CG 4.19Å; V139-F189 HydrophobicContact CG2-CB 4.35Å; V139-F189 HydrophobicContact CG2-CD1 3.68Å; V139-F189 HydrophobicContact CG2-CD2 4.33Å; V139-F189 HydrophobicContact CG2-CE1 3.95Å; V139-F189 HydrophobicContact CG2-CG 3.87Å; V139-F189 HydrophobicContact CG2-CZ 4.42Å
140	G	92.3	Very high	88	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	91.5	172.4	-179.3	0	0	0	0	0	113.2	Q148 V181 P182 V184	G140-Q148 WeakPolarHBondContact O-CG 3.42Å; G140-Q148 PolarHBondContact O-NE2 2.94Å; G140-V181 PolarHBondContact N-O 2.71Å; G140-P182 WeakPolarHBondContact O-CA 3.47Å; G140-V184 VanDerWaalsContact CA-O 3.3Å; G140-V184 WeakPolarHBondContact CA-O 3.46Å; G140-V184 PolarHBondContact N-O 2.94Å
141	N	88	Confident	88.2	Confident	60 Å²	60	63.4 Å²	63.4	32%	0.321	34%	0.343	S	S	.	.			trans	-110.6	168.2	174.7	60.1	32.4	0	0	0	110.6	S143 S144	N141-S143 PolarHBondContact ND2-OG 3.35Å; N141-S143 PolarHBondContact O-N 2.89Å; N141-S143 PolarHBondContact OD1-N 3.23Å; N141-S143 PolarHBondContact OD1-OG 3.45Å; N141-S144 PolarHBondContact N-OG 3.36Å; N141-S144 VanDerWaalsContact N-OG 3.09Å; N141-S144 VanDerWaalsContact O-CB 3.3Å; N141-S144 WeakPolarHBondContact O-CB 3.48Å; N141-S144 PolarHBondContact O-N 3.34Å; N141-S144 PolarHBondContact O-OG 3.12Å; N141-S144 PolarHBondContact OD1-N 2.91Å; N141-S144 PolarHBondContact OD1-OG 2.9Å
142	E	78.5	Confident	88.4	Confident	177 Å²	177	62 Å²	62	83%	0.827	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.1	179.6	-64	-172.8	166.3	0	0	112.9
143	S	75.7	Confident	88.7	Confident	104 Å²	104	55.1 Å²	55.1	73%	0.727	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.6	176.2	47.5	0	0	0	0	114.8	N141	N141-S143 PolarHBondContact ND2-OG 3.35Å; N141-S143 PolarHBondContact O-N 2.89Å; N141-S143 PolarHBondContact OD1-N 3.23Å; N141-S143 PolarHBondContact OD1-OG 3.45Å
144	S	70.4	Confident	88.8	Confident	27 Å²	27	55.4 Å²	55.4	19%	0.189	30%	0.3	C	S	.	.	S	Bend	trans	-68.4	145.6	-177.3	-63.5	0	0	0	0	110.4	N141 G146 G147	N141-S144 PolarHBondContact N-OG 3.36Å; N141-S144 VanDerWaalsContact N-OG 3.09Å; N141-S144 VanDerWaalsContact O-CB 3.3Å; N141-S144 WeakPolarHBondContact O-CB 3.48Å; N141-S144 PolarHBondContact O-N 3.34Å; N141-S144 PolarHBondContact O-OG 3.12Å; N141-S144 PolarHBondContact OD1-N 2.91Å; N141-S144 PolarHBondContact OD1-OG 2.9Å; S144-G146 PolarHBondContact O-N 2.92Å; S144-G147 PolarHBondContact O-N 3Å
145	L	69.2	Low	88.8	Confident	185 Å²	185	52.8 Å²	52.8	97%	0.969	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	109	174.3	-126.1	108.4	0	0	0	109.3
146	G	72.2	Confident	88.8	Confident	68 Å²	68	60.8 Å²	60.8	70%	0.701	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	5.9	-174.8	0	0	0	0	0	115.9	S144	S144-G146 PolarHBondContact O-N 2.92Å
147	G	83.9	Confident	88.8	Confident	22 Å²	22	58.7 Å²	58.7	23%	0.227	31%	0.311	C	S	.	.			trans	68.4	-171.5	174.1	0	0	0	0	0	114.8	S144	S144-G147 PolarHBondContact O-N 3Å
148	Q	90.5	Very high	88.9	Confident	99 Å²	99	58.7 Å²	58.7	46%	0.463	31%	0.311	S	S	.	.			trans	-67.9	134.3	176.2	-62.6	-167.5	-34.3	0	0	111	V138 V139 G140	V138-Q148 HydrophobicContact CG1-CB 4.03Å; V138-Q148 HydrophobicContact CG1-CG 4.49Å; V139-Q148 WeakPolarHBondContact O-CA 2.91Å; G140-Q148 WeakPolarHBondContact O-CG 3.42Å; G140-Q148 PolarHBondContact O-NE2 2.94Å
149	K	93.2	Very high	88.9	Confident	75 Å²	75	58.4 Å²	58.4	33%	0.326	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.1	175.6	-62.7	-168.4	-172.1	170.1	0	110.3	V139 I151 P186	V139-K149 PolarHBondContact N-O 3.26Å; V139-K149 PolarHBondContact O-N 3.43Å; K149-I151 HydrophobicContact CB-CG1 4.32Å; K149-P186 HydrophobicContact CB-CB 4.14Å; K149-P186 HydrophobicContact CB-CG 4.36Å; K149-P186 HydrophobicContact CD-CB 3.72Å; K149-P186 HydrophobicContact CD-CG 4.26Å; K149-P186 HydrophobicContact CG-CB 4.02Å; K149-P186 HydrophobicContact CG-CG 4.12Å
150	R	94.6	Very high	88.9	Confident	147 Å²	147	62.9 Å²	62.9	56%	0.555	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.5	173.2	-169.4	172.8	-177.8	-96.4	-3.2	109.4	W136 F137 V138 E178	W136-R150 HydrophobicContact CB-CG 4.45Å; W136-R150 VanDerWaalsContact CG-NH2 3.31Å; F137-R150 CarbonylContact O-C 3.56Å; F137-R150 VanDerWaalsContact O-CA 3.31Å; F137-R150 WeakPolarHBondContact O-CA 3.44Å; V138-R150 HydrophobicContact CG2-CG 4.36Å; R150-E178 IonicContact CZ-OE1 3.05Å; R150-E178 IonicContact NE-OE1 2.65Å; R150-E178 PolarHBondContact NE-OE1 2.97Å; R150-E178 IonicContact NH2-OE1 2.76Å
151	I	96.2	Very high	89	Confident	8 Å²	8	64.5 Å²	64.5	4%	0.041	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.7	-171	-56.1	175.7	0	0	0	109.2	Y128 W136 F137 V139 K149 F189 K190 L193	Y128-I151 HydrophobicContact CD1-CG2 4.03Å; Y128-I151 HydrophobicContact CE1-CG2 4.4Å; W136-I151 WeakPolarHBondContact CA-O 3.44Å; F137-I151 PolarHBondContact N-O 3.39Å; F137-I151 PolarHBondContact O-N 2.79Å; V139-I151 HydrophobicContact CB-CD1 4.4Å; V139-I151 HydrophobicContact CG2-CD1 4.03Å; K149-I151 HydrophobicContact CB-CG1 4.32Å; I151-F189 HydrophobicContact CD1-CD1 3.99Å; I151-K190 HydrophobicContact CD1-CG 4.14Å; I151-L193 HydrophobicContact CG2-CD1 3.64Å
152	P	96.6	Very high	89.5	Confident	19 Å²	19	61.8 Å²	61.8	12%	0.123	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	147	174.4	31.9	-34.3	0	0	0	111.3	Y128 A133	Y128-P152 WeakPolarHBondContact O-CG 3.34Å; A133-P152 HydrophobicContact CB-CB 3.8Å
153	A	96.4	Very high	90.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	178.8	175.4	0	0	0	0	0	112.4	A133 D134 V135 F137 L158 Y197	A133-A153 WeakPolarHBondContact CA-O 3.4Å; D134-A153 PolarHBondContact N-O 3.49Å; V135-A153 HydrophobicContact CG1-CB 4.06Å; V135-A153 WeakPolarHBondContact CG1-O 3.29Å; V135-A153 PolarHBondContact N-O 3.08Å; V135-A153 PolarHBondContact O-N 2.92Å; F137-A153 HydrophobicContact CD2-CB 4.1Å; F137-A153 HydrophobicContact CE2-CB 3.95Å; A153-L158 HydrophobicContact CB-CD1 3.9Å; A153-Y197 WeakPolarHBondContact CA-OH 3.32Å
154	H	96	Very high	91.3	Very high	20 Å²	20	54.8 Å²	54.8	9%	0.093	31%	0.306	C	S	.	.			trans	-126.1	112.7	-171.2	-57.9	83.6	0	0	0	110.5	M126 V131 M132 A133 D134 Y156 V157 L158 Y197	M126-H154 WeakPolarHBondContact CE-NE2 3.41Å; M126-H154 PolarHBondContact O-CE1 2.84Å; V131-H154 PolarHBondContact O-NE2 2.83Å; M132-H154 PolarHBondContact O-CD2 2.85Å; A133-H154 PolarHBondContact N-NE2 2.81Å; D134-H154 VanDerWaalsContact OD1-CA 3.25Å; D134-H154 WeakPolarHBondContact OD1-CA 3.5Å; H154-Y156 VanDerWaalsContact C-N 3.27Å; H154-Y156 PolarHBondContact O-N 3.04Å; H154-Y156 VanDerWaalsContact O-N 3.17Å; H154-V157 HydrophobicContact CB-CB 4.39Å; H154-V157 HydrophobicContact CB-CG2 4.08Å; H154-V157 PolarHBondContact O-N 2.86Å; H154-V157 VanDerWaalsContact O-N 3.1Å; H154-L158 WeakPolarHBondContact O-CG 3.44Å; H154-L158 PolarHBondContact O-N 3.36Å; H154-L158 VanDerWaalsContact O-N 3.17Å; H154-Y197 WeakPolarHBondContact CB-OH 3.24Å; H154-Y197 PolarHBondContact N-OH 2.95Å; H154-Y197 AromaticContact ND1-CE1 3.55Å; H154-Y197 AromaticContact ND1-CZ 3.56Å; H154-Y197 PolarHBondContact ND1-OH 3.38Å
155	T	94.9	Very high	92.5	Very high	20 Å²	20	53.5 Å²	53.5	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-37.6	-171.1	61.8	0	0	0	0	113.3	D134 V135 L158 A159 F169	D134-T155 WeakPolarHBondContact OD1-CG2 3.47Å; D134-T155 PolarHBondContact OD1-N 2.97Å; D134-T155 WeakPolarHBondContact OD2-CB 3.49Å; D134-T155 PolarHBondContact OD2-OG1 3.2Å; V135-T155 HydrophobicContact CB-CG2 4Å; V135-T155 HydrophobicContact CG1-CG2 3.85Å; T155-L158 PolarHBondContact O-N 3.37Å; T155-A159 WeakPolarHBondContact O-CB 3.11Å; T155-A159 PolarHBondContact O-N 3.01Å; T155-F169 HydrophobicContact CG2-CB 4.33Å; T155-F169 HydrophobicContact CG2-CD1 3.62Å; T155-F169 HydrophobicContact CG2-CD2 3.93Å; T155-F169 HydrophobicContact CG2-CE1 3.8Å; T155-F169 HydrophobicContact CG2-CE2 4.13Å; T155-F169 HydrophobicContact CG2-CG 3.7Å; T155-F169 HydrophobicContact CG2-CZ 4.07Å
156	Y	94.7	Very high	93.7	Very high	169 Å²	169	51.4 Å²	51.4	66%	0.663	28%	0.277	S	S	*	.	H	α-helix	trans	-61	-50.4	177.1	174.6	-100.9	0	0	0	112	H154 L158 A159 T160	H154-Y156 VanDerWaalsContact C-N 3.27Å; H154-Y156 PolarHBondContact O-N 3.04Å; H154-Y156 VanDerWaalsContact O-N 3.17Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.37Å; Y156-A159 PolarHBondContact O-N 2.98Å; Y156-T160 HydrophobicContact CD2-CG2 4.32Å; Y156-T160 HydrophobicContact CE1-CG2 4.26Å; Y156-T160 HydrophobicContact CE2-CG2 3.94Å; Y156-T160 WeakPolarHBondContact O-CG2 3.48Å; Y156-T160 PolarHBondContact O-N 3Å; Y156-T160 PolarHBondContact O-OG1 2.97Å
157	V	96	Very high	94.7	Very high	15 Å²	15	50.1 Å²	50.1	9%	0.091	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-47.3	-179.8	179	0	0	0	0	109.7	H154 T160 G161 L196 Y197	H154-V157 HydrophobicContact CB-CB 4.39Å; H154-V157 HydrophobicContact CB-CG2 4.08Å; H154-V157 PolarHBondContact O-N 2.86Å; H154-V157 VanDerWaalsContact O-N 3.1Å; V157-T160 PolarHBondContact O-N 3.11Å; V157-T160 PolarHBondContact O-OG1 2.85Å; V157-G161 PolarHBondContact O-N 2.97Å; V157-L196 WeakPolarHBondContact CG1-O 3.29Å; V157-Y197 HydrophobicContact CB-CE1 4.35Å; V157-Y197 HydrophobicContact CB-CE2 4.38Å; V157-Y197 HydrophobicContact CG1-CD1 4.08Å; V157-Y197 HydrophobicContact CG1-CD2 3.78Å; V157-Y197 HydrophobicContact CG1-CE1 4.13Å; V157-Y197 HydrophobicContact CG1-CE2 3.84Å; V157-Y197 HydrophobicContact CG1-CG 3.95Å; V157-Y197 HydrophobicContact CG2-CE1 4.16Å
158	L	96.6	Very high	95.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-46.5	179.7	-59.7	-177.8	0	0	0	112.8	V135 F137 A153 H154 T155 Y156 T160 G161 S162 F165 F169 L193 L196 Y197	V135-L158 HydrophobicContact CG1-CD1 4.29Å; F137-L158 HydrophobicContact CE2-CD1 3.54Å; F137-L158 HydrophobicContact CZ-CD1 3.78Å; A153-L158 HydrophobicContact CB-CD1 3.9Å; H154-L158 WeakPolarHBondContact O-CG 3.44Å; H154-L158 PolarHBondContact O-N 3.36Å; H154-L158 VanDerWaalsContact O-N 3.17Å; T155-L158 PolarHBondContact O-N 3.37Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.37Å; L158-T160 VanDerWaalsContact C-N 3.29Å; L158-T160 PolarHBondContact O-N 3.22Å; L158-G161 PolarHBondContact O-N 3.27Å; L158-S162 PolarHBondContact O-N 3.49Å; L158-F165 HydrophobicContact CB-CB 3.91Å; L158-F165 HydrophobicContact CB-CD2 3.65Å; L158-F165 HydrophobicContact CB-CE2 4.33Å; L158-F165 HydrophobicContact CB-CG 3.83Å; L158-F165 HydrophobicContact CD2-CD2 4.38Å; L158-F165 HydrophobicContact CD2-CE2 4.26Å; L158-F165 HydrophobicContact CG-CD2 4.39Å; L158-F169 HydrophobicContact CB-CE2 4.32Å; L158-F169 HydrophobicContact CD1-CE2 4.03Å; L158-F169 HydrophobicContact CD1-CZ 4.4Å; L158-L193 HydrophobicContact CD2-CD2 3.44Å; L158-L193 VanDerWaalsContact CD2-CD2 3.44Å; L158-L196 HydrophobicContact CD2-CD1 3.69Å; L158-Y197 HydrophobicContact CD2-CE2 4.35Å
159	A	95.8	Very high	95.2	Very high	12 Å²	12	48.5 Å²	48.5	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-29.1	-178.4	0	0	0	0	0	113	T155 Y156 G161 Y166 F170	T155-A159 WeakPolarHBondContact O-CB 3.11Å; T155-A159 PolarHBondContact O-N 3.01Å; Y156-A159 PolarHBondContact O-N 2.98Å; A159-G161 VanDerWaalsContact C-N 3.34Å; A159-Y166 HydrophobicContact CB-CD2 4.3Å; A159-F170 HydrophobicContact CB-CD2 3.81Å; A159-F170 HydrophobicContact CB-CE2 3.53Å
160	T	95.7	Very high	95.1	Very high	94 Å²	94	50 Å²	50	58%	0.577	25%	0.253	S	S	*	.	H	α-helix	trans	-71.3	-28.1	175.6	57.3	0	0	0	0	113.5	Y156 V157 L158	Y156-T160 HydrophobicContact CD2-CG2 4.32Å; Y156-T160 HydrophobicContact CE1-CG2 4.26Å; Y156-T160 HydrophobicContact CE2-CG2 3.94Å; Y156-T160 WeakPolarHBondContact O-CG2 3.48Å; Y156-T160 PolarHBondContact O-N 3Å; Y156-T160 PolarHBondContact O-OG1 2.97Å; V157-T160 PolarHBondContact O-N 3.11Å; V157-T160 PolarHBondContact O-OG1 2.85Å; L158-T160 VanDerWaalsContact C-N 3.29Å; L158-T160 PolarHBondContact O-N 3.22Å
161	G	94.9	Very high	94.8	Very high	33 Å²	33	45.3 Å²	45.3	34%	0.34	25%	0.251	S	S	.	.	H	α-helix	trans	-103.9	-4.8	-178.6	0	0	0	0	0	115.3	V157 L158 A159	V157-G161 PolarHBondContact O-N 2.97Å; L158-G161 PolarHBondContact O-N 3.27Å; A159-G161 VanDerWaalsContact C-N 3.34Å
162	S	97.3	Very high	93.9	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.021	29%	0.286	C	S	.	.			trans	-146.4	123.9	-179.5	170.1	0	0	0	0	111.4	L158 V164 F165 Y166 Y218	L158-S162 PolarHBondContact O-N 3.49Å; S162-V164 PolarHBondContact O-N 3.08Å; S162-V164 PolarHBondContact OG-N 2.81Å; S162-F165 VanDerWaalsContact CB-CD2 3.45Å; S162-F165 PolarHBondContact O-N 3.28Å; S162-F165 PolarHBondContact OG-N 3.23Å; S162-Y166 PolarHBondContact O-N 3.35Å; S162-Y218 WeakPolarHBondContact CB-O 3.3Å; S162-Y218 PolarHBondContact OG-O 3Å
163	T	96.3	Very high	92.6	Very high	93 Å²	93	54.1 Å²	54.1	57%	0.571	31%	0.309	S	S	*	.	H	α-helix	trans	-65.1	-28.8	174.3	52.4	0	0	0	0	112.3	Y166 A167 L219	T163-Y166 PolarHBondContact O-N 3.43Å; T163-A167 WeakPolarHBondContact O-CB 3.16Å; T163-A167 PolarHBondContact O-N 3Å; T163-L219 WeakPolarHBondContact OG1-CD1 3.37Å
164	V	95.7	Very high	91.1	Very high	41 Å²	41	58.5 Å²	58.5	25%	0.248	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-48.1	174.1	-179.5	0	0	0	0	110.3	S162 A167 M168 Y218 L219	S162-V164 PolarHBondContact O-N 3.08Å; S162-V164 PolarHBondContact OG-N 2.81Å; V164-A167 PolarHBondContact O-N 3.33Å; V164-M168 VanDerWaalsContact O-CB 3.29Å; V164-M168 WeakPolarHBondContact O-CB 3.27Å; V164-M168 PolarHBondContact O-N 2.88Å; V164-Y218 HydrophobicContact CB-CD1 4.28Å; V164-Y218 HydrophobicContact CG1-CD1 4Å; V164-Y218 HydrophobicContact CG1-CE1 4.5Å; V164-L219 HydrophobicContact CG2-CB 4.21Å; V164-L219 HydrophobicContact CG2-CD1 3.75Å; V164-L219 HydrophobicContact CG2-CG 3.76Å
165	F	95.6	Very high	89.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-65.9	-37.9	175.6	-70.4	-45.3	0	0	0	112.2	F137 L158 S162 A167 M168 F169 F189 M192 L196 Y218	F137-F165 AromaticContact CE1-CE1 3.86Å; F137-F165 HydrophobicContact CE1-CE1 3.86Å; F137-F165 HydrophobicContact CE1-CZ 4.43Å; F137-F165 HydrophobicContact CZ-CD1 4.37Å; F137-F165 AromaticContact CZ-CE1 3.69Å; F137-F165 HydrophobicContact CZ-CE1 3.69Å; F137-F165 HydrophobicContact CZ-CZ 4.21Å; L158-F165 HydrophobicContact CB-CB 3.91Å; L158-F165 HydrophobicContact CB-CD2 3.65Å; L158-F165 HydrophobicContact CB-CE2 4.33Å; L158-F165 HydrophobicContact CB-CG 3.83Å; L158-F165 HydrophobicContact CD2-CD2 4.38Å; L158-F165 HydrophobicContact CD2-CE2 4.26Å; L158-F165 HydrophobicContact CG-CD2 4.39Å; S162-F165 VanDerWaalsContact CB-CD2 3.45Å; S162-F165 PolarHBondContact O-N 3.28Å; S162-F165 PolarHBondContact OG-N 3.23Å; F165-A167 PolarHBondContact O-N 2.9Å; F165-M168 HydrophobicContact CD1-SD 4.25Å; F165-M168 PolarHBondContact O-N 2.8Å; F165-F169 HydrophobicContact CB-CD2 4.09Å; F165-F169 HydrophobicContact CB-CE2 3.92Å; F165-F169 AromaticContact CD1-CE2 3.8Å; F165-F169 HydrophobicContact CD1-CE2 3.8Å; F165-F169 HydrophobicContact CD1-CZ 4.36Å; F165-F169 HydrophobicContact CG-CE2 4.14Å; F165-F169 WeakPolarHBondContact O-CD2 3.16Å; F165-F169 PolarHBondContact O-N 3.13Å; F165-F189 HydrophobicContact CZ-CE2 4.46Å; F165-M192 HydrophobicContact CE2-CE 3.93Å; F165-M192 HydrophobicContact CE2-SD 4.31Å; F165-M192 HydrophobicContact CZ-CE 3.97Å; F165-L196 HydrophobicContact CD2-CD1 4.46Å; F165-L196 HydrophobicContact CE2-CD1 4.14Å; F165-Y218 HydrophobicContact CD1-CD1 4.11Å; F165-Y218 HydrophobicContact CD1-CE1 4.14Å; F165-Y218 HydrophobicContact CD2-CD1 4.34Å; F165-Y218 AromaticContact CE1-CD1 3.51Å; F165-Y218 HydrophobicContact CE1-CD1 3.51Å; F165-Y218 AromaticContact CE1-CE1 3.26Å; F165-Y218 HydrophobicContact CE1-CE1 3.26Å; F165-Y218 HydrophobicContact CE1-CG 4.45Å; F165-Y218 AromaticContact CE2-CD1 3.77Å; F165-Y218 HydrophobicContact CE2-CD1 3.77Å; F165-Y218 HydrophobicContact CE2-CE1 4.24Å; F165-Y218 AromaticContact CE2-CG 4Å; F165-Y218 HydrophobicContact CE2-CG 4Å; F165-Y218 HydrophobicContact CG-CD1 4.48Å; F165-Y218 AromaticContact CZ-CD1 3.31Å; F165-Y218 HydrophobicContact CZ-CD1 3.31Å; F165-Y218 HydrophobicContact CZ-CD2 4.27Å; F165-Y218 AromaticContact CZ-CE1 3.32Å; F165-Y218 HydrophobicContact CZ-CE1 3.32Å; F165-Y218 HydrophobicContact CZ-CE2 4.27Å; F165-Y218 AromaticContact CZ-CG 3.82Å; F165-Y218 HydrophobicContact CZ-CG 3.82Å; F165-Y218 AromaticContact CZ-CZ 3.82Å
166	Y	95.1	Very high	89	Confident	142 Å²	142	70 Å²	70	56%	0.557	39%	0.392	S	S	*	.	H	α-helix	trans	-57.1	-50.5	173.1	179.3	-93.6	0	0	0	111.6	A159 S162 T163 M168 F169 F170	A159-Y166 HydrophobicContact CB-CD2 4.3Å; S162-Y166 PolarHBondContact O-N 3.35Å; T163-Y166 PolarHBondContact O-N 3.43Å; Y166-M168 VanDerWaalsContact C-N 3.34Å; Y166-M168 PolarHBondContact O-N 3.32Å; Y166-F169 PolarHBondContact O-N 3.4Å; Y166-F170 HydrophobicContact CD2-CB 4.42Å; Y166-F170 HydrophobicContact CD2-CD2 4.22Å; Y166-F170 HydrophobicContact CE2-CB 4.21Å; Y166-F170 WeakPolarHBondContact O-CA 3.27Å; Y166-F170 WeakPolarHBondContact O-CB 3.36Å; Y166-F170 PolarHBondContact O-N 3.19Å
167	A	93.8	Very high	88.6	Confident	41 Å²	41	66.3 Å²	66.3	34%	0.339	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-43.5	177	0	0	0	0	0	111.5	T163 V164 F165 F169 G171 F173	T163-A167 WeakPolarHBondContact O-CB 3.16Å; T163-A167 PolarHBondContact O-N 3Å; V164-A167 PolarHBondContact O-N 3.33Å; F165-A167 PolarHBondContact O-N 2.9Å; A167-F169 PolarHBondContact O-N 3.17Å; A167-G171 WeakPolarHBondContact O-CA 3.31Å; A167-G171 PolarHBondContact O-N 3.09Å; A167-F173 WeakPolarHBondContact O-CD2 3.33Å; A167-F173 WeakPolarHBondContact O-CE2 3.46Å
168	M	92.3	Very high	88.4	Confident	63 Å²	63	69.9 Å²	69.9	31%	0.31	40%	0.403	S	S	.	.	H	α-helix	trans	-60.6	-43.8	-179.3	-175.4	177.9	-70.2	0	0	113	V164 F165 Y166 I179	V164-M168 VanDerWaalsContact O-CB 3.29Å; V164-M168 WeakPolarHBondContact O-CB 3.27Å; V164-M168 PolarHBondContact O-N 2.88Å; F165-M168 HydrophobicContact CD1-SD 4.25Å; F165-M168 PolarHBondContact O-N 2.8Å; Y166-M168 VanDerWaalsContact C-N 3.34Å; Y166-M168 PolarHBondContact O-N 3.32Å; M168-I179 HydrophobicContact SD-CD1 3.54Å; M168-I179 VanDerWaalsContact SD-CD1 3.54Å
169	F	92.2	Very high	88.2	Confident	23 Å²	23	71 Å²	71	10%	0.101	41%	0.409	C	S	.	.	H	α-helix	trans	-96.2	-28.7	-173.4	-60.4	-55.7	0	0	0	114.5	V135 F137 T155 L158 F165 Y166 A167 I179	V135-F169 HydrophobicContact CB-CE1 4.4Å; V135-F169 HydrophobicContact CG1-CZ 4.26Å; V135-F169 HydrophobicContact CG2-CE1 3.89Å; V135-F169 HydrophobicContact CG2-CZ 4.03Å; F137-F169 HydrophobicContact CZ-CZ 4Å; T155-F169 HydrophobicContact CG2-CB 4.33Å; T155-F169 HydrophobicContact CG2-CD1 3.62Å; T155-F169 HydrophobicContact CG2-CD2 3.93Å; T155-F169 HydrophobicContact CG2-CE1 3.8Å; T155-F169 HydrophobicContact CG2-CE2 4.13Å; T155-F169 HydrophobicContact CG2-CG 3.7Å; T155-F169 HydrophobicContact CG2-CZ 4.07Å; L158-F169 HydrophobicContact CB-CE2 4.32Å; L158-F169 HydrophobicContact CD1-CE2 4.03Å; L158-F169 HydrophobicContact CD1-CZ 4.4Å; F165-F169 HydrophobicContact CB-CD2 4.09Å; F165-F169 HydrophobicContact CB-CE2 3.92Å; F165-F169 AromaticContact CD1-CE2 3.8Å; F165-F169 HydrophobicContact CD1-CE2 3.8Å; F165-F169 HydrophobicContact CD1-CZ 4.36Å; F165-F169 HydrophobicContact CG-CE2 4.14Å; F165-F169 WeakPolarHBondContact O-CD2 3.16Å; F165-F169 PolarHBondContact O-N 3.13Å; Y166-F169 PolarHBondContact O-N 3.4Å; A167-F169 PolarHBondContact O-N 3.17Å; F169-I179 HydrophobicContact CE1-CD1 3.53Å; F169-I179 HydrophobicContact CZ-CD1 3.64Å
170	F	91	Very high	88.1	Confident	106 Å²	106	76.5 Å²	76.5	47%	0.465	44%	0.436	S	S	.	.	H	α-helix	trans	-119.9	-3.4	-173.6	-58.9	-82.3	0	0	0	113.6	A159 Y166 G172	A159-F170 HydrophobicContact CB-CD2 3.81Å; A159-F170 HydrophobicContact CB-CE2 3.53Å; Y166-F170 HydrophobicContact CD2-CB 4.42Å; Y166-F170 HydrophobicContact CD2-CD2 4.22Å; Y166-F170 HydrophobicContact CE2-CB 4.21Å; Y166-F170 WeakPolarHBondContact O-CA 3.27Å; Y166-F170 WeakPolarHBondContact O-CB 3.36Å; Y166-F170 PolarHBondContact O-N 3.19Å; F170-G172 VanDerWaalsContact C-N 3.35Å; F170-G172 PolarHBondContact O-N 2.91Å
171	G	87.3	Confident	88.1	Confident	49 Å²	49	72 Å²	72	51%	0.505	41%	0.408	S	S	.	.	S	Bend	trans	-84.8	5.5	179.2	0	0	0	0	0	115.9	A167	A167-G171 WeakPolarHBondContact O-CA 3.31Å; A167-G171 PolarHBondContact O-N 3.09Å
172	G	78.5	Confident	88	Confident	75 Å²	75	73.8 Å²	73.8	77%	0.773	41%	0.413	S	S	*	.	S	Bend	trans	92.8	9.2	177.3	0	0	0	0	0	115.9	F170	F170-G172 VanDerWaalsContact C-N 3.35Å; F170-G172 PolarHBondContact O-N 2.91Å
173	F	68.8	Low	87.7	Confident	138 Å²	138	77.2 Å²	77.2	61%	0.605	43%	0.432	S	S	*	.			trans	-71.4	159.4	170.3	-59.8	-84.1	0	0	0	111.6	A167 K175	A167-F173 WeakPolarHBondContact O-CD2 3.33Å; A167-F173 WeakPolarHBondContact O-CE2 3.46Å; F173-K175 PolarHBondContact O-N 3.25Å
174	S	64.7	Low	87.6	Confident	92 Å²	92	73 Å²	73	64%	0.643	41%	0.406	S	S	*	.			trans	-57.9	125.2	174.7	54.8	0	0	0	0	110.1	N176	S174-N176 PolarHBondContact O-N 3.49Å
175	K	69.4	Low	87.5	Confident	180 Å²	180	75.9 Å²	75.9	78%	0.783	42%	0.416	S	S	*	.			trans	-68.9	84	174.5	-72.4	-171.5	177.2	-171.8	0	109.9	F173	F173-K175 PolarHBondContact O-N 3.25Å
176	N	77.9	Confident	87.4	Confident	102 Å²	102	76.3 Å²	76.3	55%	0.545	42%	0.42	S	S	.	.			trans	-76	123.6	165.9	-68.1	-10.9	0	0	0	107.5	S174 E178	S174-N176 PolarHBondContact O-N 3.49Å; N176-E178 PolarHBondContact O-N 3.32Å
177	T	85.3	Confident	87.4	Confident	91 Å²	91	73.5 Å²	73.5	56%	0.558	41%	0.411	S	S	*	.	S	Bend	trans	-72.5	-18.7	172.6	51.2	0	0	0	0	111.4	V135 W136	V135-T177 CarbonylContact C-O 3.58Å; W136-T177 PolarHBondContact N-O 3.19Å
178	E	92.7	Very high	87.5	Confident	89 Å²	89	71.6 Å²	71.6	42%	0.416	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.5	179	-163.7	158.8	-116.3	0	0	110.7	W136 V138 R150 N176	W136-E178 CarbonylContact O-C 3.53Å; W136-E178 WeakPolarHBondContact O-CA 3.43Å; V138-E178 HydrophobicContact CG2-CG 3.81Å; R150-E178 IonicContact CZ-OE1 3.05Å; R150-E178 IonicContact NE-OE1 2.65Å; R150-E178 PolarHBondContact NE-OE1 2.97Å; R150-E178 IonicContact NH2-OE1 2.76Å; N176-E178 PolarHBondContact O-N 3.32Å
179	I	93.2	Very high	87.7	Confident	25 Å²	25	68.6 Å²	68.6	13%	0.128	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.9	-177.3	-63	169.6	0	0	0	108.8	V135 W136 F137 V138 M168 F169 V181	V135-I179 HydrophobicContact CG2-CD1 3.7Å; V135-I179 HydrophobicContact CG2-CG1 4.22Å; W136-I179 PolarHBondContact O-N 3.5Å; F137-I179 CarbonylContact C-O 3.54Å; F137-I179 VanDerWaalsContact CA-O 3.31Å; F137-I179 WeakPolarHBondContact CA-O 3.27Å; F137-I179 HydrophobicContact CD1-CB 3.77Å; F137-I179 HydrophobicContact CD1-CD1 4.41Å; F137-I179 HydrophobicContact CD1-CG2 3.84Å; F137-I179 HydrophobicContact CE1-CB 3.89Å; F137-I179 HydrophobicContact CE1-CD1 3.71Å; F137-I179 HydrophobicContact CE1-CG1 4.41Å; F137-I179 HydrophobicContact CE1-CG2 3.82Å; F137-I179 HydrophobicContact CZ-CD1 3.94Å; V138-I179 PolarHBondContact N-O 3.09Å; M168-I179 HydrophobicContact SD-CD1 3.54Å; M168-I179 VanDerWaalsContact SD-CD1 3.54Å; F169-I179 HydrophobicContact CE1-CD1 3.53Å; F169-I179 HydrophobicContact CZ-CD1 3.64Å; I179-V181 HydrophobicContact CG2-CG2 4.12Å
180	L	93.6	Very high	87.8	Confident	126 Å²	126	69.8 Å²	69.8	66%	0.66	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.5	176.5	-52.9	-179.1	0	0	0	110	V138	V138-L180 HydrophobicContact CB-CD2 3.69Å; V138-L180 HydrophobicContact CG1-CD2 4.23Å; V138-L180 HydrophobicContact CG2-CD2 3.96Å
181	V	94.5	Very high	88.1	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.006	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	71.5	177	-164	0	0	0	0	109.3	F137 V138 V139 G140 I179 D183 V184	F137-V181 HydrophobicContact CD1-CG2 3.72Å; F137-V181 HydrophobicContact CE1-CG2 4.46Å; V138-V181 PolarHBondContact O-N 2.66Å; V139-V181 WeakPolarHBondContact CA-O 3.47Å; V139-V181 HydrophobicContact CG2-CB 4.34Å; G140-V181 PolarHBondContact N-O 2.71Å; I179-V181 HydrophobicContact CG2-CG2 4.12Å; V181-D183 VanDerWaalsContact C-N 3.31Å; V181-D183 PolarHBondContact O-N 2.67Å; V181-V184 HydrophobicContact CG1-CB 3.66Å; V181-V184 HydrophobicContact CG1-CG2 3.53Å
182	P	92.9	Very high	88.6	Confident	69 Å²	69	63.4 Å²	63.4	45%	0.448	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-19.8	-170.7	30.3	-36.3	0	0	0	114.4	G140	G140-P182 WeakPolarHBondContact O-CA 3.47Å
183	D	91.9	Very high	89.6	Confident	75 Å²	75	59.9 Å²	59.9	40%	0.401	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4	-174.4	65.8	-57	0	0	0	113.7	V181 Y213 K217	V181-D183 VanDerWaalsContact C-N 3.31Å; V181-D183 PolarHBondContact O-N 2.67Å; D183-Y213 PolarHBondContact OD2-OH 3.41Å; D183-K217 IonicContact OD1-NZ 3.62Å; D183-K217 PolarHBondContact OD1-NZ 3.21Å; D183-K217 IonicContact OD2-NZ 3.11Å; D183-K217 PolarHBondContact OD2-NZ 3.39Å
184	V	93.6	Very high	90.9	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.024	30%	0.297	C	S	.	.	S	Bend	trans	-119.6	136.3	-176.4	170.5	0	0	0	0	110.2	V139 G140 V181 F189 Y213 V214 K217	V139-V184 HydrophobicContact CG1-CB 4.13Å; V139-V184 HydrophobicContact CG1-CG1 3.96Å; V139-V184 VanDerWaalsContact CG1-O 3.27Å; V139-V184 WeakPolarHBondContact CG1-O 3.44Å; G140-V184 VanDerWaalsContact CA-O 3.3Å; G140-V184 WeakPolarHBondContact CA-O 3.46Å; G140-V184 PolarHBondContact N-O 2.94Å; V181-V184 HydrophobicContact CG1-CB 3.66Å; V181-V184 HydrophobicContact CG1-CG2 3.53Å; V184-F189 HydrophobicContact CG1-CB 3.86Å; V184-F189 HydrophobicContact CG1-CD2 4.21Å; V184-Y213 HydrophobicContact CG2-CD1 4.36Å; V184-Y213 HydrophobicContact CG2-CE1 3.96Å; V184-V214 HydrophobicContact CB-CG2 4.15Å; V184-V214 HydrophobicContact CG1-CG2 3.25Å; V184-V214 HydrophobicContact CG2-CG2 3.81Å; V184-K217 HydrophobicContact CG2-CD 4.3Å
185	E	93.2	Very high	92.5	Very high	102 Å²	102	55.1 Å²	55.1	48%	0.477	27%	0.272	S	S	.	.			trans	-68.2	133.9	171.5	-67.8	178.9	174.3	0	0	111	E187 A188 F189 S210	E185-E187 PolarHBondContact O-N 2.81Å; E185-E187 VanDerWaalsContact O-N 3.13Å; E185-A188 HydrophobicContact CB-CB 4.3Å; E185-A188 PolarHBondContact O-N 2.87Å; E185-F189 PolarHBondContact O-N 2.82Å; E185-F189 VanDerWaalsContact O-N 3.13Å; E185-S210 WeakPolarHBondContact OE2-CB 3.2Å; E185-S210 PolarHBondContact OE2-OG 3.04Å
186	P	94.6	Very high	93.8	Very high	10 Å²	10	47.3 Å²	47.3	7%	0.065	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-33.4	-178.8	-28.1	34.7	0	0	0	114.4	V139 K149 K190	V139-P186 HydrophobicContact CG1-CB 4.46Å; V139-P186 HydrophobicContact CG1-CG 4.38Å; K149-P186 HydrophobicContact CB-CB 4.14Å; K149-P186 HydrophobicContact CB-CG 4.36Å; K149-P186 HydrophobicContact CD-CB 3.72Å; K149-P186 HydrophobicContact CD-CG 4.26Å; K149-P186 HydrophobicContact CG-CB 4.02Å; K149-P186 HydrophobicContact CG-CG 4.12Å; P186-K190 VanDerWaalsContact O-CG 3.29Å; P186-K190 WeakPolarHBondContact O-CG 3.42Å; P186-K190 PolarHBondContact O-N 3.36Å
187	E	94	Very high	94.8	Very high	83 Å²	83	42.7 Å²	42.7	39%	0.388	21%	0.214	S	C	.	.	H	α-helix	trans	-74.7	-41.9	-178	-155.4	54.8	-138.5	0	0	112.4	E185 F189 K190 I191 T207	E185-E187 PolarHBondContact O-N 2.81Å; E185-E187 VanDerWaalsContact O-N 3.13Å; E187-F189 VanDerWaalsContact C-N 3.29Å; E187-F189 PolarHBondContact O-N 3.41Å; E187-K190 WeakPolarHBondContact O-CB 3.41Å; E187-K190 PolarHBondContact O-N 2.92Å; E187-K190 VanDerWaalsContact O-N 3.16Å; E187-K190 WeakPolarHBondContact OE2-CD 3.46Å; E187-K190 IonicContact OE2-NZ 3.45Å; E187-K190 PolarHBondContact OE2-NZ 2.63Å; E187-I191 WeakPolarHBondContact O-CG1 3.41Å; E187-I191 PolarHBondContact O-N 2.84Å; E187-T207 HydrophobicContact CB-CG2 4.45Å; E187-T207 HydrophobicContact CG-CG2 4.29Å
188	A	95.1	Very high	95.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-41.2	171.5	0	0	0	0	0	112.2	E185 K190 I191 M192 S210 V214	E185-A188 HydrophobicContact CB-CB 4.3Å; E185-A188 PolarHBondContact O-N 2.87Å; A188-K190 VanDerWaalsContact C-N 3.35Å; A188-K190 PolarHBondContact O-N 3.25Å; A188-I191 PolarHBondContact O-N 2.85Å; A188-M192 PolarHBondContact O-N 3.44Å; A188-S210 VanDerWaalsContact CB-C 3.49Å; A188-V214 HydrophobicContact CB-CG2 4.01Å
189	F	96.6	Very high	95.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-40.4	176.7	-165.6	-99.4	0	0	0	112.1	F137 V139 I151 F165 V184 E185 E187 M192 L193 V214 Y218	F137-F189 HydrophobicContact CB-CE1 3.87Å; F137-F189 HydrophobicContact CB-CZ 3.99Å; F137-F189 HydrophobicContact CD1-CE1 4.37Å; F137-F189 HydrophobicContact CD1-CE2 4.36Å; F137-F189 AromaticContact CD1-CZ 3.64Å; F137-F189 HydrophobicContact CD1-CZ 3.64Å; F137-F189 HydrophobicContact CD2-CE1 4.01Å; F137-F189 AromaticContact CD2-CZ 3.86Å; F137-F189 HydrophobicContact CD2-CZ 3.86Å; F137-F189 HydrophobicContact CE1-CZ 4Å; F137-F189 HydrophobicContact CE2-CZ 4.22Å; F137-F189 AromaticContact CG-CE1 3.83Å; F137-F189 HydrophobicContact CG-CE1 3.83Å; F137-F189 AromaticContact CG-CZ 3.54Å; F137-F189 HydrophobicContact CG-CZ 3.54Å; F137-F189 HydrophobicContact CZ-CZ 4.27Å; V139-F189 HydrophobicContact CG1-CB 3.87Å; V139-F189 HydrophobicContact CG1-CG 4.19Å; V139-F189 HydrophobicContact CG2-CB 4.35Å; V139-F189 HydrophobicContact CG2-CD1 3.68Å; V139-F189 HydrophobicContact CG2-CD2 4.33Å; V139-F189 HydrophobicContact CG2-CE1 3.95Å; V139-F189 HydrophobicContact CG2-CG 3.87Å; V139-F189 HydrophobicContact CG2-CZ 4.42Å; I151-F189 HydrophobicContact CD1-CD1 3.99Å; F165-F189 HydrophobicContact CZ-CE2 4.46Å; V184-F189 HydrophobicContact CG1-CB 3.86Å; V184-F189 HydrophobicContact CG1-CD2 4.21Å; E185-F189 PolarHBondContact O-N 2.82Å; E185-F189 VanDerWaalsContact O-N 3.13Å; E187-F189 VanDerWaalsContact C-N 3.29Å; E187-F189 PolarHBondContact O-N 3.41Å; F189-M192 HydrophobicContact CD2-CE 3.63Å; F189-M192 HydrophobicContact CE2-CE 3.42Å; F189-M192 VanDerWaalsContact CE2-CE 3.42Å; F189-M192 HydrophobicContact CG-CE 4.28Å; F189-M192 HydrophobicContact CZ-CE 3.91Å; F189-M192 WeakPolarHBondContact O-CB 3.45Å; F189-M192 PolarHBondContact O-N 3.07Å; F189-L193 HydrophobicContact CD1-CD1 3.8Å; F189-L193 HydrophobicContact CD1-CG 3.95Å; F189-L193 HydrophobicContact CE1-CD1 3.62Å; F189-L193 HydrophobicContact CE1-CD2 4.11Å; F189-L193 HydrophobicContact CE1-CG 3.81Å; F189-L193 HydrophobicContact CZ-CD2 4.42Å; F189-L193 WeakPolarHBondContact O-CG 3.2Å; F189-L193 PolarHBondContact O-N 3.41Å; F189-V214 HydrophobicContact CD2-CG1 4.46Å; F189-Y218 HydrophobicContact CD2-CE2 4.32Å; F189-Y218 AromaticContact CE2-CE2 3.99Å; F189-Y218 HydrophobicContact CE2-CE2 3.99Å
190	K	96.1	Very high	95.5	Very high	49 Å²	49	41 Å²	41	21%	0.213	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-42.1	174.5	-81	178.6	-178.9	-177.6	0	112.6	Y128 I151 P186 E187 A188 M192 L193 R194	Y128-K190 HydrophobicContact CE1-CB 4.31Å; Y128-K190 HydrophobicContact CE1-CG 3.81Å; Y128-K190 WeakPolarHBondContact OH-CA 3.4Å; Y128-K190 WeakPolarHBondContact OH-CB 3.41Å; Y128-K190 PolarHBondContact OH-O 3.29Å; Y128-K190 VanDerWaalsContact OH-O 3.12Å; I151-K190 HydrophobicContact CD1-CG 4.14Å; P186-K190 VanDerWaalsContact O-CG 3.29Å; P186-K190 WeakPolarHBondContact O-CG 3.42Å; P186-K190 PolarHBondContact O-N 3.36Å; E187-K190 WeakPolarHBondContact O-CB 3.41Å; E187-K190 PolarHBondContact O-N 2.92Å; E187-K190 VanDerWaalsContact O-N 3.16Å; E187-K190 WeakPolarHBondContact OE2-CD 3.46Å; E187-K190 IonicContact OE2-NZ 3.45Å; E187-K190 PolarHBondContact OE2-NZ 2.63Å; A188-K190 VanDerWaalsContact C-N 3.35Å; A188-K190 PolarHBondContact O-N 3.25Å; K190-M192 VanDerWaalsContact C-N 3.34Å; K190-M192 PolarHBondContact O-N 3.3Å; K190-L193 PolarHBondContact O-N 3.27Å; K190-R194 WeakPolarHBondContact O-CB 3.34Å; K190-R194 PolarHBondContact O-N 2.88Å
191	I	97.2	Very high	95.5	Very high	20 Å²	20	36.9 Å²	36.9	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-45.9	175.2	-67.6	165.3	0	0	0	110.2	E187 A188 R194 Y195 H202 L203 T207 T211	E187-I191 WeakPolarHBondContact O-CG1 3.41Å; E187-I191 PolarHBondContact O-N 2.84Å; A188-I191 PolarHBondContact O-N 2.85Å; I191-R194 PolarHBondContact O-N 3.05Å; I191-Y195 PolarHBondContact O-N 3.35Å; I191-H202 WeakPolarHBondContact CG2-O 3.31Å; I191-L203 HydrophobicContact CG2-CD2 4.45Å; I191-T207 VanDerWaalsContact CD1-OG1 3.28Å; I191-T207 WeakPolarHBondContact CD1-OG1 3.28Å; I191-T211 HydrophobicContact CB-CG2 4.25Å; I191-T211 HydrophobicContact CG2-CG2 3.65Å
192	M	97.8	Very high	95.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-47.6	174.4	-178.6	-160.6	61.9	0	0	111.9	F165 A188 F189 K190 R194 Y195 L196 V214 Y218 I220 L223	F165-M192 HydrophobicContact CE2-CE 3.93Å; F165-M192 HydrophobicContact CE2-SD 4.31Å; F165-M192 HydrophobicContact CZ-CE 3.97Å; A188-M192 PolarHBondContact O-N 3.44Å; F189-M192 HydrophobicContact CD2-CE 3.63Å; F189-M192 HydrophobicContact CE2-CE 3.42Å; F189-M192 VanDerWaalsContact CE2-CE 3.42Å; F189-M192 HydrophobicContact CG-CE 4.28Å; F189-M192 HydrophobicContact CZ-CE 3.91Å; F189-M192 WeakPolarHBondContact O-CB 3.45Å; F189-M192 PolarHBondContact O-N 3.07Å; K190-M192 VanDerWaalsContact C-N 3.34Å; K190-M192 PolarHBondContact O-N 3.3Å; M192-R194 VanDerWaalsContact C-N 3.35Å; M192-R194 PolarHBondContact O-N 2.78Å; M192-Y195 WeakPolarHBondContact O-CB 3.49Å; M192-Y195 PolarHBondContact O-N 3.03Å; M192-L196 HydrophobicContact CE-CD1 4.39Å; M192-L196 HydrophobicContact CG-CD1 4.23Å; M192-L196 WeakPolarHBondContact O-CG 3.47Å; M192-L196 PolarHBondContact O-N 3.21Å; M192-L196 HydrophobicContact SD-CD1 4.45Å; M192-V214 HydrophobicContact CB-CG1 3.8Å; M192-V214 HydrophobicContact CE-CG1 4.06Å; M192-V214 HydrophobicContact CG-CG1 4.01Å; M192-V214 HydrophobicContact SD-CG1 3.36Å; M192-V214 WeakPolarHBondContact SD-CG1 3.45Å; M192-Y218 HydrophobicContact CE-CD2 4.05Å; M192-Y218 HydrophobicContact CE-CE2 4.25Å; M192-Y218 HydrophobicContact SD-CD2 3.43Å; M192-Y218 WeakPolarHBondContact SD-CD2 3.27Å; M192-Y218 HydrophobicContact SD-CE2 4.18Å; M192-Y218 HydrophobicContact SD-CG 3.92Å; M192-I220 HydrophobicContact CG-CD1 3.36Å; M192-I220 HydrophobicContact SD-CD1 3.51Å; M192-I220 VanDerWaalsContact SD-CD1 3.51Å; M192-L223 HydrophobicContact CB-CD2 4.19Å; M192-L223 HydrophobicContact CG-CD2 4.17Å
193	L	97.7	Very high	95.7	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-45.5	177.4	-74.1	-175.1	0	0	0	111.1	L127 Y128 I151 L158 F189 K190 Y195 L196 Y197	L127-L193 HydrophobicContact CD1-CB 3.86Å; Y128-L193 HydrophobicContact CE1-CD1 4.24Å; I151-L193 HydrophobicContact CG2-CD1 3.64Å; L158-L193 HydrophobicContact CD2-CD2 3.44Å; L158-L193 VanDerWaalsContact CD2-CD2 3.44Å; F189-L193 HydrophobicContact CD1-CD1 3.8Å; F189-L193 HydrophobicContact CD1-CG 3.95Å; F189-L193 HydrophobicContact CE1-CD1 3.62Å; F189-L193 HydrophobicContact CE1-CD2 4.11Å; F189-L193 HydrophobicContact CE1-CG 3.81Å; F189-L193 HydrophobicContact CZ-CD2 4.42Å; F189-L193 WeakPolarHBondContact O-CG 3.2Å; F189-L193 PolarHBondContact O-N 3.41Å; K190-L193 PolarHBondContact O-N 3.27Å; L193-Y195 VanDerWaalsContact C-N 3.27Å; L193-Y195 PolarHBondContact O-N 3.5Å; L193-L196 PolarHBondContact O-N 3.07Å; L193-L196 VanDerWaalsContact O-N 3.08Å; L193-Y197 HydrophobicContact CD2-CE2 4.42Å; L193-Y197 WeakPolarHBondContact O-CD2 3.49Å; L193-Y197 PolarHBondContact O-N 3.16Å
194	R	97.3	Very high	95.8	Very high	97 Å²	97	36.8 Å²	36.8	37%	0.366	18%	0.176	S	C	.	.	H	α-helix	trans	-54.4	-48.5	176.6	-177.1	175	178.6	117.4	2.4	110.5	L127 K190 I191 M192 L196 Y197 T198 E200 H202	L127-R194 HydrophobicContact CD2-CB 3.96Å; L127-R194 HydrophobicContact CD2-CG 4.05Å; K190-R194 WeakPolarHBondContact O-CB 3.34Å; K190-R194 PolarHBondContact O-N 2.88Å; I191-R194 PolarHBondContact O-N 3.05Å; M192-R194 VanDerWaalsContact C-N 3.35Å; M192-R194 PolarHBondContact O-N 2.78Å; R194-L196 PolarHBondContact O-N 2.86Å; R194-Y197 PolarHBondContact O-N 3.36Å; R194-T198 WeakPolarHBondContact O-CB 3.46Å; R194-T198 PolarHBondContact O-N 3.49Å; R194-T198 PolarHBondContact O-OG1 3.36Å; R194-E200 IonicContact CZ-OE2 2.68Å; R194-E200 IonicContact NE-OE2 2.8Å; R194-E200 PolarHBondContact NE-OE2 3.27Å; R194-E200 IonicContact NH2-OE2 3.35Å; R194-E200 PolarHBondContact NH2-OE2 3.01Å; R194-H202 PolarHBondContact NE-CD2 2.75Å; R194-H202 PolarHBondContact NE-NE2 3.5Å; R194-H202 PolarHBondContact NH2-NE2 3.42Å
195	Y	98	Very high	95.7	Very high	34 Å²	34	40.6 Å²	40.6	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-56.5	-47.8	174.9	170.4	-101.5	0	0	0	112.6	I191 M192 L193 Y197 T198 D199 E200 V201 I220 Y222 L223	I191-Y195 PolarHBondContact O-N 3.35Å; M192-Y195 WeakPolarHBondContact O-CB 3.49Å; M192-Y195 PolarHBondContact O-N 3.03Å; L193-Y195 VanDerWaalsContact C-N 3.27Å; L193-Y195 PolarHBondContact O-N 3.5Å; Y195-Y197 VanDerWaalsContact C-N 3.26Å; Y195-Y197 PolarHBondContact O-N 3.36Å; Y195-T198 PolarHBondContact O-N 2.94Å; Y195-D199 VanDerWaalsContact O-CA 3.28Å; Y195-D199 WeakPolarHBondContact O-CA 3.04Å; Y195-D199 PolarHBondContact O-N 3.16Å; Y195-E200 WeakPolarHBondContact CA-O 3.31Å; Y195-V201 HydrophobicContact CD2-CG2 3.55Å; Y195-V201 HydrophobicContact CE2-CG2 3.95Å; Y195-V201 HydrophobicContact CG-CG2 4.48Å; Y195-I220 HydrophobicContact CD1-CG2 3.76Å; Y195-I220 HydrophobicContact CE1-CG2 3.3Å; Y195-Y222 AromaticContact CE2-CD1 3.66Å; Y195-Y222 HydrophobicContact CE2-CD1 3.66Å; Y195-Y222 HydrophobicContact CE2-CE1 4.17Å; Y195-Y222 AromaticContact CZ-CD1 3.81Å; Y195-Y222 WeakPolarHBondContact OH-CB 3.28Å; Y195-Y222 WeakPolarHBondContact OH-CD1 3.48Å; Y195-L223 HydrophobicContact CD1-CB 4.18Å; Y195-L223 HydrophobicContact CD1-CD2 4.26Å; Y195-L223 HydrophobicContact CE1-CB 4.28Å; Y195-L223 HydrophobicContact CG-CD1 4.45Å; Y195-L223 HydrophobicContact CG-CD2 4.46Å
196	L	97.6	Very high	95.6	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-30.4	-179.7	-70.3	172.8	0	0	0	113.6	V157 L158 F165 M192 L193 R194 I220	V157-L196 WeakPolarHBondContact CG1-O 3.29Å; L158-L196 HydrophobicContact CD2-CD1 3.69Å; F165-L196 HydrophobicContact CD2-CD1 4.46Å; F165-L196 HydrophobicContact CE2-CD1 4.14Å; M192-L196 HydrophobicContact CE-CD1 4.39Å; M192-L196 HydrophobicContact CG-CD1 4.23Å; M192-L196 WeakPolarHBondContact O-CG 3.47Å; M192-L196 PolarHBondContact O-N 3.21Å; M192-L196 HydrophobicContact SD-CD1 4.45Å; L193-L196 PolarHBondContact O-N 3.07Å; L193-L196 VanDerWaalsContact O-N 3.08Å; R194-L196 PolarHBondContact O-N 2.86Å; L196-I220 HydrophobicContact CD1-CD1 4.09Å; L196-I220 HydrophobicContact CD2-CD1 3.94Å; L196-I220 HydrophobicContact CG-CD1 4.13Å
197	Y	97.2	Very high	95.5	Very high	5 Å²	5	43.2 Å²	43.2	2%	0.02	22%	0.218	C	C	.	.	H	α-helix	trans	-88.8	-30.4	179.1	-79.1	-107.9	0	0	0	112.8	N123 M126 L127 A153 H154 V157 L158 L193 R194 Y195	N123-Y197 HydrophobicContact CB-CD1 4.26Å; N123-Y197 WeakPolarHBondContact CB-O 3.28Å; N123-Y197 VanDerWaalsContact O-CD1 3.29Å; N123-Y197 WeakPolarHBondContact O-CD1 3.31Å; M126-Y197 HydrophobicContact CB-CD1 4.43Å; M126-Y197 HydrophobicContact CB-CE1 4.16Å; L127-Y197 HydrophobicContact CB-CD1 4.42Å; L127-Y197 HydrophobicContact CB-CG 4.38Å; L127-Y197 HydrophobicContact CD1-CD2 3.89Å; L127-Y197 HydrophobicContact CD1-CE2 4.3Å; L127-Y197 HydrophobicContact CD1-CG 4.07Å; A153-Y197 WeakPolarHBondContact CA-OH 3.32Å; H154-Y197 WeakPolarHBondContact CB-OH 3.24Å; H154-Y197 PolarHBondContact N-OH 2.95Å; H154-Y197 AromaticContact ND1-CE1 3.55Å; H154-Y197 AromaticContact ND1-CZ 3.56Å; H154-Y197 PolarHBondContact ND1-OH 3.38Å; V157-Y197 HydrophobicContact CB-CE1 4.35Å; V157-Y197 HydrophobicContact CB-CE2 4.38Å; V157-Y197 HydrophobicContact CG1-CD1 4.08Å; V157-Y197 HydrophobicContact CG1-CD2 3.78Å; V157-Y197 HydrophobicContact CG1-CE1 4.13Å; V157-Y197 HydrophobicContact CG1-CE2 3.84Å; V157-Y197 HydrophobicContact CG1-CG 3.95Å; V157-Y197 HydrophobicContact CG2-CE1 4.16Å; L158-Y197 HydrophobicContact CD2-CE2 4.35Å; L193-Y197 HydrophobicContact CD2-CE2 4.42Å; L193-Y197 WeakPolarHBondContact O-CD2 3.49Å; L193-Y197 PolarHBondContact O-N 3.16Å; R194-Y197 PolarHBondContact O-N 3.36Å; Y195-Y197 VanDerWaalsContact C-N 3.26Å; Y195-Y197 PolarHBondContact O-N 3.36Å
198	T	95.7	Very high	95.6	Very high	4 Å²	4	39.3 Å²	39.3	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-123.1	-6.8	-166.8	75.5	0	0	0	0	115.4	R120 A124 R194 Y195 E200	R120-T198 WeakPolarHBondContact CD-O 3.36Å; R120-T198 VanDerWaalsContact CG-O 3.29Å; R120-T198 WeakPolarHBondContact CG-O 3.31Å; R120-T198 VanDerWaalsContact CZ-O 3.28Å; R120-T198 PolarHBondContact NE-O 2.95Å; A124-T198 HydrophobicContact CB-CG2 3.65Å; R194-T198 WeakPolarHBondContact O-CB 3.46Å; R194-T198 PolarHBondContact O-N 3.49Å; R194-T198 PolarHBondContact O-OG1 3.36Å; Y195-T198 PolarHBondContact O-N 2.94Å; T198-E200 PolarHBondContact O-N 2.84Å; T198-E200 VanDerWaalsContact O-N 3.09Å; T198-E200 VanDerWaalsContact OG1-CB 3.31Å; T198-E200 WeakPolarHBondContact OG1-CB 3.31Å; T198-E200 WeakPolarHBondContact OG1-CG 3.49Å; T198-E200 PolarHBondContact OG1-N 3.35Å
199	D	94.8	Very high	95.6	Very high	96 Å²	96	40.4 Å²	40.4	51%	0.513	21%	0.206	S	C	.	.			trans	54.9	10.7	-165.5	-45.3	-56.3	0	0	0	114.6	R120 Y195	R120-D199 IonicContact CZ-OD2 3.14Å; R120-D199 IonicContact NE-OD2 2.73Å; R120-D199 IonicContact NH2-OD2 2.72Å; R120-D199 PolarHBondContact NH2-OD2 3.12Å; Y195-D199 VanDerWaalsContact O-CA 3.28Å; Y195-D199 WeakPolarHBondContact O-CA 3.04Å; Y195-D199 PolarHBondContact O-N 3.16Å
200	E	95	Very high	95.4	Very high	68 Å²	68	41.4 Å²	41.4	32%	0.318	21%	0.213	S	C	.	.			trans	-90.9	130.6	179.3	-60.7	-179.4	170.2	0	0	110.7	R194 Y195 T198 H202	R194-E200 IonicContact CZ-OE2 2.68Å; R194-E200 IonicContact NE-OE2 2.8Å; R194-E200 PolarHBondContact NE-OE2 3.27Å; R194-E200 IonicContact NH2-OE2 3.35Å; R194-E200 PolarHBondContact NH2-OE2 3.01Å; Y195-E200 WeakPolarHBondContact CA-O 3.31Å; T198-E200 PolarHBondContact O-N 2.84Å; T198-E200 VanDerWaalsContact O-N 3.09Å; T198-E200 VanDerWaalsContact OG1-CB 3.31Å; T198-E200 WeakPolarHBondContact OG1-CB 3.31Å; T198-E200 WeakPolarHBondContact OG1-CG 3.49Å; T198-E200 PolarHBondContact OG1-N 3.35Å; E200-H202 WeakPolarHBondContact CB-NE2 3.33Å; E200-H202 IonicContact OE2-CD2 3.64Å; E200-H202 IonicContact OE2-CE1 2.9Å; E200-H202 IonicContact OE2-NE2 3.57Å; E200-H202 PolarHBondContact OE2-NE2 3.34Å
201	V	94.9	Very high	95.4	Very high	40 Å²	40	39.1 Å²	39.1	24%	0.242	20%	0.203	C	C	.	.			trans	-104.1	110	176.5	178.1	0	0	0	0	108.5	Y195 L203 Y222 L223 A226	Y195-V201 HydrophobicContact CD2-CG2 3.55Å; Y195-V201 HydrophobicContact CE2-CG2 3.95Å; Y195-V201 HydrophobicContact CG-CG2 4.48Å; V201-L203 HydrophobicContact CG1-CD1 3.68Å; V201-L203 HydrophobicContact CG1-CD2 4.15Å; V201-L203 HydrophobicContact CG1-CG 3.57Å; V201-Y222 HydrophobicContact CG2-CE1 4.14Å; V201-L223 HydrophobicContact CG1-CD1 4.04Å; V201-L223 HydrophobicContact CG2-CD1 4.17Å; V201-A226 HydrophobicContact CG1-CB 3.89Å; V201-A226 HydrophobicContact CG2-CB 4.35Å
202	H	94.3	Very high	95.4	Very high	66 Å²	66	38.2 Å²	38.2	31%	0.306	20%	0.198	S	C	.	.			trans	-113.6	104.3	174.7	-63.6	-77	0	0	0	107.9	I191 R194 E200	I191-H202 WeakPolarHBondContact CG2-O 3.31Å; R194-H202 PolarHBondContact NE-CD2 2.75Å; R194-H202 PolarHBondContact NE-NE2 3.5Å; R194-H202 PolarHBondContact NH2-NE2 3.42Å; E200-H202 WeakPolarHBondContact CB-NE2 3.33Å; E200-H202 IonicContact OE2-CD2 3.64Å; E200-H202 IonicContact OE2-CE1 2.9Å; E200-H202 IonicContact OE2-NE2 3.57Å; E200-H202 PolarHBondContact OE2-NE2 3.34Å
203	L	96.6	Very high	95.3	Very high	30 Å²	30	42.4 Å²	42.4	16%	0.157	21%	0.214	C	C	.	.			trans	-111.3	141.3	-177.5	-63.1	172	0	0	0	109.6	I191 V201 V208 T211 A226 F230	I191-L203 HydrophobicContact CG2-CD2 4.45Å; V201-L203 HydrophobicContact CG1-CD1 3.68Å; V201-L203 HydrophobicContact CG1-CD2 4.15Å; V201-L203 HydrophobicContact CG1-CG 3.57Å; L203-V208 HydrophobicContact CD2-CG2 4.45Å; L203-T211 HydrophobicContact CD2-CG2 3.89Å; L203-A226 HydrophobicContact CD1-CB 4.46Å; L203-A226 WeakPolarHBondContact CD1-O 3.49Å; L203-F230 HydrophobicContact CB-CD1 4.5Å; L203-F230 HydrophobicContact CB-CD2 3.81Å; L203-F230 HydrophobicContact CB-CE2 4.04Å; L203-F230 HydrophobicContact CB-CG 4.04Å; L203-F230 HydrophobicContact CB-CZ 4.48Å; L203-F230 HydrophobicContact CD1-CB 3.65Å; L203-F230 HydrophobicContact CD1-CD2 4.26Å; L203-F230 HydrophobicContact CD1-CG 4.04Å
204	D	93.9	Very high	95.2	Very high	48 Å²	48	42.4 Å²	42.4	26%	0.257	21%	0.214	S	C	.	.			trans	-126.5	142.6	178.1	-174.2	-83.2	0	0	0	109.3	D206 T207 V208	D204-D206 PolarHBondContact O-N 3.22Å; D204-D206 VanDerWaalsContact O-N 3.12Å; D204-D206 WeakPolarHBondContact OD1-CB 3.49Å; D204-D206 PolarHBondContact OD1-N 2.97Å; D204-T207 PolarHBondContact O-N 3.3Å; D204-T207 VanDerWaalsContact O-N 3.11Å; D204-V208 WeakPolarHBondContact O-CB 3.29Å; D204-V208 PolarHBondContact O-N 2.87Å
205	P	91.5	Very high	95.2	Very high	83 Å²	83	37.8 Å²	37.8	54%	0.539	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.5	179.4	-26	35.7	0	0	0	114.2	F230	P205-F230 HydrophobicContact CG-CE1 4.31Å; P205-F230 HydrophobicContact CG-CZ 4.01Å
206	D	91.1	Very high	95	Very high	146 Å²	146	38.8 Å²	38.8	78%	0.781	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-25.1	-175.9	-61.4	-19.6	0	0	0	112.1	D204	D204-D206 PolarHBondContact O-N 3.22Å; D204-D206 VanDerWaalsContact O-N 3.12Å; D204-D206 WeakPolarHBondContact OD1-CB 3.49Å; D204-D206 PolarHBondContact OD1-N 2.97Å
207	T	93.8	Very high	94.9	Very high	21 Å²	21	41.5 Å²	41.5	13%	0.129	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-6.8	-174.1	62.4	0	0	0	0	114	E187 I191 D204 I209 S210 T211	E187-T207 HydrophobicContact CB-CG2 4.45Å; E187-T207 HydrophobicContact CG-CG2 4.29Å; I191-T207 VanDerWaalsContact CD1-OG1 3.28Å; I191-T207 WeakPolarHBondContact CD1-OG1 3.28Å; D204-T207 PolarHBondContact O-N 3.3Å; D204-T207 VanDerWaalsContact O-N 3.11Å; T207-I209 VanDerWaalsContact C-N 3.34Å; T207-I209 PolarHBondContact O-N 3.2Å; T207-S210 PolarHBondContact O-N 2.92Å; T207-S210 PolarHBondContact O-OG 3.14Å; T207-S210 VanDerWaalsContact O-OG 3.08Å; T207-T211 VanDerWaalsContact O-CB 3.28Å; T207-T211 WeakPolarHBondContact O-CB 3.48Å; T207-T211 PolarHBondContact O-N 3.22Å; T207-T211 PolarHBondContact O-OG1 3.01Å
208	V	95.5	Very high	94.9	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-36.2	-173.6	60.8	0	0	0	0	112.9	L203 D204 T211 L212 C227 F230 L231	L203-V208 HydrophobicContact CD2-CG2 4.45Å; D204-V208 WeakPolarHBondContact O-CB 3.29Å; D204-V208 PolarHBondContact O-N 2.87Å; V208-T211 PolarHBondContact O-N 3.11Å; V208-L212 VanDerWaalsContact O-CB 3.3Å; V208-L212 WeakPolarHBondContact O-CB 3.49Å; V208-L212 PolarHBondContact O-N 3.36Å; V208-C227 HydrophobicContact CG2-CB 4.01Å; V208-F230 HydrophobicContact CB-CD1 4.03Å; V208-F230 HydrophobicContact CB-CE1 4.2Å; V208-F230 HydrophobicContact CG1-CD1 4.09Å; V208-F230 HydrophobicContact CG1-CE1 4.08Å; V208-F230 HydrophobicContact CG2-CB 4.45Å; V208-F230 HydrophobicContact CG2-CD1 3.75Å; V208-F230 HydrophobicContact CG2-CE1 4.43Å; V208-F230 HydrophobicContact CG2-CG 4.38Å; V208-L231 HydrophobicContact CG1-CD2 3.54Å; V208-L231 HydrophobicContact CG1-CG 4.28Å; V208-L231 HydrophobicContact CG2-CD2 4.19Å; V208-L231 HydrophobicContact CG2-CG 3.99Å
209	I	94	Very high	95	Very high	23 Å²	23	46.4 Å²	46.4	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-44.9	-179.9	-57.7	-177.1	0	0	0	110.5	T207 T211 L212 Y213 L231 F242 L243 Q246 L249	T207-I209 VanDerWaalsContact C-N 3.34Å; T207-I209 PolarHBondContact O-N 3.2Å; I209-T211 VanDerWaalsContact C-N 3.32Å; I209-T211 PolarHBondContact O-N 3.18Å; I209-L212 WeakPolarHBondContact O-CB 3.37Å; I209-L212 PolarHBondContact O-N 3.09Å; I209-Y213 PolarHBondContact O-N 3.4Å; I209-L231 HydrophobicContact CG1-CD2 4.38Å; I209-F242 HydrophobicContact CD1-CD1 4.12Å; I209-F242 HydrophobicContact CD1-CE1 3.35Å; I209-F242 HydrophobicContact CD1-CZ 3.96Å; I209-L243 HydrophobicContact CD1-CD2 3.81Å; I209-L243 HydrophobicContact CG1-CD2 4.41Å; I209-Q246 HydrophobicContact CD1-CB 4.14Å; I209-Q246 HydrophobicContact CD1-CG 3.86Å; I209-Q246 HydrophobicContact CG2-CB 4.36Å; I209-Q246 HydrophobicContact CG2-CG 4.49Å; I209-L249 HydrophobicContact CG2-CD1 4.01Å
210	S	93.9	Very high	95.1	Very high	21 Å²	21	42.1 Å²	42.1	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-34.9	175.8	53.3	0	0	0	0	111.5	E185 A188 T207 Y213 V214	E185-S210 WeakPolarHBondContact OE2-CB 3.2Å; E185-S210 PolarHBondContact OE2-OG 3.04Å; A188-S210 VanDerWaalsContact CB-C 3.49Å; T207-S210 PolarHBondContact O-N 2.92Å; T207-S210 PolarHBondContact O-OG 3.14Å; T207-S210 VanDerWaalsContact O-OG 3.08Å; S210-Y213 PolarHBondContact O-N 3Å; S210-V214 VanDerWaalsContact O-CG2 3.31Å; S210-V214 WeakPolarHBondContact O-CG2 3.39Å; S210-V214 PolarHBondContact O-N 3.28Å; S210-V214 VanDerWaalsContact O-N 3.07Å
211	T	96.6	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-42.5	172	-58	0	0	0	0	111.8	I191 L203 T207 V208 I209 V214 A215 L223	I191-T211 HydrophobicContact CB-CG2 4.25Å; I191-T211 HydrophobicContact CG2-CG2 3.65Å; L203-T211 HydrophobicContact CD2-CG2 3.89Å; T207-T211 VanDerWaalsContact O-CB 3.28Å; T207-T211 WeakPolarHBondContact O-CB 3.48Å; T207-T211 PolarHBondContact O-N 3.22Å; T207-T211 PolarHBondContact O-OG1 3.01Å; V208-T211 PolarHBondContact O-N 3.11Å; I209-T211 VanDerWaalsContact C-N 3.32Å; I209-T211 PolarHBondContact O-N 3.18Å; T211-V214 PolarHBondContact O-N 3.5Å; T211-A215 WeakPolarHBondContact O-CB 3.42Å; T211-A215 PolarHBondContact O-N 3.13Å; T211-L223 HydrophobicContact CG2-CD1 4.39Å; T211-L223 HydrophobicContact CG2-CD2 4.32Å; T211-L223 HydrophobicContact CG2-CG 4.48Å
212	L	96.1	Very high	95.2	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-43.6	176	177.2	52.5	0	0	0	111.6	V208 I209 V214 A215 K216 V224 C227 I228 L231 F250	V208-L212 VanDerWaalsContact O-CB 3.3Å; V208-L212 WeakPolarHBondContact O-CB 3.49Å; V208-L212 PolarHBondContact O-N 3.36Å; I209-L212 WeakPolarHBondContact O-CB 3.37Å; I209-L212 PolarHBondContact O-N 3.09Å; L212-V214 VanDerWaalsContact C-N 3.34Å; L212-V214 PolarHBondContact O-N 3.13Å; L212-A215 PolarHBondContact O-N 3.26Å; L212-K216 HydrophobicContact CD1-CD 4.46Å; L212-K216 HydrophobicContact CD1-CG 4.2Å; L212-K216 PolarHBondContact O-N 2.84Å; L212-V224 HydrophobicContact CD1-CB 4.27Å; L212-V224 HydrophobicContact CD1-CG1 3.86Å; L212-V224 HydrophobicContact CD1-CG2 4.34Å; L212-C227 HydrophobicContact CB-CB 3.86Å; L212-C227 HydrophobicContact CD1-CB 3.96Å; L212-C227 HydrophobicContact CD2-CB 4.42Å; L212-C227 HydrophobicContact CG-CB 4.3Å; L212-I228 HydrophobicContact CD1-CG1 4.27Å; L212-I228 HydrophobicContact CD2-CG1 4.33Å; L212-L231 HydrophobicContact CD2-CD1 3.8Å; L212-F250 HydrophobicContact CD2-CB 3.44Å; L212-F250 VanDerWaalsContact CD2-CB 3.44Å; L212-F250 HydrophobicContact CD2-CG 4.31Å; L212-F250 HydrophobicContact CG-CB 4.26Å
213	Y	94.9	Very high	95.4	Very high	87 Å²	87	46.3 Å²	46.3	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-55.9	-49	174.1	172.4	-102	0	0	0	111.4	D183 V184 I209 S210 K216 K217	D183-Y213 PolarHBondContact OD2-OH 3.41Å; V184-Y213 HydrophobicContact CG2-CD1 4.36Å; V184-Y213 HydrophobicContact CG2-CE1 3.96Å; I209-Y213 PolarHBondContact O-N 3.4Å; S210-Y213 PolarHBondContact O-N 3Å; Y213-K216 PolarHBondContact O-N 3.44Å; Y213-K217 HydrophobicContact CE1-CD 4.21Å; Y213-K217 VanDerWaalsContact O-CB 3.31Å; Y213-K217 WeakPolarHBondContact O-CB 3.3Å; Y213-K217 PolarHBondContact O-N 2.68Å
214	V	96	Very high	95.3	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-44.2	178.3	173.8	0	0	0	0	111.4	V184 A188 F189 M192 S210 T211 L212 K216 K217 Y218	V184-V214 HydrophobicContact CB-CG2 4.15Å; V184-V214 HydrophobicContact CG1-CG2 3.25Å; V184-V214 HydrophobicContact CG2-CG2 3.81Å; A188-V214 HydrophobicContact CB-CG2 4.01Å; F189-V214 HydrophobicContact CD2-CG1 4.46Å; M192-V214 HydrophobicContact CB-CG1 3.8Å; M192-V214 HydrophobicContact CE-CG1 4.06Å; M192-V214 HydrophobicContact CG-CG1 4.01Å; M192-V214 HydrophobicContact SD-CG1 3.36Å; M192-V214 WeakPolarHBondContact SD-CG1 3.45Å; S210-V214 VanDerWaalsContact O-CG2 3.31Å; S210-V214 WeakPolarHBondContact O-CG2 3.39Å; S210-V214 PolarHBondContact O-N 3.28Å; S210-V214 VanDerWaalsContact O-N 3.07Å; T211-V214 PolarHBondContact O-N 3.5Å; L212-V214 VanDerWaalsContact C-N 3.34Å; L212-V214 PolarHBondContact O-N 3.13Å; V214-K216 VanDerWaalsContact C-N 3.32Å; V214-K216 PolarHBondContact O-N 2.83Å; V214-K217 PolarHBondContact O-N 2.85Å; V214-Y218 HydrophobicContact CG1-CD2 3.73Å; V214-Y218 HydrophobicContact CG1-CE2 3.96Å; V214-Y218 VanDerWaalsContact O-CD2 3.27Å; V214-Y218 WeakPolarHBondContact O-CD2 3.42Å; V214-Y218 PolarHBondContact O-N 3.31Å
215	A	96.9	Very high	95.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-40.9	178.5	0	0	0	0	0	111.8	T211 L212 L219 I220 L223 V224	T211-A215 WeakPolarHBondContact O-CB 3.42Å; T211-A215 PolarHBondContact O-N 3.13Å; L212-A215 PolarHBondContact O-N 3.26Å; A215-L219 PolarHBondContact O-N 2.92Å; A215-I220 PolarHBondContact O-N 3.15Å; A215-L223 HydrophobicContact CB-CB 4.02Å; A215-L223 HydrophobicContact CB-CD2 3.82Å; A215-L223 HydrophobicContact CB-CG 3.76Å; A215-V224 HydrophobicContact CB-CG2 3.61Å
216	K	95.3	Very high	95.7	Very high	56 Å²	56	47.2 Å²	47.2	24%	0.243	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-47.5	173.2	-73.4	-164.6	176.7	-130.9	0	111.5	L212 Y213 V214 Y218 L219 V224 F250 E252	L212-K216 HydrophobicContact CD1-CD 4.46Å; L212-K216 HydrophobicContact CD1-CG 4.2Å; L212-K216 PolarHBondContact O-N 2.84Å; Y213-K216 PolarHBondContact O-N 3.44Å; V214-K216 VanDerWaalsContact C-N 3.32Å; V214-K216 PolarHBondContact O-N 2.83Å; K216-Y218 PolarHBondContact O-N 2.74Å; K216-L219 WeakPolarHBondContact O-CD2 3.42Å; K216-L219 PolarHBondContact O-N 3.36Å; K216-V224 HydrophobicContact CB-CG2 4.45Å; K216-V224 HydrophobicContact CG-CG1 4.2Å; K216-V224 HydrophobicContact CG-CG2 3.68Å; K216-F250 VanDerWaalsContact CE-O 3.24Å; K216-F250 WeakPolarHBondContact CE-O 3.46Å; K216-F250 PolarHBondContact NZ-O 3.41Å; K216-E252 IonicContact NZ-OE1 3Å; K216-E252 PolarHBondContact NZ-OE1 3.28Å
217	K	95.4	Very high	95.9	Very high	73 Å²	73	40.2 Å²	40.2	32%	0.317	18%	0.184	S	C	.	.	H	α-helix	trans	-54.7	-38.3	179.2	-179.5	174.6	179.2	175.2	0	112.7	D183 V184 Y213 V214	D183-K217 IonicContact OD1-NZ 3.62Å; D183-K217 PolarHBondContact OD1-NZ 3.21Å; D183-K217 IonicContact OD2-NZ 3.11Å; D183-K217 PolarHBondContact OD2-NZ 3.39Å; V184-K217 HydrophobicContact CG2-CD 4.3Å; Y213-K217 HydrophobicContact CE1-CD 4.21Å; Y213-K217 VanDerWaalsContact O-CB 3.31Å; Y213-K217 WeakPolarHBondContact O-CB 3.3Å; Y213-K217 PolarHBondContact O-N 2.68Å; V214-K217 PolarHBondContact O-N 2.85Å
218	Y	97	Very high	95.9	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.027	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	10.8	179.1	-63.5	-72.8	0	0	0	113.9	S162 V164 F165 F189 M192 V214 K216 I220	S162-Y218 WeakPolarHBondContact CB-O 3.3Å; S162-Y218 PolarHBondContact OG-O 3Å; V164-Y218 HydrophobicContact CB-CD1 4.28Å; V164-Y218 HydrophobicContact CG1-CD1 4Å; V164-Y218 HydrophobicContact CG1-CE1 4.5Å; F165-Y218 HydrophobicContact CD1-CD1 4.11Å; F165-Y218 HydrophobicContact CD1-CE1 4.14Å; F165-Y218 HydrophobicContact CD2-CD1 4.34Å; F165-Y218 AromaticContact CE1-CD1 3.51Å; F165-Y218 HydrophobicContact CE1-CD1 3.51Å; F165-Y218 AromaticContact CE1-CE1 3.26Å; F165-Y218 HydrophobicContact CE1-CE1 3.26Å; F165-Y218 HydrophobicContact CE1-CG 4.45Å; F165-Y218 AromaticContact CE2-CD1 3.77Å; F165-Y218 HydrophobicContact CE2-CD1 3.77Å; F165-Y218 HydrophobicContact CE2-CE1 4.24Å; F165-Y218 AromaticContact CE2-CG 4Å; F165-Y218 HydrophobicContact CE2-CG 4Å; F165-Y218 HydrophobicContact CG-CD1 4.48Å; F165-Y218 AromaticContact CZ-CD1 3.31Å; F165-Y218 HydrophobicContact CZ-CD1 3.31Å; F165-Y218 HydrophobicContact CZ-CD2 4.27Å; F165-Y218 AromaticContact CZ-CE1 3.32Å; F165-Y218 HydrophobicContact CZ-CE1 3.32Å; F165-Y218 HydrophobicContact CZ-CE2 4.27Å; F165-Y218 AromaticContact CZ-CG 3.82Å; F165-Y218 HydrophobicContact CZ-CG 3.82Å; F165-Y218 AromaticContact CZ-CZ 3.82Å; F189-Y218 HydrophobicContact CD2-CE2 4.32Å; F189-Y218 AromaticContact CE2-CE2 3.99Å; F189-Y218 HydrophobicContact CE2-CE2 3.99Å; M192-Y218 HydrophobicContact CE-CD2 4.05Å; M192-Y218 HydrophobicContact CE-CE2 4.25Å; M192-Y218 HydrophobicContact SD-CD2 3.43Å; M192-Y218 WeakPolarHBondContact SD-CD2 3.27Å; M192-Y218 HydrophobicContact SD-CE2 4.18Å; M192-Y218 HydrophobicContact SD-CG 3.92Å; V214-Y218 HydrophobicContact CG1-CD2 3.73Å; V214-Y218 HydrophobicContact CG1-CE2 3.96Å; V214-Y218 VanDerWaalsContact O-CD2 3.27Å; V214-Y218 WeakPolarHBondContact O-CD2 3.42Å; V214-Y218 PolarHBondContact O-N 3.31Å; K216-Y218 PolarHBondContact O-N 2.74Å; Y218-I220 PolarHBondContact O-N 2.99Å
219	L	97.1	Very high	95.9	Very high	105 Å²	105	43.9 Å²	43.9	55%	0.55	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	44	175.3	-57.4	178.3	0	0	0	114.4	T163 V164 A215 K216 E221	T163-L219 WeakPolarHBondContact OG1-CD1 3.37Å; V164-L219 HydrophobicContact CG2-CB 4.21Å; V164-L219 HydrophobicContact CG2-CD1 3.75Å; V164-L219 HydrophobicContact CG2-CG 3.76Å; A215-L219 PolarHBondContact O-N 2.92Å; K216-L219 WeakPolarHBondContact O-CD2 3.42Å; K216-L219 PolarHBondContact O-N 3.36Å; L219-E221 PolarHBondContact O-N 2.89Å
220	I	97.6	Very high	96	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	21%	0.205	C	C	.	.			trans	-95.9	81.1	178.2	-55	171.8	0	0	0	108.6	M192 Y195 L196 A215 Y218 Y222 L223 V224	M192-I220 HydrophobicContact CG-CD1 3.36Å; M192-I220 HydrophobicContact SD-CD1 3.51Å; M192-I220 VanDerWaalsContact SD-CD1 3.51Å; Y195-I220 HydrophobicContact CD1-CG2 3.76Å; Y195-I220 HydrophobicContact CE1-CG2 3.3Å; L196-I220 HydrophobicContact CD1-CD1 4.09Å; L196-I220 HydrophobicContact CD2-CD1 3.94Å; L196-I220 HydrophobicContact CG-CD1 4.13Å; A215-I220 PolarHBondContact O-N 3.15Å; Y218-I220 PolarHBondContact O-N 2.99Å; I220-Y222 VanDerWaalsContact C-N 3.32Å; I220-Y222 PolarHBondContact O-N 2.99Å; I220-L223 HydrophobicContact CB-CB 4.21Å; I220-L223 HydrophobicContact CG2-CB 3.62Å; I220-L223 PolarHBondContact O-N 3.34Å; I220-L223 VanDerWaalsContact O-N 3.11Å; I220-V224 WeakPolarHBondContact O-CG2 3.38Å; I220-V224 PolarHBondContact O-N 3.14Å
221	E	95.3	Very high	96	Very high	130 Å²	130	43.9 Å²	43.9	61%	0.607	20%	0.199	S	C	*	.	H	α-helix	trans	-55.9	-40.4	-169.1	-66.1	-173.1	-174.5	0	0	114.4	L219 V224 R225	L219-E221 PolarHBondContact O-N 2.89Å; E221-V224 WeakPolarHBondContact O-CB 3.5Å; E221-V224 PolarHBondContact O-N 3.28Å; E221-R225 WeakPolarHBondContact O-CG 3.3Å; E221-R225 PolarHBondContact O-N 3.13Å; E221-R225 IonicContact OE2-NH2 2.91Å; E221-R225 PolarHBondContact OE2-NH2 3.46Å; E221-R225 VanDerWaalsContact OE2-NH2 3.11Å
222	Y	96.6	Very high	95.7	Very high	132 Å²	132	45.3 Å²	45.3	52%	0.518	21%	0.206	S	C	.	.	H	α-helix	trans	-67.4	-39.8	-179.2	-176.3	-91.4	0	0	0	111.6	Y195 V201 I220 R225 A226	Y195-Y222 AromaticContact CE2-CD1 3.66Å; Y195-Y222 HydrophobicContact CE2-CD1 3.66Å; Y195-Y222 HydrophobicContact CE2-CE1 4.17Å; Y195-Y222 AromaticContact CZ-CD1 3.81Å; Y195-Y222 WeakPolarHBondContact OH-CB 3.28Å; Y195-Y222 WeakPolarHBondContact OH-CD1 3.48Å; V201-Y222 HydrophobicContact CG2-CE1 4.14Å; I220-Y222 VanDerWaalsContact C-N 3.32Å; I220-Y222 PolarHBondContact O-N 2.99Å; Y222-R225 PolarHBondContact O-N 2.64Å; Y222-A226 WeakPolarHBondContact O-CB 3.42Å; Y222-A226 PolarHBondContact O-N 3.25Å
223	L	97.6	Very high	95.5	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-37.5	175.8	-176.4	59.9	0	0	0	111.1	M192 Y195 V201 T211 A215 I220 A226 C227	M192-L223 HydrophobicContact CB-CD2 4.19Å; M192-L223 HydrophobicContact CG-CD2 4.17Å; Y195-L223 HydrophobicContact CD1-CB 4.18Å; Y195-L223 HydrophobicContact CD1-CD2 4.26Å; Y195-L223 HydrophobicContact CE1-CB 4.28Å; Y195-L223 HydrophobicContact CG-CD1 4.45Å; Y195-L223 HydrophobicContact CG-CD2 4.46Å; V201-L223 HydrophobicContact CG1-CD1 4.04Å; V201-L223 HydrophobicContact CG2-CD1 4.17Å; T211-L223 HydrophobicContact CG2-CD1 4.39Å; T211-L223 HydrophobicContact CG2-CD2 4.32Å; T211-L223 HydrophobicContact CG2-CG 4.48Å; A215-L223 HydrophobicContact CB-CB 4.02Å; A215-L223 HydrophobicContact CB-CD2 3.82Å; A215-L223 HydrophobicContact CB-CG 3.76Å; I220-L223 HydrophobicContact CB-CB 4.21Å; I220-L223 HydrophobicContact CG2-CB 3.62Å; I220-L223 PolarHBondContact O-N 3.34Å; I220-L223 VanDerWaalsContact O-N 3.11Å; L223-A226 PolarHBondContact O-N 2.83Å; L223-C227 PolarHBondContact O-N 2.7Å; L223-C227 PolarHBondContact O-SG 2.97Å
224	V	95.9	Very high	95.4	Very high	18 Å²	18	49.5 Å²	49.5	11%	0.109	24%	0.236	C	C	.	.	H	α-helix	trans	-56.7	-52.7	171.7	170.1	0	0	0	0	110.6	L212 A215 K216 I220 E221 A226 C227 I228	L212-V224 HydrophobicContact CD1-CB 4.27Å; L212-V224 HydrophobicContact CD1-CG1 3.86Å; L212-V224 HydrophobicContact CD1-CG2 4.34Å; A215-V224 HydrophobicContact CB-CG2 3.61Å; K216-V224 HydrophobicContact CB-CG2 4.45Å; K216-V224 HydrophobicContact CG-CG1 4.2Å; K216-V224 HydrophobicContact CG-CG2 3.68Å; I220-V224 WeakPolarHBondContact O-CG2 3.38Å; I220-V224 PolarHBondContact O-N 3.14Å; E221-V224 WeakPolarHBondContact O-CB 3.5Å; E221-V224 PolarHBondContact O-N 3.28Å; V224-A226 VanDerWaalsContact C-N 3.35Å; V224-A226 PolarHBondContact O-N 3.17Å; V224-C227 PolarHBondContact O-N 3.27Å; V224-I228 HydrophobicContact CG1-CD1 3.68Å; V224-I228 WeakPolarHBondContact O-CD1 3.33Å; V224-I228 VanDerWaalsContact O-CG1 3.31Å; V224-I228 WeakPolarHBondContact O-CG1 3.39Å; V224-I228 PolarHBondContact O-N 3.11Å
225	R	95.6	Very high	95.3	Very high	144 Å²	144	50 Å²	50	54%	0.543	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-46	177.7	-70.2	179.1	-167.9	139.5	16	111.8	E221 Y222 C227 I228 D229	E221-R225 WeakPolarHBondContact O-CG 3.3Å; E221-R225 PolarHBondContact O-N 3.13Å; E221-R225 IonicContact OE2-NH2 2.91Å; E221-R225 PolarHBondContact OE2-NH2 3.46Å; E221-R225 VanDerWaalsContact OE2-NH2 3.11Å; Y222-R225 PolarHBondContact O-N 2.64Å; R225-C227 VanDerWaalsContact C-N 3.31Å; R225-C227 PolarHBondContact O-N 2.94Å; R225-I228 PolarHBondContact O-N 3.34Å; R225-I228 VanDerWaalsContact O-N 3.16Å; R225-D229 WeakPolarHBondContact O-CB 3.3Å; R225-D229 VanDerWaalsContact O-CG 3.28Å; R225-D229 PolarHBondContact O-N 2.69Å
226	A	96.9	Very high	95.1	Very high	18 Å²	18	52.9 Å²	52.9	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-37.1	179.3	0	0	0	0	0	112.9	V201 L203 Y222 L223 V224 F230	V201-A226 HydrophobicContact CG1-CB 3.89Å; V201-A226 HydrophobicContact CG2-CB 4.35Å; L203-A226 HydrophobicContact CD1-CB 4.46Å; L203-A226 WeakPolarHBondContact CD1-O 3.49Å; Y222-A226 WeakPolarHBondContact O-CB 3.42Å; Y222-A226 PolarHBondContact O-N 3.25Å; L223-A226 PolarHBondContact O-N 2.83Å; V224-A226 VanDerWaalsContact C-N 3.35Å; V224-A226 PolarHBondContact O-N 3.17Å; A226-F230 WeakPolarHBondContact O-CB 3.35Å; A226-F230 PolarHBondContact O-N 3.18Å
227	C	96.1	Very high	95	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-43.2	174.1	-66	0	0	0	0	111.8	V208 L212 L223 V224 R225 F230 L231	V208-C227 HydrophobicContact CG2-CB 4.01Å; L212-C227 HydrophobicContact CB-CB 3.86Å; L212-C227 HydrophobicContact CD1-CB 3.96Å; L212-C227 HydrophobicContact CD2-CB 4.42Å; L212-C227 HydrophobicContact CG-CB 4.3Å; L223-C227 PolarHBondContact O-N 2.7Å; L223-C227 PolarHBondContact O-SG 2.97Å; V224-C227 PolarHBondContact O-N 3.27Å; R225-C227 VanDerWaalsContact C-N 3.31Å; R225-C227 PolarHBondContact O-N 2.94Å; C227-F230 WeakPolarHBondContact O-CB 3.35Å; C227-F230 PolarHBondContact O-N 3.38Å; C227-L231 VanDerWaalsContact O-CG 3.31Å; C227-L231 WeakPolarHBondContact O-CG 3.37Å; C227-L231 PolarHBondContact O-N 2.87Å
228	I	94.8	Very high	95	Very high	14 Å²	14	55.3 Å²	55.3	7%	0.072	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-45.5	178.4	-63.8	160.6	0	0	0	110.4	L212 V224 R225 F230 L231 Q232 E252	L212-I228 HydrophobicContact CD1-CG1 4.27Å; L212-I228 HydrophobicContact CD2-CG1 4.33Å; V224-I228 HydrophobicContact CG1-CD1 3.68Å; V224-I228 WeakPolarHBondContact O-CD1 3.33Å; V224-I228 VanDerWaalsContact O-CG1 3.31Å; V224-I228 WeakPolarHBondContact O-CG1 3.39Å; V224-I228 PolarHBondContact O-N 3.11Å; R225-I228 PolarHBondContact O-N 3.34Å; R225-I228 VanDerWaalsContact O-N 3.16Å; I228-F230 VanDerWaalsContact C-N 3.29Å; I228-F230 PolarHBondContact O-N 3.03Å; I228-L231 PolarHBondContact O-N 2.84Å; I228-Q232 HydrophobicContact CG2-CG 4.3Å; I228-Q232 WeakPolarHBondContact O-CB 3.35Å; I228-Q232 VanDerWaalsContact O-CG 3.3Å; I228-Q232 WeakPolarHBondContact O-CG 3.38Å; I228-Q232 PolarHBondContact O-N 3.38Å; I228-E252 HydrophobicContact CD1-CG 3.49Å; I228-E252 VanDerWaalsContact CD1-CG 3.49Å; I228-E252 WeakPolarHBondContact CD1-OE1 3.48Å; I228-E252 HydrophobicContact CG1-CG 3.83Å; I228-E252 HydrophobicContact CG2-CG 4.35Å
229	D	94.3	Very high	94.9	Very high	86 Å²	86	57.2 Å²	57.2	46%	0.46	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-41.5	176.2	-69.8	-18.1	0	0	0	111.1	R225 Q232 N233	R225-D229 WeakPolarHBondContact O-CB 3.3Å; R225-D229 VanDerWaalsContact O-CG 3.28Å; R225-D229 PolarHBondContact O-N 2.69Å; D229-Q232 PolarHBondContact O-N 3.42Å; D229-N233 WeakPolarHBondContact O-CB 3.28Å; D229-N233 PolarHBondContact O-N 3.05Å; D229-N233 PolarHBondContact O-ND2 3.36Å
230	F	95.4	Very high	94.8	Very high	40 Å²	40	52.2 Å²	52.2	18%	0.175	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-47	175.3	-177.7	-84.9	0	0	0	111.8	L203 P205 V208 A226 C227 I228 Q232 N233 S234	L203-F230 HydrophobicContact CB-CD1 4.5Å; L203-F230 HydrophobicContact CB-CD2 3.81Å; L203-F230 HydrophobicContact CB-CE2 4.04Å; L203-F230 HydrophobicContact CB-CG 4.04Å; L203-F230 HydrophobicContact CB-CZ 4.48Å; L203-F230 HydrophobicContact CD1-CB 3.65Å; L203-F230 HydrophobicContact CD1-CD2 4.26Å; L203-F230 HydrophobicContact CD1-CG 4.04Å; P205-F230 HydrophobicContact CG-CE1 4.31Å; P205-F230 HydrophobicContact CG-CZ 4.01Å; V208-F230 HydrophobicContact CB-CD1 4.03Å; V208-F230 HydrophobicContact CB-CE1 4.2Å; V208-F230 HydrophobicContact CG1-CD1 4.09Å; V208-F230 HydrophobicContact CG1-CE1 4.08Å; V208-F230 HydrophobicContact CG2-CB 4.45Å; V208-F230 HydrophobicContact CG2-CD1 3.75Å; V208-F230 HydrophobicContact CG2-CE1 4.43Å; V208-F230 HydrophobicContact CG2-CG 4.38Å; A226-F230 WeakPolarHBondContact O-CB 3.35Å; A226-F230 PolarHBondContact O-N 3.18Å; C227-F230 WeakPolarHBondContact O-CB 3.35Å; C227-F230 PolarHBondContact O-N 3.38Å; I228-F230 VanDerWaalsContact C-N 3.29Å; I228-F230 PolarHBondContact O-N 3.03Å; F230-Q232 VanDerWaalsContact C-N 3.35Å; F230-Q232 PolarHBondContact O-N 3.49Å; F230-N233 PolarHBondContact O-N 2.77Å; F230-S234 WeakPolarHBondContact O-CB 3.3Å; F230-S234 PolarHBondContact O-N 3.08Å; F230-S234 PolarHBondContact O-OG 2.95Å
231	L	94.3	Very high	94.8	Very high	4 Å²	4	52 Å²	52	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-42.3	177.7	-73.9	173.6	0	0	0	111.9	V208 I209 L212 C227 I228 S234 L235 L243 L255	V208-L231 HydrophobicContact CG1-CD2 3.54Å; V208-L231 HydrophobicContact CG1-CG 4.28Å; V208-L231 HydrophobicContact CG2-CD2 4.19Å; V208-L231 HydrophobicContact CG2-CG 3.99Å; I209-L231 HydrophobicContact CG1-CD2 4.38Å; L212-L231 HydrophobicContact CD2-CD1 3.8Å; C227-L231 VanDerWaalsContact O-CG 3.31Å; C227-L231 WeakPolarHBondContact O-CG 3.37Å; C227-L231 PolarHBondContact O-N 2.87Å; I228-L231 PolarHBondContact O-N 2.84Å; L231-S234 PolarHBondContact O-N 3.22Å; L231-L235 PolarHBondContact O-N 2.98Å; L231-L235 VanDerWaalsContact O-N 3.11Å; L231-L243 HydrophobicContact CD2-CD2 3.61Å; L231-L255 HydrophobicContact CB-CD2 3.88Å; L231-L255 HydrophobicContact CD1-CD2 4Å
232	Q	91.5	Very high	94.7	Very high	30 Å²	30	49.4 Å²	49.4	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-41.9	177.2	-75.7	-177.1	-3.5	0	0	112.2	I228 D229 F230 L255	I228-Q232 HydrophobicContact CG2-CG 4.3Å; I228-Q232 WeakPolarHBondContact O-CB 3.35Å; I228-Q232 VanDerWaalsContact O-CG 3.3Å; I228-Q232 WeakPolarHBondContact O-CG 3.38Å; I228-Q232 PolarHBondContact O-N 3.38Å; D229-Q232 PolarHBondContact O-N 3.42Å; F230-Q232 VanDerWaalsContact C-N 3.35Å; F230-Q232 PolarHBondContact O-N 3.49Å; Q232-L255 HydrophobicContact CG-CB 4.46Å; Q232-L255 HydrophobicContact CG-CD1 3.81Å
233	N	91.3	Very high	94.6	Very high	141 Å²	141	43.4 Å²	43.4	75%	0.754	22%	0.217	S	C	*	.	H	α-helix	trans	-78.5	-20.8	-178.6	-69.8	-39.2	0	0	0	113.7	D229 F230	D229-N233 WeakPolarHBondContact O-CB 3.28Å; D229-N233 PolarHBondContact O-N 3.05Å; D229-N233 PolarHBondContact O-ND2 3.36Å; F230-N233 PolarHBondContact O-N 2.77Å
234	S	92.3	Very high	94.4	Very high	35 Å²	35	43.7 Å²	43.7	25%	0.245	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	6.7	177.4	60.3	0	0	0	0	113.4	F230 L231 T236 N239	F230-S234 WeakPolarHBondContact O-CB 3.3Å; F230-S234 PolarHBondContact O-N 3.08Å; F230-S234 PolarHBondContact O-OG 2.95Å; L231-S234 PolarHBondContact O-N 3.22Å; S234-T236 PolarHBondContact O-N 3.32Å; S234-N239 PolarHBondContact O-ND2 3.48Å
235	L	93.3	Very high	94.3	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	22%	0.218	C	C	.	.			trans	-67.1	125.6	178.4	-175.7	64.4	0	0	0	110.8	L231 V240 L243 R258 M262	L231-L235 PolarHBondContact O-N 2.98Å; L231-L235 VanDerWaalsContact O-N 3.11Å; L235-V240 HydrophobicContact CD1-CB 4.04Å; L235-V240 HydrophobicContact CD1-CG2 3.99Å; L235-L243 HydrophobicContact CD1-CD1 3.59Å; L235-R258 HydrophobicContact CD2-CB 3.86Å; L235-M262 HydrophobicContact CD1-SD 4.32Å; L235-M262 HydrophobicContact CD2-CE 4.33Å; L235-M262 HydrophobicContact CD2-SD 4.4Å; L235-M262 HydrophobicContact CG-CE 3.95Å; L235-M262 HydrophobicContact CG-SD 3.84Å
236	T	93.7	Very high	94.1	Very high	61 Å²	61	39.1 Å²	39.1	37%	0.374	20%	0.204	S	C	.	.			trans	-143	161	178.6	67.2	0	0	0	0	110.8	S234 K238 N239 V240 M262	S234-T236 PolarHBondContact O-N 3.32Å; T236-K238 PolarHBondContact O-N 2.9Å; T236-K238 PolarHBondContact OG1-N 3.11Å; T236-N239 PolarHBondContact N-OD1 3.35Å; T236-N239 PolarHBondContact O-N 3.46Å; T236-N239 VanDerWaalsContact O-N 3.1Å; T236-N239 PolarHBondContact O-OD1 3.11Å; T236-N239 PolarHBondContact OG1-OD1 3.45Å; T236-V240 WeakPolarHBondContact O-CB 3.49Å; T236-V240 PolarHBondContact O-N 2.68Å; T236-M262 VanDerWaalsContact CA-SD 3.55Å; T236-M262 VanDerWaalsContact O-SD 3.41Å
237	S	94.1	Very high	93.7	Very high	18 Å²	18	39.5 Å²	39.5	13%	0.126	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-18.7	175.8	48.9	0	0	0	0	113.1	M262 Q266 A270	S237-M262 PolarHBondContact N-SD 2.88Å; S237-Q266 PolarHBondContact OG-OE1 2.95Å; S237-A270 WeakPolarHBondContact O-CA 3.41Å
238	K	94.5	Very high	93.2	Very high	162 Å²	162	45.8 Å²	45.8	70%	0.704	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-25.1	178.8	-63.3	-176.1	178.7	-177.3	0	114.7	T236 S275	T236-K238 PolarHBondContact O-N 2.9Å; T236-K238 PolarHBondContact OG1-N 3.11Å; K238-S275 WeakPolarHBondContact O-CB 3.21Å; K238-S275 PolarHBondContact O-OG 2.78Å
239	N	94.7	Very high	92.6	Very high	46 Å²	46	49 Å²	49	25%	0.246	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-8.5	-176.9	65.9	8.4	0	0	0	113.5	S234 T236 C241 F242 L243	S234-N239 PolarHBondContact O-ND2 3.48Å; T236-N239 PolarHBondContact N-OD1 3.35Å; T236-N239 PolarHBondContact O-N 3.46Å; T236-N239 VanDerWaalsContact O-N 3.1Å; T236-N239 PolarHBondContact O-OD1 3.11Å; T236-N239 PolarHBondContact OG1-OD1 3.45Å; N239-C241 VanDerWaalsContact C-N 3.34Å; N239-C241 PolarHBondContact O-N 2.95Å; N239-F242 PolarHBondContact O-N 3.32Å; N239-L243 PolarHBondContact O-N 3.12Å
240	V	96.1	Very high	92	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-38.6	-173.4	65.3	0	0	0	0	113.8	L235 T236 L243 L244 C259 M262 I263 A270	L235-V240 HydrophobicContact CD1-CB 4.04Å; L235-V240 HydrophobicContact CD1-CG2 3.99Å; T236-V240 WeakPolarHBondContact O-CB 3.49Å; T236-V240 PolarHBondContact O-N 2.68Å; V240-L243 PolarHBondContact O-N 2.91Å; V240-L244 WeakPolarHBondContact O-CB 3.18Å; V240-L244 PolarHBondContact O-N 2.93Å; V240-C259 HydrophobicContact CG2-CB 3.65Å; V240-C259 VanDerWaalsContact CG2-O 3.27Å; V240-C259 WeakPolarHBondContact CG2-O 3.46Å; V240-M262 HydrophobicContact CB-CG 4.46Å; V240-M262 HydrophobicContact CB-SD 3.95Å; V240-M262 HydrophobicContact CG1-CG 4.44Å; V240-M262 HydrophobicContact CG1-SD 4.36Å; V240-M262 HydrophobicContact CG2-CB 4.29Å; V240-M262 HydrophobicContact CG2-CG 4.4Å; V240-M262 HydrophobicContact CG2-SD 4.22Å; V240-I263 HydrophobicContact CB-CG1 4.4Å; V240-I263 HydrophobicContact CG1-CD1 4.48Å; V240-I263 HydrophobicContact CG1-CG1 3.77Å; V240-I263 HydrophobicContact CG2-CD1 3.93Å; V240-I263 HydrophobicContact CG2-CG1 3.7Å; V240-A270 HydrophobicContact CG1-CB 3.84Å
241	C	97	Very high	91.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.007	25%	0.25	C	S	.	.	H	α-helix	trans	-67.9	-41.5	-179.1	-61.8	0	0	0	0	110.9	N239 L244 S245 S275 F276 V279	N239-C241 VanDerWaalsContact C-N 3.34Å; N239-C241 PolarHBondContact O-N 2.95Å; C241-L244 PolarHBondContact O-N 3.22Å; C241-S245 PolarHBondContact O-N 3.28Å; C241-S275 WeakPolarHBondContact CB-OG 3.33Å; C241-F276 HydrophobicContact CB-CB 4.31Å; C241-F276 HydrophobicContact CB-CD2 4.4Å; C241-V279 HydrophobicContact CB-CG1 3.73Å; C241-V279 WeakPolarHBondContact O-CG1 3.14Å
242	F	93.3	Very high	91.4	Very high	76 Å²	76	52.9 Å²	52.9	33%	0.333	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-49.5	173.5	174.5	-108.5	0	0	0	110.8	I209 N239 L244 S245 Q246	I209-F242 HydrophobicContact CD1-CD1 4.12Å; I209-F242 HydrophobicContact CD1-CE1 3.35Å; I209-F242 HydrophobicContact CD1-CZ 3.96Å; N239-F242 PolarHBondContact O-N 3.32Å; F242-L244 VanDerWaalsContact C-N 3.27Å; F242-L244 PolarHBondContact O-N 3.3Å; F242-S245 WeakPolarHBondContact O-CB 3.37Å; F242-S245 PolarHBondContact O-N 2.82Å; F242-S245 PolarHBondContact O-OG 3.19Å; F242-Q246 HydrophobicContact CD2-CG 4.45Å; F242-Q246 HydrophobicContact CE1-CG 4.27Å; F242-Q246 HydrophobicContact CE2-CG 4.07Å; F242-Q246 HydrophobicContact CZ-CG 3.97Å; F242-Q246 WeakPolarHBondContact O-CG 3.31Å; F242-Q246 PolarHBondContact O-N 3.31Å; F242-Q246 VanDerWaalsContact O-N 3.12Å
243	L	93.8	Very high	91.4	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-38.2	177.8	-71.5	178.4	0	0	0	112.8	I209 L231 L235 N239 V240 Q246 S247 F250	I209-L243 HydrophobicContact CD1-CD2 3.81Å; I209-L243 HydrophobicContact CG1-CD2 4.41Å; L231-L243 HydrophobicContact CD2-CD2 3.61Å; L235-L243 HydrophobicContact CD1-CD1 3.59Å; N239-L243 PolarHBondContact O-N 3.12Å; V240-L243 PolarHBondContact O-N 2.91Å; L243-Q246 CarbonylContact O-C 3.5Å; L243-Q246 PolarHBondContact O-N 3.4Å; L243-S247 PolarHBondContact O-N 2.78Å; L243-F250 WeakPolarHBondContact O-CE1 3.32Å
244	L	94.5	Very high	91.4	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-40.9	174.7	-178.6	67.8	0	0	0	111.8	V240 C241 F242 Q246 S247 V256 C259 W260 I263 T283 I287	V240-L244 WeakPolarHBondContact O-CB 3.18Å; V240-L244 PolarHBondContact O-N 2.93Å; C241-L244 PolarHBondContact O-N 3.22Å; F242-L244 VanDerWaalsContact C-N 3.27Å; F242-L244 PolarHBondContact O-N 3.3Å; L244-Q246 PolarHBondContact O-N 2.74Å; L244-S247 WeakPolarHBondContact O-CB 3.35Å; L244-S247 PolarHBondContact O-N 3.12Å; L244-S247 PolarHBondContact O-OG 3.35Å; L244-V256 HydrophobicContact CD1-CG1 4.19Å; L244-C259 HydrophobicContact CB-CB 4.45Å; L244-C259 HydrophobicContact CD1-CB 4.39Å; L244-W260 HydrophobicContact CD1-CD2 4.29Å; L244-W260 HydrophobicContact CD1-CH2 4.47Å; L244-W260 HydrophobicContact CD1-CZ2 3.77Å; L244-W260 HydrophobicContact CD2-CD2 4.31Å; L244-W260 HydrophobicContact CD2-CE3 4.15Å; L244-W260 HydrophobicContact CD2-CH2 3.35Å; L244-W260 HydrophobicContact CD2-CZ2 3.52Å; L244-W260 HydrophobicContact CD2-CZ3 3.68Å; L244-W260 HydrophobicContact CG-CH2 4.46Å; L244-W260 HydrophobicContact CG-CZ2 4.19Å; L244-I263 HydrophobicContact CB-CD1 4.36Å; L244-I263 HydrophobicContact CD2-CD1 3.51Å; L244-I263 HydrophobicContact CG-CD1 4.49Å; L244-T283 HydrophobicContact CD2-CG2 3.88Å; L244-T283 HydrophobicContact CG-CG2 4.12Å; L244-I287 HydrophobicContact CD2-CD1 4.32Å; L244-I287 HydrophobicContact CD2-CG1 4.21Å
245	S	92.6	Very high	91.4	Very high	15 Å²	15	56.8 Å²	56.8	11%	0.105	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-30.4	175.5	78.2	0	0	0	0	112.4	C241 F242 S247	C241-S245 PolarHBondContact O-N 3.28Å; F242-S245 WeakPolarHBondContact O-CB 3.37Å; F242-S245 PolarHBondContact O-N 2.82Å; F242-S245 PolarHBondContact O-OG 3.19Å; S245-S247 VanDerWaalsContact C-N 3.34Å
246	Q	90.8	Very high	91.4	Very high	52 Å²	52	57.6 Å²	57.6	24%	0.243	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	2.2	177.5	-55.7	-51.7	-60.8	0	0	113.4	I209 F242 L243 L244 R248 L249 F250	I209-Q246 HydrophobicContact CD1-CB 4.14Å; I209-Q246 HydrophobicContact CD1-CG 3.86Å; I209-Q246 HydrophobicContact CG2-CB 4.36Å; I209-Q246 HydrophobicContact CG2-CG 4.49Å; F242-Q246 HydrophobicContact CD2-CG 4.45Å; F242-Q246 HydrophobicContact CE1-CG 4.27Å; F242-Q246 HydrophobicContact CE2-CG 4.07Å; F242-Q246 HydrophobicContact CZ-CG 3.97Å; F242-Q246 WeakPolarHBondContact O-CG 3.31Å; F242-Q246 PolarHBondContact O-N 3.31Å; F242-Q246 VanDerWaalsContact O-N 3.12Å; L243-Q246 CarbonylContact O-C 3.5Å; L243-Q246 PolarHBondContact O-N 3.4Å; L244-Q246 PolarHBondContact O-N 2.74Å; Q246-R248 PolarHBondContact O-N 3.2Å; Q246-R248 VanDerWaalsContact O-N 3.11Å; Q246-L249 HydrophobicContact CB-CD1 4.36Å; Q246-L249 WeakPolarHBondContact O-CB 3.35Å; Q246-L249 PolarHBondContact O-N 3.1Å; Q246-F250 WeakPolarHBondContact O-CD1 3.19Å
247	S	89.8	Confident	91.5	Very high	25 Å²	25	56.8 Å²	56.8	18%	0.175	28%	0.276	C	S	.	.	H	α-helix	trans	-54.8	-33.8	-175.4	55.4	0	0	0	0	115.2	L243 L244 S245 L249 F250 E251	L243-S247 PolarHBondContact O-N 2.78Å; L244-S247 WeakPolarHBondContact O-CB 3.35Å; L244-S247 PolarHBondContact O-N 3.12Å; L244-S247 PolarHBondContact O-OG 3.35Å; S245-S247 VanDerWaalsContact C-N 3.34Å; S247-L249 PolarHBondContact O-N 2.89Å; S247-F250 VanDerWaalsContact CA-CE1 3.47Å; S247-F250 VanDerWaalsContact CA-CZ 3.42Å; S247-F250 PolarHBondContact O-N 3.16Å; S247-E251 PolarHBondContact O-N 2.7Å
248	R	85.5	Confident	91.4	Very high	133 Å²	133	58.9 Å²	58.9	50%	0.502	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-28.7	177.9	-61.9	171.5	-175.2	-157.9	-17	112.9	Q246 E282	Q246-R248 PolarHBondContact O-N 3.2Å; Q246-R248 VanDerWaalsContact O-N 3.11Å; R248-E282 IonicContact CZ-OE1 3.89Å; R248-E282 IonicContact CZ-OE2 2.77Å; R248-E282 IonicContact NH1-OE1 3.02Å; R248-E282 IonicContact NH1-OE2 3.87Å; R248-E282 PolarHBondContact NH1-OE2 3.39Å; R248-E282 IonicContact NH2-OE1 3.38Å; R248-E282 PolarHBondContact NH2-OE1 2.6Å; R248-E282 IonicContact NH2-OE2 3.88Å; R248-E282 PolarHBondContact NH2-OE2 3.15Å
249	L	82	Confident	91.4	Very high	81 Å²	81	51.2 Å²	51.2	42%	0.424	25%	0.248	S	C	.	.	H	α-helix	trans	-74	-33.9	-178.4	-64.5	178.8	0	0	0	112	I209 Q246 S247	I209-L249 HydrophobicContact CG2-CD1 4.01Å; Q246-L249 HydrophobicContact CB-CD1 4.36Å; Q246-L249 WeakPolarHBondContact O-CB 3.35Å; Q246-L249 PolarHBondContact O-N 3.1Å; S247-L249 PolarHBondContact O-N 2.89Å
250	F	82.8	Confident	91.5	Very high	1 Å²	1	51 Å²	51	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-101.5	-20.2	-175.9	56.8	-107	0	0	0	114	L212 K216 L243 Q246 S247 E252 L255 V256	L212-F250 HydrophobicContact CD2-CB 3.44Å; L212-F250 VanDerWaalsContact CD2-CB 3.44Å; L212-F250 HydrophobicContact CD2-CG 4.31Å; L212-F250 HydrophobicContact CG-CB 4.26Å; K216-F250 VanDerWaalsContact CE-O 3.24Å; K216-F250 WeakPolarHBondContact CE-O 3.46Å; K216-F250 PolarHBondContact NZ-O 3.41Å; L243-F250 WeakPolarHBondContact O-CE1 3.32Å; Q246-F250 WeakPolarHBondContact O-CD1 3.19Å; S247-F250 VanDerWaalsContact CA-CE1 3.47Å; S247-F250 VanDerWaalsContact CA-CZ 3.42Å; S247-F250 PolarHBondContact O-N 3.16Å; F250-E252 HydrophobicContact CB-CG 4.31Å; F250-E252 HydrophobicContact CD2-CB 3.67Å; F250-E252 HydrophobicContact CD2-CG 3.94Å; F250-E252 HydrophobicContact CE2-CB 4.17Å; F250-E252 WeakPolarHBondContact O-CG 3.34Å; F250-E252 PolarHBondContact O-N 2.86Å; F250-E252 VanDerWaalsContact O-N 3.11Å; F250-L255 HydrophobicContact CD1-CD2 4.49Å; F250-L255 HydrophobicContact CD2-CD2 3.98Å; F250-L255 HydrophobicContact CE1-CD2 4.08Å; F250-L255 HydrophobicContact CE2-CB 3.94Å; F250-L255 HydrophobicContact CE2-CD2 3.54Å; F250-L255 HydrophobicContact CE2-CG 3.75Å; F250-L255 HydrophobicContact CG-CD2 4.43Å; F250-L255 HydrophobicContact CZ-CB 4.5Å; F250-L255 HydrophobicContact CZ-CD2 3.57Å; F250-L255 HydrophobicContact CZ-CG 3.82Å; F250-V256 HydrophobicContact CE2-CG2 3.78Å; F250-V256 HydrophobicContact CZ-CG2 4.29Å
251	E	86	Confident	91.5	Very high	156 Å²	156	55.4 Å²	55.4	73%	0.729	26%	0.264	S	S	*	.			trans	54.2	32.1	174.5	-55.8	-177.7	163.4	0	0	113.8	S247	S247-E251 PolarHBondContact O-N 2.7Å
252	E	89.4	Confident	91.4	Very high	55 Å²	55	55.5 Å²	55.5	26%	0.257	27%	0.265	S	S	.	.			trans	-106.2	97.3	-178.3	-58.9	-58.6	149.3	0	0	110.4	K216 I228 F250 E254 L255 V256	K216-E252 IonicContact NZ-OE1 3Å; K216-E252 PolarHBondContact NZ-OE1 3.28Å; I228-E252 HydrophobicContact CD1-CG 3.49Å; I228-E252 VanDerWaalsContact CD1-CG 3.49Å; I228-E252 WeakPolarHBondContact CD1-OE1 3.48Å; I228-E252 HydrophobicContact CG1-CG 3.83Å; I228-E252 HydrophobicContact CG2-CG 4.35Å; F250-E252 HydrophobicContact CB-CG 4.31Å; F250-E252 HydrophobicContact CD2-CB 3.67Å; F250-E252 HydrophobicContact CD2-CG 3.94Å; F250-E252 HydrophobicContact CE2-CB 4.17Å; F250-E252 WeakPolarHBondContact O-CG 3.34Å; F250-E252 PolarHBondContact O-N 2.86Å; F250-E252 VanDerWaalsContact O-N 3.11Å; E252-E254 VanDerWaalsContact C-N 3.25Å; E252-E254 PolarHBondContact O-N 2.76Å; E252-L255 HydrophobicContact CB-CB 4.05Å; E252-L255 PolarHBondContact O-N 3.03Å; E252-L255 VanDerWaalsContact O-N 3.14Å; E252-V256 WeakPolarHBondContact O-CG2 3.33Å; E252-V256 PolarHBondContact O-N 3.02Å
253	E	91.9	Very high	91.6	Very high	172 Å²	172	51.9 Å²	51.9	80%	0.804	25%	0.249	S	C	*	.	H	α-helix	trans	-56.7	-37.2	-175.8	-64.5	-175.6	172.8	0	0	113	V256 A257	E253-V256 PolarHBondContact O-N 3.4Å; E253-A257 WeakPolarHBondContact O-CB 3.42Å; E253-A257 PolarHBondContact O-N 2.88Å
254	E	91.2	Very high	91.7	Very high	115 Å²	115	51.9 Å²	51.9	54%	0.537	25%	0.249	S	C	.	.	H	α-helix	trans	-67.1	-42.3	179.1	-171	-178.8	179	0	0	112	E252 V256 A257 R258	E252-E254 VanDerWaalsContact C-N 3.25Å; E252-E254 PolarHBondContact O-N 2.76Å; E254-V256 VanDerWaalsContact C-N 3.34Å; E254-A257 PolarHBondContact O-N 2.62Å; E254-R258 WeakPolarHBondContact O-CG 3.32Å; E254-R258 PolarHBondContact O-N 3.2Å; E254-R258 IonicContact OE1-CZ 3.48Å; E254-R258 IonicContact OE1-NE 3.41Å; E254-R258 IonicContact OE1-NH2 3.5Å; E254-R258 PolarHBondContact OE1-NH2 3.28Å
255	L	91.9	Very high	91.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-41.7	175.9	176.5	56.5	0	0	0	110.4	L231 Q232 F250 E252 A257 R258 C259	L231-L255 HydrophobicContact CB-CD2 3.88Å; L231-L255 HydrophobicContact CD1-CD2 4Å; Q232-L255 HydrophobicContact CG-CB 4.46Å; Q232-L255 HydrophobicContact CG-CD1 3.81Å; F250-L255 HydrophobicContact CD1-CD2 4.49Å; F250-L255 HydrophobicContact CD2-CD2 3.98Å; F250-L255 HydrophobicContact CE1-CD2 4.08Å; F250-L255 HydrophobicContact CE2-CB 3.94Å; F250-L255 HydrophobicContact CE2-CD2 3.54Å; F250-L255 HydrophobicContact CE2-CG 3.75Å; F250-L255 HydrophobicContact CG-CD2 4.43Å; F250-L255 HydrophobicContact CZ-CB 4.5Å; F250-L255 HydrophobicContact CZ-CD2 3.57Å; F250-L255 HydrophobicContact CZ-CG 3.82Å; E252-L255 HydrophobicContact CB-CB 4.05Å; E252-L255 PolarHBondContact O-N 3.03Å; E252-L255 VanDerWaalsContact O-N 3.14Å; L255-A257 PolarHBondContact O-N 2.97Å; L255-R258 PolarHBondContact O-N 3.46Å; L255-C259 PolarHBondContact O-N 3.21Å; L255-C259 PolarHBondContact O-SG 3.12Å
256	V	94.9	Very high	91.9	Very high	30 Å²	30	52 Å²	52	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.1	176.7	0	0	0	0	111.6	L244 F250 E252 E253 E254 R258 C259 W260	L244-V256 HydrophobicContact CD1-CG1 4.19Å; F250-V256 HydrophobicContact CE2-CG2 3.78Å; F250-V256 HydrophobicContact CZ-CG2 4.29Å; E252-V256 WeakPolarHBondContact O-CG2 3.33Å; E252-V256 PolarHBondContact O-N 3.02Å; E253-V256 PolarHBondContact O-N 3.4Å; E254-V256 VanDerWaalsContact C-N 3.34Å; V256-R258 VanDerWaalsContact C-N 3.3Å; V256-R258 PolarHBondContact O-N 3.01Å; V256-C259 WeakPolarHBondContact O-CB 3.44Å; V256-C259 PolarHBondContact O-N 3.23Å; V256-W260 PolarHBondContact O-N 2.71Å
257	A	94.2	Very high	92.2	Very high	44 Å²	44	49.6 Å²	49.6	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-58.9	-43.2	175.8	0	0	0	0	0	111.2	E253 E254 L255 C259 W260 E261	E253-A257 WeakPolarHBondContact O-CB 3.42Å; E253-A257 PolarHBondContact O-N 2.88Å; E254-A257 PolarHBondContact O-N 2.62Å; L255-A257 PolarHBondContact O-N 2.97Å; A257-C259 PolarHBondContact O-N 3.4Å; A257-W260 PolarHBondContact O-N 2.96Å; A257-E261 WeakPolarHBondContact O-CG 3.43Å; A257-E261 PolarHBondContact O-N 3.41Å
258	R	92.5	Very high	92.5	Very high	62 Å²	62	50 Å²	50	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-37.2	176.3	-70.7	-173.7	-177.4	163.8	11.1	113	L235 E254 L255 V256 W260 M262	L235-R258 HydrophobicContact CD2-CB 3.86Å; E254-R258 WeakPolarHBondContact O-CG 3.32Å; E254-R258 PolarHBondContact O-N 3.2Å; E254-R258 IonicContact OE1-CZ 3.48Å; E254-R258 IonicContact OE1-NE 3.41Å; E254-R258 IonicContact OE1-NH2 3.5Å; E254-R258 PolarHBondContact OE1-NH2 3.28Å; L255-R258 PolarHBondContact O-N 3.46Å; V256-R258 VanDerWaalsContact C-N 3.3Å; V256-R258 PolarHBondContact O-N 3.01Å; R258-W260 VanDerWaalsContact C-N 3.33Å; R258-M262 PolarHBondContact O-N 3.2Å
259	C	95.6	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-45.4	172.8	-68.2	0	0	0	0	110.9	V240 L244 L255 V256 A257 M262 I263	V240-C259 HydrophobicContact CG2-CB 3.65Å; V240-C259 VanDerWaalsContact CG2-O 3.27Å; V240-C259 WeakPolarHBondContact CG2-O 3.46Å; L244-C259 HydrophobicContact CB-CB 4.45Å; L244-C259 HydrophobicContact CD1-CB 4.39Å; L255-C259 PolarHBondContact O-N 3.21Å; L255-C259 PolarHBondContact O-SG 3.12Å; V256-C259 WeakPolarHBondContact O-CB 3.44Å; V256-C259 PolarHBondContact O-N 3.23Å; A257-C259 PolarHBondContact O-N 3.4Å; C259-M262 PolarHBondContact O-N 3.32Å; C259-I263 WeakPolarHBondContact O-CG1 3.39Å; C259-I263 PolarHBondContact O-N 3.2Å
260	W	96.3	Very high	93.7	Very high	41 Å²	41	43.4 Å²	43.4	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-42.6	179.6	-77	124.2	0	0	0	113.7	L244 V256 A257 R258 M262 I263 D264 L286 I287	L244-W260 HydrophobicContact CD1-CD2 4.29Å; L244-W260 HydrophobicContact CD1-CH2 4.47Å; L244-W260 HydrophobicContact CD1-CZ2 3.77Å; L244-W260 HydrophobicContact CD2-CD2 4.31Å; L244-W260 HydrophobicContact CD2-CE3 4.15Å; L244-W260 HydrophobicContact CD2-CH2 3.35Å; L244-W260 HydrophobicContact CD2-CZ2 3.52Å; L244-W260 HydrophobicContact CD2-CZ3 3.68Å; L244-W260 HydrophobicContact CG-CH2 4.46Å; L244-W260 HydrophobicContact CG-CZ2 4.19Å; V256-W260 PolarHBondContact O-N 2.71Å; A257-W260 PolarHBondContact O-N 2.96Å; R258-W260 VanDerWaalsContact C-N 3.33Å; W260-M262 PolarHBondContact O-N 2.64Å; W260-I263 HydrophobicContact CE3-CB 4.4Å; W260-I263 HydrophobicContact CE3-CD1 4.11Å; W260-I263 HydrophobicContact CE3-CG2 4.34Å; W260-I263 HydrophobicContact CZ3-CD1 4.21Å; W260-I263 HydrophobicContact CZ3-CG2 4.37Å; W260-I263 PolarHBondContact O-N 2.83Å; W260-D264 PolarHBondContact O-N 3.49Å; W260-L286 HydrophobicContact CH2-CB 3.97Å; W260-L286 HydrophobicContact CZ2-CB 4.31Å; W260-I287 HydrophobicContact CH2-CG1 4.01Å; W260-I287 HydrophobicContact CZ3-CG1 3.9Å
261	E	94.9	Very high	94.4	Very high	94 Å²	94	43.4 Å²	43.4	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-40.9	175.4	-74	176	-168.1	0	0	111.7	A257 A265 R419 F421	A257-E261 WeakPolarHBondContact O-CG 3.43Å; A257-E261 PolarHBondContact O-N 3.41Å; E261-A265 VanDerWaalsContact O-CB 3.31Å; E261-A265 WeakPolarHBondContact O-CB 3.25Å; E261-A265 PolarHBondContact O-N 2.8Å; E261-R419 IonicContact OE2-CZ 2.87Å; E261-R419 IonicContact OE2-NE 2.81Å; E261-R419 IonicContact OE2-NH2 3.57Å; E261-R419 PolarHBondContact OE2-NH2 3.21Å; E261-F421 HydrophobicContact CB-CE2 4.37Å
262	M	95.5	Very high	94.9	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-72.1	-42.6	178.3	179.4	175.2	-79.2	0	0	112.8	L235 T236 S237 V240 R258 C259 W260 D264 A265 Q266 F421	L235-M262 HydrophobicContact CD1-SD 4.32Å; L235-M262 HydrophobicContact CD2-CE 4.33Å; L235-M262 HydrophobicContact CD2-SD 4.4Å; L235-M262 HydrophobicContact CG-CE 3.95Å; L235-M262 HydrophobicContact CG-SD 3.84Å; T236-M262 VanDerWaalsContact CA-SD 3.55Å; T236-M262 VanDerWaalsContact O-SD 3.41Å; S237-M262 PolarHBondContact N-SD 2.88Å; V240-M262 HydrophobicContact CB-CG 4.46Å; V240-M262 HydrophobicContact CB-SD 3.95Å; V240-M262 HydrophobicContact CG1-CG 4.44Å; V240-M262 HydrophobicContact CG1-SD 4.36Å; V240-M262 HydrophobicContact CG2-CB 4.29Å; V240-M262 HydrophobicContact CG2-CG 4.4Å; V240-M262 HydrophobicContact CG2-SD 4.22Å; R258-M262 PolarHBondContact O-N 3.2Å; C259-M262 PolarHBondContact O-N 3.32Å; W260-M262 PolarHBondContact O-N 2.64Å; M262-D264 PolarHBondContact O-N 2.69Å; M262-A265 PolarHBondContact O-N 2.77Å; M262-Q266 PolarHBondContact O-N 2.85Å; M262-F421 HydrophobicContact CB-CZ 4.38Å
263	I	97.1	Very high	95.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-59.4	-39.5	174.4	-74	166	0	0	0	110.3	V240 L244 C259 W260 A267 A270 L293	V240-I263 HydrophobicContact CB-CG1 4.4Å; V240-I263 HydrophobicContact CG1-CD1 4.48Å; V240-I263 HydrophobicContact CG1-CG1 3.77Å; V240-I263 HydrophobicContact CG2-CD1 3.93Å; V240-I263 HydrophobicContact CG2-CG1 3.7Å; L244-I263 HydrophobicContact CB-CD1 4.36Å; L244-I263 HydrophobicContact CD2-CD1 3.51Å; L244-I263 HydrophobicContact CG-CD1 4.49Å; C259-I263 WeakPolarHBondContact O-CG1 3.39Å; C259-I263 PolarHBondContact O-N 3.2Å; W260-I263 HydrophobicContact CE3-CB 4.4Å; W260-I263 HydrophobicContact CE3-CD1 4.11Å; W260-I263 HydrophobicContact CE3-CG2 4.34Å; W260-I263 HydrophobicContact CZ3-CD1 4.21Å; W260-I263 HydrophobicContact CZ3-CG2 4.37Å; W260-I263 PolarHBondContact O-N 2.83Å; I263-A267 WeakPolarHBondContact O-CA 3.48Å; I263-A267 WeakPolarHBondContact O-CB 3.43Å; I263-A267 PolarHBondContact O-N 2.89Å; I263-A270 HydrophobicContact CG1-CB 4.45Å; I263-L293 HydrophobicContact CG2-CD1 3.76Å
264	D	96.8	Very high	95.3	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.027	17%	0.167	C	C	.	.	H	α-helix	trans	-70.3	-49.8	177.2	-78.2	-16.1	0	0	0	112.5	W260 M262 R290 T292 L293 N294 L385	W260-D264 PolarHBondContact O-N 3.49Å; M262-D264 PolarHBondContact O-N 2.69Å; D264-R290 WeakPolarHBondContact OD1-CD 3.27Å; D264-R290 IonicContact OD1-CZ 2.66Å; D264-R290 IonicContact OD1-NE 3.8Å; D264-R290 PolarHBondContact OD1-NE 3.31Å; D264-R290 IonicContact OD1-NH2 2.82Å; D264-R290 IonicContact OD2-CZ 2.71Å; D264-R290 IonicContact OD2-NE 3.81Å; D264-R290 PolarHBondContact OD2-NE 2.99Å; D264-R290 IonicContact OD2-NH2 2.84Å; D264-R290 PolarHBondContact OD2-NH2 2.99Å; D264-T292 VanDerWaalsContact OD1-C 3.31Å; D264-T292 PolarHBondContact OD1-OG1 2.99Å; D264-T292 WeakPolarHBondContact OD2-CB 3.38Å; D264-T292 PolarHBondContact OD2-OG1 3.43Å; D264-L293 WeakPolarHBondContact OD1-CA 3.32Å; D264-L293 PolarHBondContact OD1-N 2.86Å; D264-N294 WeakPolarHBondContact O-CB 3.43Å; D264-N294 PolarHBondContact O-N 2.85Å; D264-L385 HydrophobicContact CB-CD1 3.96Å; D264-L385 HydrophobicContact CB-CD2 3.88Å; D264-L385 HydrophobicContact CB-CG 4.08Å
265	A	95.6	Very high	95.4	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-71.2	-38.3	-172.6	0	0	0	0	0	112.5	E261 M262 L385 F421 P473	E261-A265 VanDerWaalsContact O-CB 3.31Å; E261-A265 WeakPolarHBondContact O-CB 3.25Å; E261-A265 PolarHBondContact O-N 2.8Å; M262-A265 PolarHBondContact O-N 2.77Å; A265-L385 HydrophobicContact CB-CD1 3.9Å; A265-F421 HydrophobicContact CB-CB 3.88Å; A265-F421 HydrophobicContact CB-CD1 3.45Å; A265-F421 VanDerWaalsContact CB-CD1 3.45Å; A265-F421 HydrophobicContact CB-CD2 3.5Å; A265-F421 HydrophobicContact CB-CE1 3.75Å; A265-F421 HydrophobicContact CB-CE2 3.8Å; A265-F421 HydrophobicContact CB-CG 3.31Å; A265-F421 HydrophobicContact CB-CZ 3.92Å; A265-P473 WeakPolarHBondContact O-CD 3.21Å; A265-P473 VanDerWaalsContact O-CG 3.23Å; A265-P473 WeakPolarHBondContact O-CG 2.87Å
266	Q	95.8	Very high	95.7	Very high	23 Å²	23	28.3 Å²	28.3	11%	0.107	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	41.7	-177.8	-63.2	-169.2	-33	0	0	111.3	S237 M262 E268 L269 A270 F421 P473	S237-Q266 PolarHBondContact OG-OE1 2.95Å; M262-Q266 PolarHBondContact O-N 2.85Å; Q266-E268 PolarHBondContact O-N 3.44Å; Q266-L269 HydrophobicContact CB-CB 4.34Å; Q266-L269 HydrophobicContact CB-CD1 4.27Å; Q266-L269 HydrophobicContact CG-CD1 4.45Å; Q266-L269 PolarHBondContact O-N 2.96Å; Q266-L269 VanDerWaalsContact O-N 3.14Å; Q266-A270 PolarHBondContact O-N 2.9Å; Q266-F421 HydrophobicContact CG-CD1 4.33Å; Q266-F421 HydrophobicContact CG-CE1 4.21Å; Q266-P473 WeakPolarHBondContact CG-O 3.43Å; Q266-P473 PolarHBondContact NE2-O 3.45Å
267	A	96.6	Very high	95.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-52.4	-50.5	-172.7	0	0	0	0	0	113.5	I263 L269 A270 L271 L293 A295	I263-A267 WeakPolarHBondContact O-CA 3.48Å; I263-A267 WeakPolarHBondContact O-CB 3.43Å; I263-A267 PolarHBondContact O-N 2.89Å; A267-L269 PolarHBondContact O-N 2.89Å; A267-A270 PolarHBondContact O-N 2.94Å; A267-L271 VanDerWaalsContact O-CB 3.31Å; A267-L271 WeakPolarHBondContact O-CB 3.41Å; A267-L271 WeakPolarHBondContact O-CG 3.49Å; A267-L271 PolarHBondContact O-N 2.83Å; A267-L293 HydrophobicContact CB-CD1 3.59Å; A267-L293 HydrophobicContact CB-CG 4.06Å; A267-A295 HydrophobicContact CB-CB 3.63Å
268	E	95.5	Very high	95.6	Very high	33 Å²	33	30.6 Å²	30.6	15%	0.154	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-45.5	179.9	-62.2	-168.8	-171.1	0	0	110.7	Q266 A270 L271 F272 A295 R296 K299	Q266-E268 PolarHBondContact O-N 3.44Å; E268-A270 VanDerWaalsContact C-N 3.31Å; E268-A270 PolarHBondContact O-N 3.14Å; E268-L271 PolarHBondContact O-N 3.08Å; E268-F272 HydrophobicContact CB-CD2 4.5Å; E268-F272 WeakPolarHBondContact O-CD2 3.4Å; E268-F272 PolarHBondContact O-N 3.18Å; E268-A295 HydrophobicContact CG-CB 3.77Å; E268-R296 IonicContact OE1-CZ 3.14Å; E268-R296 IonicContact OE1-NE 3.88Å; E268-R296 PolarHBondContact OE1-NE 3.17Å; E268-R296 IonicContact OE1-NH2 2.73Å; E268-R296 IonicContact OE2-NH2 2.61Å; E268-K299 HydrophobicContact CG-CB 4.19Å; E268-K299 HydrophobicContact CG-CG 4.4Å
269	L	95.9	Very high	95.7	Very high	76 Å²	76	27.6 Å²	27.6	40%	0.398	13%	0.134	S	C	.	.	H	α-helix	trans	-60.1	-40	177.4	-61.7	178.3	0	0	0	112.8	Q266 A267 S273 Q472	Q266-L269 HydrophobicContact CB-CB 4.34Å; Q266-L269 HydrophobicContact CB-CD1 4.27Å; Q266-L269 HydrophobicContact CG-CD1 4.45Å; Q266-L269 PolarHBondContact O-N 2.96Å; Q266-L269 VanDerWaalsContact O-N 3.14Å; A267-L269 PolarHBondContact O-N 2.89Å; L269-S273 PolarHBondContact O-N 2.8Å; L269-Q472 HydrophobicContact CD1-CB 4.12Å; L269-Q472 HydrophobicContact CD1-CG 4.09Å; L269-Q472 HydrophobicContact CD2-CG 4.24Å; L269-Q472 HydrophobicContact CG-CB 4.47Å; L269-Q472 HydrophobicContact CG-CG 3.91Å
270	A	97.3	Very high	95.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.9	-45.2	179	0	0	0	0	0	112.2	S237 V240 I263 Q266 A267 E268 F272 S273	S237-A270 WeakPolarHBondContact O-CA 3.41Å; V240-A270 HydrophobicContact CG1-CB 3.84Å; I263-A270 HydrophobicContact CG1-CB 4.45Å; Q266-A270 PolarHBondContact O-N 2.9Å; A267-A270 PolarHBondContact O-N 2.94Å; E268-A270 VanDerWaalsContact C-N 3.31Å; E268-A270 PolarHBondContact O-N 3.14Å; A270-F272 VanDerWaalsContact C-N 3.32Å; A270-F272 PolarHBondContact O-N 3.5Å; A270-S273 WeakPolarHBondContact O-CB 3.22Å; A270-S273 PolarHBondContact O-N 3.25Å; A270-S273 PolarHBondContact O-OG 3.18Å
271	L	97.5	Very high	95.6	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-68.3	-29	-178.4	-68.5	173.8	0	0	0	113.2	A267 E268 F276 I287 L293 A295 I300 A303	A267-L271 VanDerWaalsContact O-CB 3.31Å; A267-L271 WeakPolarHBondContact O-CB 3.41Å; A267-L271 WeakPolarHBondContact O-CG 3.49Å; A267-L271 PolarHBondContact O-N 2.83Å; E268-L271 PolarHBondContact O-N 3.08Å; L271-F276 HydrophobicContact CD2-CD1 4.42Å; L271-F276 HydrophobicContact CD2-CD2 3.74Å; L271-F276 HydrophobicContact CD2-CE1 4.08Å; L271-F276 HydrophobicContact CD2-CE2 3.33Å; L271-F276 HydrophobicContact CD2-CG 4.27Å; L271-F276 HydrophobicContact CD2-CZ 3.51Å; L271-F276 WeakPolarHBondContact O-CB 3.43Å; L271-F276 WeakPolarHBondContact O-CD1 3.27Å; L271-F276 WeakPolarHBondContact O-CG 3.44Å; L271-I287 HydrophobicContact CD2-CG2 3.97Å; L271-L293 HydrophobicContact CD1-CD2 4.46Å; L271-A295 HydrophobicContact CD1-CB 4.36Å; L271-I300 HydrophobicContact CD1-CG1 3.88Å; L271-A303 HydrophobicContact CB-CB 3.71Å
272	F	96.6	Very high	95.7	Very high	58 Å²	58	32.1 Å²	32.1	25%	0.254	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	2.9	176.1	-74.7	-75.7	0	0	0	114	E268 A270 K299 E302	E268-F272 HydrophobicContact CB-CD2 4.5Å; E268-F272 WeakPolarHBondContact O-CD2 3.4Å; E268-F272 PolarHBondContact O-N 3.18Å; A270-F272 VanDerWaalsContact C-N 3.32Å; A270-F272 PolarHBondContact O-N 3.5Å; F272-K299 HydrophobicContact CE2-CB 4.1Å; F272-K299 HydrophobicContact CE2-CD 4.15Å; F272-K299 HydrophobicContact CE2-CG 4.48Å; F272-K299 HydrophobicContact CZ-CD 4.11Å; F272-E302 HydrophobicContact CE1-CB 4.4Å; F272-E302 HydrophobicContact CE1-CG 3.86Å; F272-E302 HydrophobicContact CZ-CB 4.04Å; F272-E302 HydrophobicContact CZ-CG 3.91Å; F272-E302 WeakPolarHBondContact CZ-OE2 3.42Å
273	S	96.3	Very high	95.7	Very high	10 Å²	10	32.3 Å²	32.3	7%	0.07	16%	0.159	C	C	.	.	S	Bend	trans	-78.4	153.7	174.1	75.7	0	0	0	0	112.1	L269 A270 S275 F276	L269-S273 PolarHBondContact O-N 2.8Å; A270-S273 WeakPolarHBondContact O-CB 3.22Å; A270-S273 PolarHBondContact O-N 3.25Å; A270-S273 PolarHBondContact O-OG 3.18Å; S273-S275 PolarHBondContact O-N 3.2Å; S273-S275 PolarHBondContact OG-OG 3.02Å; S273-F276 WeakPolarHBondContact O-CB 3.35Å; S273-F276 PolarHBondContact O-N 3.46Å
274	D	94	Very high	95.7	Very high	103 Å²	103	32.2 Å²	32.2	55%	0.551	16%	0.158	S	C	*	.	H	α-helix	trans	-59.7	-31.1	177.2	-56	-6.1	0	0	0	112.1	F276 W277	D274-F276 PolarHBondContact O-N 2.95Å; D274-F276 VanDerWaalsContact O-N 3.17Å; D274-W277 VanDerWaalsContact CA-CE2 3.45Å; D274-W277 HydrophobicContact CB-CH2 4.25Å; D274-W277 HydrophobicContact CB-CZ2 3.64Å; D274-W277 VanDerWaalsContact CG-CZ2 3.48Å; D274-W277 VanDerWaalsContact O-CD1 3.24Å; D274-W277 PolarHBondContact O-N 3.27Å; D274-W277 PolarHBondContact O-NE1 2.92Å; D274-W277 WeakPolarHBondContact OD1-CH2 3.42Å; D274-W277 WeakPolarHBondContact OD1-CZ2 3.37Å
275	S	93.7	Very high	95.8	Very high	9 Å²	9	32.5 Å²	32.5	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-21.5	176.9	77.6	0	0	0	0	113.9	K238 C241 S273 V279	K238-S275 WeakPolarHBondContact O-CB 3.21Å; K238-S275 PolarHBondContact O-OG 2.78Å; C241-S275 WeakPolarHBondContact CB-OG 3.33Å; S273-S275 PolarHBondContact O-N 3.2Å; S273-S275 PolarHBondContact OG-OG 3.02Å; S275-V279 VanDerWaalsContact O-CG1 3.26Å; S275-V279 WeakPolarHBondContact O-CG1 3.36Å
276	F	97.3	Very high	95.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-75.1	-44.9	-178.9	-178.6	-108.4	0	0	0	112.6	C241 L271 S273 D274 E278 V279 L284 I287 A303 W307	C241-F276 HydrophobicContact CB-CB 4.31Å; C241-F276 HydrophobicContact CB-CD2 4.4Å; L271-F276 HydrophobicContact CD2-CD1 4.42Å; L271-F276 HydrophobicContact CD2-CD2 3.74Å; L271-F276 HydrophobicContact CD2-CE1 4.08Å; L271-F276 HydrophobicContact CD2-CE2 3.33Å; L271-F276 HydrophobicContact CD2-CG 4.27Å; L271-F276 HydrophobicContact CD2-CZ 3.51Å; L271-F276 WeakPolarHBondContact O-CB 3.43Å; L271-F276 WeakPolarHBondContact O-CD1 3.27Å; L271-F276 WeakPolarHBondContact O-CG 3.44Å; S273-F276 WeakPolarHBondContact O-CB 3.35Å; S273-F276 PolarHBondContact O-N 3.46Å; D274-F276 PolarHBondContact O-N 2.95Å; D274-F276 VanDerWaalsContact O-N 3.17Å; F276-E278 PolarHBondContact O-N 3.21Å; F276-V279 WeakPolarHBondContact O-CG1 3.34Å; F276-V279 WeakPolarHBondContact O-CG2 3.06Å; F276-V279 PolarHBondContact O-N 2.99Å; F276-L284 HydrophobicContact CE1-CD1 4.32Å; F276-L284 HydrophobicContact CE2-CD1 4.26Å; F276-L284 HydrophobicContact CZ-CD1 3.6Å; F276-I287 HydrophobicContact CD2-CD1 4.14Å; F276-I287 HydrophobicContact CE2-CD1 3.83Å; F276-I287 HydrophobicContact CE2-CG2 4.23Å; F276-A303 HydrophobicContact CD1-CB 4.27Å; F276-A303 HydrophobicContact CE1-CB 3.95Å; F276-W307 HydrophobicContact CE1-CB 4.09Å
277	W	94.1	Very high	95.9	Very high	14 Å²	14	35.1 Å²	35.1	5%	0.053	17%	0.174	C	C	.	.	H	α-helix	trans	-74.7	-12.4	179.3	52.3	66.9	0	0	0	113.6	D274 R306 Y310 R314	D274-W277 VanDerWaalsContact CA-CE2 3.45Å; D274-W277 HydrophobicContact CB-CH2 4.25Å; D274-W277 HydrophobicContact CB-CZ2 3.64Å; D274-W277 VanDerWaalsContact CG-CZ2 3.48Å; D274-W277 VanDerWaalsContact O-CD1 3.24Å; D274-W277 PolarHBondContact O-N 3.27Å; D274-W277 PolarHBondContact O-NE1 2.92Å; D274-W277 WeakPolarHBondContact OD1-CH2 3.42Å; D274-W277 WeakPolarHBondContact OD1-CZ2 3.37Å; W277-R306 HydrophobicContact CE3-CG 3.86Å; W277-R306 VanDerWaalsContact CZ3-CD 3.48Å; W277-R306 HydrophobicContact CZ3-CG 4.2Å; W277-Y310 HydrophobicContact CB-CD2 4.06Å; W277-Y310 HydrophobicContact CB-CG 4.05Å; W277-Y310 AromaticContact CD1-CD1 3.79Å; W277-Y310 AromaticContact CD1-CG 3.86Å; W277-Y310 HydrophobicContact CD2-CD2 4.08Å; W277-Y310 AromaticContact CD2-CE2 3.95Å; W277-Y310 HydrophobicContact CD2-CE2 3.95Å; W277-Y310 AromaticContact CE2-CE2 3.99Å; W277-Y310 AromaticContact CE2-CZ 3.82Å; W277-Y310 HydrophobicContact CE3-CE2 4.44Å; W277-Y310 HydrophobicContact CG-CD1 4.25Å; W277-Y310 AromaticContact CG-CD2 3.83Å; W277-Y310 HydrophobicContact CG-CD2 3.83Å; W277-Y310 HydrophobicContact CG-CE2 4.15Å; W277-Y310 AromaticContact CG-CG 3.87Å; W277-Y310 HydrophobicContact CG-CG 3.87Å; W277-Y310 HydrophobicContact CZ2-CE2 4.44Å; W277-Y310 AromaticContact NE1-CE1 3.79Å; W277-Y310 AromaticContact NE1-CZ 3.93Å; W277-R314 PolarHBondContact O-NH2 3.3Å
278	E	91.9	Very high	96	Very high	108 Å²	108	35.1 Å²	35.1	51%	0.505	18%	0.175	S	C	.	.	H	α-helix	trans	-78.4	-20.3	172.8	-69.5	-178.4	179.1	0	0	113.3	F276 R314	F276-E278 PolarHBondContact O-N 3.21Å; E278-R314 PolarHBondContact O-NH1 3.41Å
279	V	95.7	Very high	96.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-62.9	152.3	-176.4	-50.3	0	0	0	0	112.8	C241 S275 F276 T283 L284 W307 R314	C241-V279 HydrophobicContact CB-CG1 3.73Å; C241-V279 WeakPolarHBondContact O-CG1 3.14Å; S275-V279 VanDerWaalsContact O-CG1 3.26Å; S275-V279 WeakPolarHBondContact O-CG1 3.36Å; F276-V279 WeakPolarHBondContact O-CG1 3.34Å; F276-V279 WeakPolarHBondContact O-CG2 3.06Å; F276-V279 PolarHBondContact O-N 2.99Å; V279-T283 HydrophobicContact CB-CG2 4Å; V279-T283 HydrophobicContact CG1-CG2 4.15Å; V279-T283 HydrophobicContact CG2-CG2 4.35Å; V279-L284 HydrophobicContact CG2-CB 4.21Å; V279-W307 PolarHBondContact O-NE1 2.61Å; V279-R314 PolarHBondContact O-NH2 2.78Å
280	D	94.4	Very high	96.1	Very high	63 Å²	63	40.2 Å²	40.2	34%	0.337	19%	0.187	S	C	.	.			trans	-72	164.3	174.2	68.1	9.7	0	0	0	112.4	E282 T283 L284	D280-E282 PolarHBondContact O-N 2.99Å; D280-T283 PolarHBondContact O-N 3.26Å; D280-T283 WeakPolarHBondContact OD1-CA 3.47Å; D280-T283 WeakPolarHBondContact OD1-CB 3.17Å; D280-T283 PolarHBondContact OD1-N 2.61Å; D280-T283 PolarHBondContact OD1-OG1 2.65Å; D280-L284 PolarHBondContact O-N 2.91Å
281	F	96.1	Very high	96.1	Very high	71 Å²	71	44 Å²	44	31%	0.311	21%	0.205	S	C	.	.	H	α-helix	trans	-59.3	-31.5	-178.2	-176.2	-97.6	0	0	0	112.9	T285 W307 L328 A331	F281-T285 WeakPolarHBondContact O-CB 3.46Å; F281-T285 PolarHBondContact O-N 3.3Å; F281-T285 PolarHBondContact O-OG1 3.43Å; F281-W307 AromaticContact CD2-CH2 3.94Å; F281-W307 HydrophobicContact CD2-CH2 3.94Å; F281-L328 VanDerWaalsContact CE2-O 3.29Å; F281-L328 WeakPolarHBondContact CE2-O 3.49Å; F281-A331 HydrophobicContact CE2-CB 3.95Å; F281-A331 HydrophobicContact CZ-CB 4.01Å
282	E	95.5	Very high	96	Very high	96 Å²	96	46 Å²	46	45%	0.449	22%	0.217	S	C	.	.	H	α-helix	trans	-72.2	-45.7	-179	-162.3	174.2	167.6	0	0	111.3	R248 D280 T285 L286	R248-E282 IonicContact CZ-OE1 3.89Å; R248-E282 IonicContact CZ-OE2 2.77Å; R248-E282 IonicContact NH1-OE1 3.02Å; R248-E282 IonicContact NH1-OE2 3.87Å; R248-E282 PolarHBondContact NH1-OE2 3.39Å; R248-E282 IonicContact NH2-OE1 3.38Å; R248-E282 PolarHBondContact NH2-OE1 2.6Å; R248-E282 IonicContact NH2-OE2 3.88Å; R248-E282 PolarHBondContact NH2-OE2 3.15Å; D280-E282 PolarHBondContact O-N 2.99Å; E282-T285 WeakPolarHBondContact O-CB 3.42Å; E282-T285 PolarHBondContact O-N 3.28Å; E282-L286 WeakPolarHBondContact O-CG 3.17Å; E282-L286 PolarHBondContact O-N 2.95Å
283	T	95.9	Very high	96.1	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-43.1	174.6	-56.3	0	0	0	0	111.1	L244 V279 D280 T285 L286 I287	L244-T283 HydrophobicContact CD2-CG2 3.88Å; L244-T283 HydrophobicContact CG-CG2 4.12Å; V279-T283 HydrophobicContact CB-CG2 4Å; V279-T283 HydrophobicContact CG1-CG2 4.15Å; V279-T283 HydrophobicContact CG2-CG2 4.35Å; D280-T283 PolarHBondContact O-N 3.26Å; D280-T283 WeakPolarHBondContact OD1-CA 3.47Å; D280-T283 WeakPolarHBondContact OD1-CB 3.17Å; D280-T283 PolarHBondContact OD1-N 2.61Å; D280-T283 PolarHBondContact OD1-OG1 2.65Å; T283-T285 VanDerWaalsContact C-N 3.31Å; T283-T285 PolarHBondContact O-N 3.33Å; T283-L286 PolarHBondContact O-N 2.96Å; T283-I287 HydrophobicContact CG2-CD1 3.98Å; T283-I287 WeakPolarHBondContact O-CG1 3.17Å; T283-I287 PolarHBondContact O-N 3.4Å
284	L	97.6	Very high	96	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.5	-50.2	171.7	174.7	72.7	0	0	0	110.9	F276 V279 D280 L286 I287 L288 W307 L328 A331	F276-L284 HydrophobicContact CE1-CD1 4.32Å; F276-L284 HydrophobicContact CE2-CD1 4.26Å; F276-L284 HydrophobicContact CZ-CD1 3.6Å; V279-L284 HydrophobicContact CG2-CB 4.21Å; D280-L284 PolarHBondContact O-N 2.91Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 3.4Å; L284-I287 PolarHBondContact O-N 3.33Å; L284-L288 HydrophobicContact CD1-CD1 3.96Å; L284-L288 HydrophobicContact CD1-CG 4.17Å; L284-L288 HydrophobicContact CG-CD1 4.02Å; L284-L288 HydrophobicContact CG-CG 4.44Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3.36Å; L284-W307 HydrophobicContact CD1-CD2 4.32Å; L284-W307 HydrophobicContact CD1-CG 4.13Å; L284-W307 HydrophobicContact CD2-CD2 3.66Å; L284-W307 HydrophobicContact CD2-CE3 3.61Å; L284-W307 HydrophobicContact CD2-CG 4.34Å; L284-W307 HydrophobicContact CD2-CH2 3.9Å; L284-W307 HydrophobicContact CD2-CZ2 3.91Å; L284-W307 HydrophobicContact CD2-CZ3 3.74Å; L284-W307 HydrophobicContact CG-CD2 4.48Å; L284-L328 HydrophobicContact CD2-CD2 4.1Å; L284-A331 HydrophobicContact CD2-CB 4.03Å; L284-A331 HydrophobicContact CG-CB 4.48Å
285	T	97.9	Very high	96	Very high	11 Å²	11	41 Å²	41	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-40.7	-179.5	-62.5	0	0	0	0	111.5	F281 E282 T283 R289 L334	F281-T285 WeakPolarHBondContact O-CB 3.46Å; F281-T285 PolarHBondContact O-N 3.3Å; F281-T285 PolarHBondContact O-OG1 3.43Å; E282-T285 WeakPolarHBondContact O-CB 3.42Å; E282-T285 PolarHBondContact O-N 3.28Å; T283-T285 VanDerWaalsContact C-N 3.31Å; T283-T285 PolarHBondContact O-N 3.33Å; T285-R289 WeakPolarHBondContact O-CB 3.38Å; T285-R289 VanDerWaalsContact O-CG 3.27Å; T285-R289 WeakPolarHBondContact O-CG 3.42Å; T285-R289 PolarHBondContact O-N 3.24Å; T285-R289 VanDerWaalsContact O-N 3.08Å; T285-L334 HydrophobicContact CG2-CD1 3.93Å
286	L	96.9	Very high	96.1	Very high	78 Å²	78	46.2 Å²	46.2	41%	0.408	21%	0.213	S	C	.	.	H	α-helix	trans	-63.9	-44.7	176.7	-71.1	171.7	0	0	0	111.8	W260 E282 T283 L284 R289	W260-L286 HydrophobicContact CH2-CB 3.97Å; W260-L286 HydrophobicContact CZ2-CB 4.31Å; E282-L286 WeakPolarHBondContact O-CG 3.17Å; E282-L286 PolarHBondContact O-N 2.95Å; T283-L286 PolarHBondContact O-N 2.96Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 3.4Å; L286-R289 PolarHBondContact O-N 2.92Å
287	I	97.7	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-48.5	177.7	-66.5	167.5	0	0	0	110.2	L244 W260 L271 F276 T283 L284 R289 R290 L293	L244-I287 HydrophobicContact CD2-CD1 4.32Å; L244-I287 HydrophobicContact CD2-CG1 4.21Å; W260-I287 HydrophobicContact CH2-CG1 4.01Å; W260-I287 HydrophobicContact CZ3-CG1 3.9Å; L271-I287 HydrophobicContact CD2-CG2 3.97Å; F276-I287 HydrophobicContact CD2-CD1 4.14Å; F276-I287 HydrophobicContact CE2-CD1 3.83Å; F276-I287 HydrophobicContact CE2-CG2 4.23Å; T283-I287 HydrophobicContact CG2-CD1 3.98Å; T283-I287 WeakPolarHBondContact O-CG1 3.17Å; T283-I287 PolarHBondContact O-N 3.4Å; L284-I287 PolarHBondContact O-N 3.33Å; I287-R289 VanDerWaalsContact C-N 3.29Å; I287-R289 PolarHBondContact O-N 2.88Å; I287-R290 WeakPolarHBondContact O-CB 3.26Å; I287-R290 PolarHBondContact O-N 3.32Å; I287-R290 VanDerWaalsContact O-N 3.11Å; I287-L293 HydrophobicContact CG2-CD1 4.39Å; I287-L293 HydrophobicContact CG2-CD2 4.3Å
288	L	97.9	Very high	96.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-68.3	-24.3	-177.3	-67	-176.8	0	0	0	114	L284 R290 I300 T304 A331 L334 I335 R382	L284-L288 HydrophobicContact CD1-CD1 3.96Å; L284-L288 HydrophobicContact CD1-CG 4.17Å; L284-L288 HydrophobicContact CG-CD1 4.02Å; L284-L288 HydrophobicContact CG-CG 4.44Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3.36Å; L288-R290 VanDerWaalsContact C-N 3.28Å; L288-I300 HydrophobicContact CD2-CG2 3.42Å; L288-I300 VanDerWaalsContact CD2-CG2 3.42Å; L288-T304 HydrophobicContact CD1-CG2 4.1Å; L288-A331 HydrophobicContact CD1-CB 4.18Å; L288-L334 HydrophobicContact CB-CB 3.91Å; L288-L334 HydrophobicContact CB-CD1 3.82Å; L288-I335 HydrophobicContact CD1-CD1 4Å; L288-I335 HydrophobicContact CD2-CD1 3.77Å; L288-I335 HydrophobicContact CG-CD1 4.44Å; L288-R382 PolarHBondContact O-NH1 2.85Å; L288-R382 PolarHBondContact O-NH2 2.92Å; L288-R382 VanDerWaalsContact O-NH2 3.13Å
289	R	97.1	Very high	96.4	Very high	149 Å²	149	43.1 Å²	43.1	56%	0.562	20%	0.199	S	C	*	.	H	α-helix	trans	-75	-16.1	173.9	-79.3	176.4	-177.2	175.3	2.5	113.7	T285 L286 I287 E291 L334	T285-R289 WeakPolarHBondContact O-CB 3.38Å; T285-R289 VanDerWaalsContact O-CG 3.27Å; T285-R289 WeakPolarHBondContact O-CG 3.42Å; T285-R289 PolarHBondContact O-N 3.24Å; T285-R289 VanDerWaalsContact O-N 3.08Å; L286-R289 PolarHBondContact O-N 2.92Å; I287-R289 VanDerWaalsContact C-N 3.29Å; I287-R289 PolarHBondContact O-N 2.88Å; R289-E291 PolarHBondContact O-N 2.78Å; R289-L334 HydrophobicContact CG-CD1 3.66Å; R289-L334 HydrophobicContact CG-CD2 3.7Å; R289-L334 HydrophobicContact CG-CG 4.29Å
290	R	96.3	Very high	96.5	Very high	66 Å²	66	43.1 Å²	43.1	25%	0.249	20%	0.199	C	C	.	.			trans	-72.1	125.4	-166.5	-163.2	167.7	173.4	90.3	9.8	112.1	D264 I287 L288 T292 L293 R382	D264-R290 WeakPolarHBondContact OD1-CD 3.27Å; D264-R290 IonicContact OD1-CZ 2.66Å; D264-R290 IonicContact OD1-NE 3.8Å; D264-R290 PolarHBondContact OD1-NE 3.31Å; D264-R290 IonicContact OD1-NH2 2.82Å; D264-R290 IonicContact OD2-CZ 2.71Å; D264-R290 IonicContact OD2-NE 3.81Å; D264-R290 PolarHBondContact OD2-NE 2.99Å; D264-R290 IonicContact OD2-NH2 2.84Å; D264-R290 PolarHBondContact OD2-NH2 2.99Å; I287-R290 WeakPolarHBondContact O-CB 3.26Å; I287-R290 PolarHBondContact O-N 3.32Å; I287-R290 VanDerWaalsContact O-N 3.11Å; L288-R290 VanDerWaalsContact C-N 3.28Å; R290-T292 WeakPolarHBondContact CG-OG1 3.21Å; R290-T292 PolarHBondContact NE-OG1 2.8Å; R290-T292 VanDerWaalsContact NE-OG1 3.15Å; R290-T292 PolarHBondContact NH2-OG1 2.93Å; R290-L293 HydrophobicContact CB-CB 4.31Å; R290-R382 PolarHBondContact O-NH1 2.8Å
291	E	97	Very high	96.7	Very high	79 Å²	79	40.4 Å²	40.4	37%	0.369	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-28	178.1	-70.7	-57.2	143.7	0	0	113.2	R289 R336 L383 G384	R289-E291 PolarHBondContact O-N 2.78Å; E291-R336 IonicContact OE1-CZ 2.66Å; E291-R336 IonicContact OE1-NH1 2.62Å; E291-R336 PolarHBondContact OE1-NH1 3.1Å; E291-R336 IonicContact OE1-NH2 3.47Å; E291-R336 PolarHBondContact OE1-NH2 2.86Å; E291-R336 IonicContact OE2-CZ 3.57Å; E291-R336 IonicContact OE2-NH1 3.25Å; E291-R336 PolarHBondContact OE2-NH1 3.42Å; E291-R336 IonicContact OE2-NH2 3.41Å; E291-R336 PolarHBondContact OE2-NH2 2.81Å; E291-L383 HydrophobicContact CB-CD1 4.32Å; E291-L383 HydrophobicContact CB-CG 4.46Å; E291-L383 PolarHBondContact O-N 2.76Å; E291-G384 PolarHBondContact O-N 2.98Å
292	T	97.1	Very high	96.7	Very high	44 Å²	44	40.9 Å²	40.9	27%	0.27	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	0	-175.3	49.8	0	0	0	0	113.8	D264 R290 N294	D264-T292 VanDerWaalsContact OD1-C 3.31Å; D264-T292 PolarHBondContact OD1-OG1 2.99Å; D264-T292 WeakPolarHBondContact OD2-CB 3.38Å; D264-T292 PolarHBondContact OD2-OG1 3.43Å; R290-T292 WeakPolarHBondContact CG-OG1 3.21Å; R290-T292 PolarHBondContact NE-OG1 2.8Å; R290-T292 VanDerWaalsContact NE-OG1 3.15Å; R290-T292 PolarHBondContact NH2-OG1 2.93Å; T292-N294 PolarHBondContact O-N 3.26Å
293	L	97.1	Very high	96.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	17%	0.166	C	C	.	.			trans	-64.4	106.2	179.4	-174.3	70.3	0	0	0	110	I263 D264 A267 L271 I287 R290 A295 I300	I263-L293 HydrophobicContact CG2-CD1 3.76Å; D264-L293 WeakPolarHBondContact OD1-CA 3.32Å; D264-L293 PolarHBondContact OD1-N 2.86Å; A267-L293 HydrophobicContact CB-CD1 3.59Å; A267-L293 HydrophobicContact CB-CG 4.06Å; L271-L293 HydrophobicContact CD1-CD2 4.46Å; I287-L293 HydrophobicContact CG2-CD1 4.39Å; I287-L293 HydrophobicContact CG2-CD2 4.3Å; R290-L293 HydrophobicContact CB-CB 4.31Å; L293-A295 VanDerWaalsContact C-N 3.28Å; L293-A295 PolarHBondContact O-N 3.35Å; L293-I300 HydrophobicContact CD2-CD1 3.64Å; L293-I300 HydrophobicContact CD2-CG1 4.05Å; L293-I300 HydrophobicContact CG-CD1 4.32Å
294	N	94.8	Very high	96.9	Very high	49 Å²	49	36.1 Å²	36.1	26%	0.262	17%	0.165	S	C	.	.			trans	-85.6	62.4	-171.6	-168.7	45.8	0	0	0	112.1	D264 T292 L385	D264-N294 WeakPolarHBondContact O-CB 3.43Å; D264-N294 PolarHBondContact O-N 2.85Å; T292-N294 PolarHBondContact O-N 3.26Å; N294-L385 HydrophobicContact CB-CD1 4.42Å; N294-L385 HydrophobicContact CB-CG 4.39Å
295	A	95	Very high	96.9	Very high	18 Å²	18	37 Å²	37	15%	0.149	17%	0.169	C	C	.	.	S	Bend	trans	-135.2	155.5	175.5	0	0	0	0	0	111.2	A267 E268 L271 L293 I300	A267-A295 HydrophobicContact CB-CB 3.63Å; E268-A295 HydrophobicContact CG-CB 3.77Å; L271-A295 HydrophobicContact CD1-CB 4.36Å; L293-A295 VanDerWaalsContact C-N 3.28Å; L293-A295 PolarHBondContact O-N 3.35Å; A295-I300 HydrophobicContact CB-CD1 4.1Å; A295-I300 HydrophobicContact CB-CG1 3.87Å
296	R	94.5	Very high	96.9	Very high	117 Å²	117	40.8 Å²	40.8	44%	0.442	18%	0.182	S	C	.	.			trans	-66.7	141.3	170	-68.7	173.8	-71.4	169.6	-5.4	110	E268 S298 K299 I300	E268-R296 IonicContact OE1-CZ 3.14Å; E268-R296 IonicContact OE1-NE 3.88Å; E268-R296 PolarHBondContact OE1-NE 3.17Å; E268-R296 IonicContact OE1-NH2 2.73Å; E268-R296 IonicContact OE2-NH2 2.61Å; R296-S298 PolarHBondContact O-N 2.88Å; R296-K299 HydrophobicContact CB-CG 4.36Å; R296-K299 WeakPolarHBondContact O-CB 3.31Å; R296-K299 PolarHBondContact O-N 3.45Å; R296-I300 WeakPolarHBondContact O-CG1 3.16Å; R296-I300 PolarHBondContact O-N 2.86Å
297	E	96.9	Very high	97	Very high	16 Å²	16	37.1 Å²	37.1	8%	0.075	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-32.3	-178.5	-161.7	69.6	-160.1	0	0	112.1	K299 I300 F301 I335 R336 M340 R382	E297-K299 VanDerWaalsContact C-N 3.33Å; E297-K299 PolarHBondContact O-N 2.9Å; E297-I300 PolarHBondContact O-N 3.41Å; E297-F301 WeakPolarHBondContact O-CB 3.39Å; E297-F301 PolarHBondContact O-N 3.27Å; E297-I335 HydrophobicContact CG-CG2 4.15Å; E297-I335 WeakPolarHBondContact OE1-CA 3.29Å; E297-R336 HydrophobicContact CG-CB 3.96Å; E297-R336 PolarHBondContact OE1-N 2.92Å; E297-M340 HydrophobicContact CB-CE 4.04Å; E297-M340 HydrophobicContact CB-CG 3.78Å; E297-M340 HydrophobicContact CG-CE 3.6Å; E297-M340 HydrophobicContact CG-CG 4.09Å; E297-M340 WeakPolarHBondContact O-CE 3.46Å; E297-R382 IonicContact OE1-CZ 2.68Å; E297-R382 IonicContact OE1-NE 3.57Å; E297-R382 IonicContact OE1-NH2 2.7Å; E297-R382 PolarHBondContact OE1-NH2 3.31Å; E297-R382 IonicContact OE2-CZ 3.8Å; E297-R382 IonicContact OE2-NE 3.3Å; E297-R382 PolarHBondContact OE2-NE 2.92Å; E297-R382 IonicContact OE2-NH2 3.73Å; E297-R382 PolarHBondContact OE2-NH2 2.88Å
298	S	96.3	Very high	97	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-55.3	-45.9	171.9	53.2	0	0	0	0	112.4	R296 F301 E302 E344 E348	R296-S298 PolarHBondContact O-N 2.88Å; S298-F301 WeakPolarHBondContact O-CB 3.28Å; S298-F301 PolarHBondContact O-N 2.91Å; S298-E302 PolarHBondContact O-N 2.96Å; S298-E344 PolarHBondContact OG-OE2 3.39Å; S298-E348 VanDerWaalsContact CB-OE2 3.27Å; S298-E348 WeakPolarHBondContact CB-OE2 3.48Å
299	K	96.5	Very high	97	Very high	41 Å²	41	40 Å²	40	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-69.4	-36.4	175.6	-65.3	-45.3	-166.8	-171.4	0	113.7	E268 F272 R296 E297 F301 E302 A303	E268-K299 HydrophobicContact CG-CB 4.19Å; E268-K299 HydrophobicContact CG-CG 4.4Å; F272-K299 HydrophobicContact CE2-CB 4.1Å; F272-K299 HydrophobicContact CE2-CD 4.15Å; F272-K299 HydrophobicContact CE2-CG 4.48Å; F272-K299 HydrophobicContact CZ-CD 4.11Å; R296-K299 HydrophobicContact CB-CG 4.36Å; R296-K299 WeakPolarHBondContact O-CB 3.31Å; R296-K299 PolarHBondContact O-N 3.45Å; E297-K299 VanDerWaalsContact C-N 3.33Å; E297-K299 PolarHBondContact O-N 2.9Å; K299-F301 VanDerWaalsContact C-N 3.32Å; K299-E302 WeakPolarHBondContact CD-OE2 3.38Å; K299-E302 IonicContact NZ-OE2 3.38Å; K299-E302 PolarHBondContact NZ-OE2 3.02Å; K299-E302 PolarHBondContact O-N 2.84Å; K299-A303 WeakPolarHBondContact O-CB 3.49Å; K299-A303 PolarHBondContact O-N 2.7Å
300	I	97.8	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-43.1	173.3	-63.2	168.9	0	0	0	110.2	L271 L288 L293 A295 R296 E297 T304 I335	L271-I300 HydrophobicContact CD1-CG1 3.88Å; L288-I300 HydrophobicContact CD2-CG2 3.42Å; L288-I300 VanDerWaalsContact CD2-CG2 3.42Å; L293-I300 HydrophobicContact CD2-CD1 3.64Å; L293-I300 HydrophobicContact CD2-CG1 4.05Å; L293-I300 HydrophobicContact CG-CD1 4.32Å; A295-I300 HydrophobicContact CB-CD1 4.1Å; A295-I300 HydrophobicContact CB-CG1 3.87Å; R296-I300 WeakPolarHBondContact O-CG1 3.16Å; R296-I300 PolarHBondContact O-N 2.86Å; E297-I300 PolarHBondContact O-N 3.41Å; I300-T304 WeakPolarHBondContact O-CB 3.16Å; I300-T304 PolarHBondContact O-N 3.25Å; I300-T304 PolarHBondContact O-OG1 3.45Å; I300-I335 HydrophobicContact CG2-CD1 3.87Å
301	F	98.1	Very high	97	Very high	6 Å²	6	34.5 Å²	34.5	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-49.7	175.8	171.8	-104.1	0	0	0	111.9	E297 S298 K299 A303 T304 I305 F332 I335 F337 M340 V349 S352 V354	E297-F301 WeakPolarHBondContact O-CB 3.39Å; E297-F301 PolarHBondContact O-N 3.27Å; S298-F301 WeakPolarHBondContact O-CB 3.28Å; S298-F301 PolarHBondContact O-N 2.91Å; K299-F301 VanDerWaalsContact C-N 3.32Å; F301-A303 VanDerWaalsContact C-N 3.32Å; F301-A303 PolarHBondContact O-N 3.49Å; F301-T304 WeakPolarHBondContact O-CB 3.26Å; F301-T304 PolarHBondContact O-N 2.78Å; F301-I305 HydrophobicContact CD1-CG1 4.33Å; F301-I305 HydrophobicContact CD2-CD1 4.41Å; F301-I305 HydrophobicContact CD2-CG1 4.06Å; F301-I305 HydrophobicContact CE1-CG1 3.84Å; F301-I305 HydrophobicContact CE2-CD1 3.64Å; F301-I305 HydrophobicContact CE2-CG1 3.56Å; F301-I305 HydrophobicContact CG-CG1 4.44Å; F301-I305 HydrophobicContact CZ-CD1 3.78Å; F301-I305 HydrophobicContact CZ-CG1 3.43Å; F301-I305 VanDerWaalsContact CZ-CG1 3.43Å; F301-I305 WeakPolarHBondContact O-CG1 3.38Å; F301-I305 PolarHBondContact O-N 3.1Å; F301-F332 HydrophobicContact CE2-CE2 4.49Å; F301-I335 HydrophobicContact CB-CG2 4.22Å; F301-I335 HydrophobicContact CD2-CG2 4.39Å; F301-F337 AromaticContact CD2-CE1 3.44Å; F301-F337 HydrophobicContact CD2-CE1 3.44Å; F301-F337 VanDerWaalsContact CD2-CE1 3.44Å; F301-F337 AromaticContact CD2-CZ 3.8Å; F301-F337 HydrophobicContact CD2-CZ 3.8Å; F301-F337 AromaticContact CE2-CE1 3.7Å; F301-F337 HydrophobicContact CE2-CE1 3.7Å; F301-F337 AromaticContact CE2-CZ 3.9Å; F301-F337 HydrophobicContact CE2-CZ 3.9Å; F301-F337 HydrophobicContact CG-CE1 4.09Å; F301-M340 HydrophobicContact CB-CE 3.73Å; F301-M340 HydrophobicContact CG-CE 4.35Å; F301-V349 HydrophobicContact CD1-CG2 3.83Å; F301-V349 HydrophobicContact CE1-CB 4.2Å; F301-V349 HydrophobicContact CE1-CG1 4.32Å; F301-V349 HydrophobicContact CE1-CG2 3.91Å; F301-V349 HydrophobicContact CE2-CG1 4.21Å; F301-V349 HydrophobicContact CG-CG2 4.2Å; F301-V349 HydrophobicContact CZ-CB 4.34Å; F301-V349 HydrophobicContact CZ-CG1 3.96Å; F301-V349 HydrophobicContact CZ-CG2 4.34Å; F301-S352 WeakPolarHBondContact CZ-OG 3.06Å; F301-V354 HydrophobicContact CE2-CG2 3.89Å; F301-V354 HydrophobicContact CZ-CG2 3.88Å
302	E	97.6	Very high	97	Very high	81 Å²	81	30.8 Å²	30.8	38%	0.379	14%	0.14	S	C	.	.	H	α-helix	trans	-53.6	-48.8	177.3	-173.5	-177.2	173.8	0	0	111.4	F272 S298 K299 T304 I305 R306	F272-E302 HydrophobicContact CE1-CB 4.4Å; F272-E302 HydrophobicContact CE1-CG 3.86Å; F272-E302 HydrophobicContact CZ-CB 4.04Å; F272-E302 HydrophobicContact CZ-CG 3.91Å; F272-E302 WeakPolarHBondContact CZ-OE2 3.42Å; S298-E302 PolarHBondContact O-N 2.96Å; K299-E302 WeakPolarHBondContact CD-OE2 3.38Å; K299-E302 IonicContact NZ-OE2 3.38Å; K299-E302 PolarHBondContact NZ-OE2 3.02Å; K299-E302 PolarHBondContact O-N 2.84Å; E302-T304 PolarHBondContact O-N 2.85Å; E302-I305 PolarHBondContact O-N 3.41Å; E302-R306 PolarHBondContact O-N 2.91Å
303	A	97.8	Very high	97	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-63.7	-38.4	176.4	0	0	0	0	0	112.8	L271 F276 K299 F301 R306 W307	L271-A303 HydrophobicContact CB-CB 3.71Å; F276-A303 HydrophobicContact CD1-CB 4.27Å; F276-A303 HydrophobicContact CE1-CB 3.95Å; K299-A303 WeakPolarHBondContact O-CB 3.49Å; K299-A303 PolarHBondContact O-N 2.7Å; F301-A303 VanDerWaalsContact C-N 3.32Å; F301-A303 PolarHBondContact O-N 3.49Å; A303-R306 WeakPolarHBondContact O-CB 3.45Å; A303-R306 PolarHBondContact O-N 3.16Å; A303-W307 PolarHBondContact O-N 3.39Å
304	T	98	Very high	96.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-39.9	178.2	-59.1	0	0	0	0	111.9	L288 I300 F301 E302 R306 W307 A308 L328 I335	L288-T304 HydrophobicContact CD1-CG2 4.1Å; I300-T304 WeakPolarHBondContact O-CB 3.16Å; I300-T304 PolarHBondContact O-N 3.25Å; I300-T304 PolarHBondContact O-OG1 3.45Å; F301-T304 WeakPolarHBondContact O-CB 3.26Å; F301-T304 PolarHBondContact O-N 2.78Å; E302-T304 PolarHBondContact O-N 2.85Å; T304-R306 VanDerWaalsContact C-N 3.32Å; T304-W307 PolarHBondContact O-N 2.94Å; T304-A308 PolarHBondContact O-N 2.87Å; T304-L328 HydrophobicContact CG2-CD1 3.95Å; T304-L328 HydrophobicContact CG2-CD2 3.38Å; T304-L328 HydrophobicContact CG2-CG 4.32Å; T304-I335 HydrophobicContact CG2-CD1 4.33Å
305	I	97.8	Very high	97	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-40.7	173.7	-68.7	-52.7	0	0	0	110.8	F301 E302 A308 E309 K324 L328 V354	F301-I305 HydrophobicContact CD1-CG1 4.33Å; F301-I305 HydrophobicContact CD2-CD1 4.41Å; F301-I305 HydrophobicContact CD2-CG1 4.06Å; F301-I305 HydrophobicContact CE1-CG1 3.84Å; F301-I305 HydrophobicContact CE2-CD1 3.64Å; F301-I305 HydrophobicContact CE2-CG1 3.56Å; F301-I305 HydrophobicContact CG-CG1 4.44Å; F301-I305 HydrophobicContact CZ-CD1 3.78Å; F301-I305 HydrophobicContact CZ-CG1 3.43Å; F301-I305 VanDerWaalsContact CZ-CG1 3.43Å; F301-I305 WeakPolarHBondContact O-CG1 3.38Å; F301-I305 PolarHBondContact O-N 3.1Å; E302-I305 PolarHBondContact O-N 3.41Å; I305-A308 WeakPolarHBondContact O-CB 3.16Å; I305-A308 PolarHBondContact O-N 3.25Å; I305-A308 VanDerWaalsContact O-N 3.17Å; I305-E309 WeakPolarHBondContact O-CG 3.21Å; I305-E309 PolarHBondContact O-N 2.65Å; I305-K324 HydrophobicContact CG2-CD 4.01Å; I305-L328 HydrophobicContact CD1-CD1 4.23Å; I305-V354 HydrophobicContact CD1-CG1 3.87Å; I305-V354 HydrophobicContact CD1-CG2 4.28Å
306	R	97.1	Very high	97	Very high	92 Å²	92	51.2 Å²	51.2	35%	0.347	22%	0.217	S	C	.	.	H	α-helix	trans	-62.8	-45.3	174.7	-167.4	169.7	-175.7	171.8	-3.9	111.8	W277 E302 A303 T304 A308 E309 Y310	W277-R306 HydrophobicContact CE3-CG 3.86Å; W277-R306 VanDerWaalsContact CZ3-CD 3.48Å; W277-R306 HydrophobicContact CZ3-CG 4.2Å; E302-R306 PolarHBondContact O-N 2.91Å; A303-R306 WeakPolarHBondContact O-CB 3.45Å; A303-R306 PolarHBondContact O-N 3.16Å; T304-R306 VanDerWaalsContact C-N 3.32Å; R306-A308 VanDerWaalsContact C-N 3.25Å; R306-A308 PolarHBondContact O-N 2.73Å; R306-E309 WeakPolarHBondContact O-CB 3.23Å; R306-E309 PolarHBondContact O-N 3.38Å; R306-Y310 HydrophobicContact CG-CD2 4.27Å; R306-Y310 HydrophobicContact CG-CE2 4.13Å; R306-Y310 WeakPolarHBondContact O-CD2 3.19Å; R306-Y310 PolarHBondContact O-N 3.46Å
307	W	98.1	Very high	97.1	Very high	1 Å²	1	49.1 Å²	49.1	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-54.2	-44.5	171.6	-179.8	102.5	0	0	0	111.3	F276 V279 F281 L284 A303 T304 E309 Y310 E311 V327 L328	F276-W307 HydrophobicContact CE1-CB 4.09Å; V279-W307 PolarHBondContact O-NE1 2.61Å; F281-W307 AromaticContact CD2-CH2 3.94Å; F281-W307 HydrophobicContact CD2-CH2 3.94Å; L284-W307 HydrophobicContact CD1-CD2 4.32Å; L284-W307 HydrophobicContact CD1-CG 4.13Å; L284-W307 HydrophobicContact CD2-CD2 3.66Å; L284-W307 HydrophobicContact CD2-CE3 3.61Å; L284-W307 HydrophobicContact CD2-CG 4.34Å; L284-W307 HydrophobicContact CD2-CH2 3.9Å; L284-W307 HydrophobicContact CD2-CZ2 3.91Å; L284-W307 HydrophobicContact CD2-CZ3 3.74Å; L284-W307 HydrophobicContact CG-CD2 4.48Å; A303-W307 PolarHBondContact O-N 3.39Å; T304-W307 PolarHBondContact O-N 2.94Å; W307-E309 VanDerWaalsContact C-N 3.34Å; W307-E309 PolarHBondContact O-N 2.94Å; W307-Y310 PolarHBondContact O-N 3.42Å; W307-E311 HydrophobicContact CE3-CB 4.16Å; W307-E311 HydrophobicContact CH2-CB 3.96Å; W307-E311 HydrophobicContact CH2-CG 3.7Å; W307-E311 HydrophobicContact CZ2-CB 4.38Å; W307-E311 HydrophobicContact CZ2-CG 4.31Å; W307-E311 HydrophobicContact CZ3-CB 3.85Å; W307-E311 HydrophobicContact CZ3-CG 3.94Å; W307-E311 WeakPolarHBondContact O-CB 3.38Å; W307-E311 PolarHBondContact O-N 2.89Å; W307-V327 HydrophobicContact CZ3-CG2 4.45Å; W307-L328 HydrophobicContact CE3-CD2 3.64Å; W307-L328 HydrophobicContact CZ3-CD2 3.87Å
308	A	98.1	Very high	97	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.5	-36.6	-179.9	0	0	0	0	0	113	T304 I305 R306 E311 C312 K324 V327 L328	T304-A308 PolarHBondContact O-N 2.87Å; I305-A308 WeakPolarHBondContact O-CB 3.16Å; I305-A308 PolarHBondContact O-N 3.25Å; I305-A308 VanDerWaalsContact O-N 3.17Å; R306-A308 VanDerWaalsContact C-N 3.25Å; R306-A308 PolarHBondContact O-N 2.73Å; A308-E311 PolarHBondContact O-N 2.72Å; A308-C312 PolarHBondContact O-N 3.39Å; A308-C312 PolarHBondContact O-SG 2.76Å; A308-K324 HydrophobicContact CB-CB 3.91Å; A308-K324 HydrophobicContact CB-CG 4.15Å; A308-V327 HydrophobicContact CB-CG2 3.83Å; A308-L328 HydrophobicContact CB-CD1 3.85Å; A308-L328 HydrophobicContact CB-CD2 3.98Å; A308-L328 HydrophobicContact CB-CG 3.67Å
309	E	97.2	Very high	97	Very high	62 Å²	62	57.7 Å²	57.7	29%	0.29	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-48.2	175.2	-74.8	168.4	-174.1	0	0	111.9	I305 R306 W307 E311 C312 Q313 A319 K324	I305-E309 WeakPolarHBondContact O-CG 3.21Å; I305-E309 PolarHBondContact O-N 2.65Å; R306-E309 WeakPolarHBondContact O-CB 3.23Å; R306-E309 PolarHBondContact O-N 3.38Å; W307-E309 VanDerWaalsContact C-N 3.34Å; W307-E309 PolarHBondContact O-N 2.94Å; E309-E311 VanDerWaalsContact C-N 3.34Å; E309-C312 WeakPolarHBondContact O-CB 3.21Å; E309-C312 PolarHBondContact O-N 2.68Å; E309-Q313 WeakPolarHBondContact O-CG 3.47Å; E309-Q313 PolarHBondContact O-N 3.41Å; E309-Q313 VanDerWaalsContact O-N 3.07Å; E309-A319 HydrophobicContact CG-CB 4.41Å; E309-K324 HydrophobicContact CG-CD 3.92Å; E309-K324 IonicContact OE1-NZ 3.55Å; E309-K324 PolarHBondContact OE1-NZ 3.32Å
310	Y	96.7	Very high	97	Very high	77 Å²	77	57.9 Å²	57.9	30%	0.302	27%	0.266	S	S	.	.	H	α-helix	trans	-67.1	-36.3	177	-81.5	-94.9	0	0	0	111.7	W277 R306 W307 C312 Q313 R314	W277-Y310 HydrophobicContact CB-CD2 4.06Å; W277-Y310 HydrophobicContact CB-CG 4.05Å; W277-Y310 AromaticContact CD1-CD1 3.79Å; W277-Y310 AromaticContact CD1-CG 3.86Å; W277-Y310 HydrophobicContact CD2-CD2 4.08Å; W277-Y310 AromaticContact CD2-CE2 3.95Å; W277-Y310 HydrophobicContact CD2-CE2 3.95Å; W277-Y310 AromaticContact CE2-CE2 3.99Å; W277-Y310 AromaticContact CE2-CZ 3.82Å; W277-Y310 HydrophobicContact CE3-CE2 4.44Å; W277-Y310 HydrophobicContact CG-CD1 4.25Å; W277-Y310 AromaticContact CG-CD2 3.83Å; W277-Y310 HydrophobicContact CG-CD2 3.83Å; W277-Y310 HydrophobicContact CG-CE2 4.15Å; W277-Y310 AromaticContact CG-CG 3.87Å; W277-Y310 HydrophobicContact CG-CG 3.87Å; W277-Y310 HydrophobicContact CZ2-CE2 4.44Å; W277-Y310 AromaticContact NE1-CE1 3.79Å; W277-Y310 AromaticContact NE1-CZ 3.93Å; R306-Y310 HydrophobicContact CG-CD2 4.27Å; R306-Y310 HydrophobicContact CG-CE2 4.13Å; R306-Y310 WeakPolarHBondContact O-CD2 3.19Å; R306-Y310 PolarHBondContact O-N 3.46Å; W307-Y310 PolarHBondContact O-N 3.42Å; Y310-C312 VanDerWaalsContact C-N 3.33Å; Y310-C312 PolarHBondContact O-N 2.8Å; Y310-Q313 WeakPolarHBondContact O-CB 3.29Å; Y310-Q313 PolarHBondContact O-N 2.76Å; Y310-R314 WeakPolarHBondContact O-CG 3.36Å; Y310-R314 PolarHBondContact O-N 3.11Å
311	E	97.3	Very high	97	Very high	22 Å²	22	60.3 Å²	60.3	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-37.5	173.9	-174.6	63.3	-176.2	0	0	112.2	W307 A308 E309 Q313 R314 R315 V327	W307-E311 HydrophobicContact CE3-CB 4.16Å; W307-E311 HydrophobicContact CH2-CB 3.96Å; W307-E311 HydrophobicContact CH2-CG 3.7Å; W307-E311 HydrophobicContact CZ2-CB 4.38Å; W307-E311 HydrophobicContact CZ2-CG 4.31Å; W307-E311 HydrophobicContact CZ3-CB 3.85Å; W307-E311 HydrophobicContact CZ3-CG 3.94Å; W307-E311 WeakPolarHBondContact O-CB 3.38Å; W307-E311 PolarHBondContact O-N 2.89Å; A308-E311 PolarHBondContact O-N 2.72Å; E309-E311 VanDerWaalsContact C-N 3.34Å; E311-Q313 VanDerWaalsContact C-N 3.33Å; E311-Q313 PolarHBondContact O-N 2.84Å; E311-R314 PolarHBondContact O-N 3.24Å; E311-R314 IonicContact OE2-CZ 2.79Å; E311-R314 IonicContact OE2-NE 2.74Å; E311-R314 PolarHBondContact OE2-NE 3.03Å; E311-R314 IonicContact OE2-NH2 3.37Å; E311-R314 PolarHBondContact OE2-NH2 3Å; E311-R315 WeakPolarHBondContact O-CB 3.43Å; E311-R315 WeakPolarHBondContact O-CG 3.11Å; E311-R315 PolarHBondContact O-N 3.13Å; E311-R315 IonicContact OE1-CZ 3.54Å; E311-R315 IonicContact OE1-NE 3.5Å; E311-R315 PolarHBondContact OE1-NE 2.91Å; E311-R315 IonicContact OE1-NH2 2.75Å; E311-R315 PolarHBondContact OE1-NH2 3.41Å; E311-V327 HydrophobicContact CB-CB 4.37Å; E311-V327 HydrophobicContact CB-CG2 4.19Å; E311-V327 HydrophobicContact CG-CB 3.84Å; E311-V327 HydrophobicContact CG-CG1 4.19Å; E311-V327 HydrophobicContact CG-CG2 4.21Å
312	C	97.6	Very high	96.9	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-45.3	171.5	-68.5	0	0	0	0	110.7	A308 E309 Y310 R315 Q316 L317 A319	A308-C312 PolarHBondContact O-N 3.39Å; A308-C312 PolarHBondContact O-SG 2.76Å; E309-C312 WeakPolarHBondContact O-CB 3.21Å; E309-C312 PolarHBondContact O-N 2.68Å; Y310-C312 VanDerWaalsContact C-N 3.33Å; Y310-C312 PolarHBondContact O-N 2.8Å; C312-R315 CarbonylContact O-C 3.54Å; C312-R315 PolarHBondContact O-N 2.94Å; C312-Q316 PolarHBondContact O-N 3.48Å; C312-L317 CarbonylContact C-O 3.59Å; C312-L317 HydrophobicContact CB-CB 4.18Å; C312-L317 PolarHBondContact O-N 3Å; C312-A319 HydrophobicContact CB-CB 4.2Å
313	Q	96.4	Very high	96.9	Very high	122 Å²	122	64 Å²	64	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-61.3	-45.3	177.1	-67.7	175.9	2	0	0	112.3	E309 Y310 E311 R315 Q316	E309-Q313 WeakPolarHBondContact O-CG 3.47Å; E309-Q313 PolarHBondContact O-N 3.41Å; E309-Q313 VanDerWaalsContact O-N 3.07Å; Y310-Q313 WeakPolarHBondContact O-CB 3.29Å; Y310-Q313 PolarHBondContact O-N 2.76Å; E311-Q313 VanDerWaalsContact C-N 3.33Å; E311-Q313 PolarHBondContact O-N 2.84Å; Q313-R315 PolarHBondContact O-N 3.35Å; Q313-Q316 PolarHBondContact O-N 3.04Å
314	R	95.5	Very high	96.9	Very high	121 Å²	121	65.3 Å²	65.3	46%	0.457	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-37.8	176.3	-72	-166.5	-69.5	-154.3	-3.3	112.1	W277 E278 V279 Y310 E311 Q316	W277-R314 PolarHBondContact O-NH2 3.3Å; E278-R314 PolarHBondContact O-NH1 3.41Å; V279-R314 PolarHBondContact O-NH2 2.78Å; Y310-R314 WeakPolarHBondContact O-CG 3.36Å; Y310-R314 PolarHBondContact O-N 3.11Å; E311-R314 PolarHBondContact O-N 3.24Å; E311-R314 IonicContact OE2-CZ 2.79Å; E311-R314 IonicContact OE2-NE 2.74Å; E311-R314 PolarHBondContact OE2-NE 3.03Å; E311-R314 IonicContact OE2-NH2 3.37Å; E311-R314 PolarHBondContact OE2-NH2 3Å; R314-Q316 VanDerWaalsContact C-N 3.31Å
315	R	96	Very high	96.8	Very high	116 Å²	116	67.8 Å²	67.8	44%	0.438	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	5.5	177.5	-63	-174.4	-169.7	-169.9	7.9	114.1	E311 C312 Q313 L317	E311-R315 WeakPolarHBondContact O-CB 3.43Å; E311-R315 WeakPolarHBondContact O-CG 3.11Å; E311-R315 PolarHBondContact O-N 3.13Å; E311-R315 IonicContact OE1-CZ 3.54Å; E311-R315 IonicContact OE1-NE 3.5Å; E311-R315 PolarHBondContact OE1-NE 2.91Å; E311-R315 IonicContact OE1-NH2 2.75Å; E311-R315 PolarHBondContact OE1-NH2 3.41Å; C312-R315 CarbonylContact O-C 3.54Å; C312-R315 PolarHBondContact O-N 2.94Å; Q313-R315 PolarHBondContact O-N 3.35Å; R315-L317 HydrophobicContact CB-CD1 3.96Å; R315-L317 HydrophobicContact CB-CG 3.95Å; R315-L317 PolarHBondContact O-N 3.32Å
316	Q	95.8	Very high	96.8	Very high	183 Å²	183	73.5 Å²	73.5	86%	0.855	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	35.4	-177.2	-55.7	175.8	-8.9	0	0	113.2	C312 Q313 R314	C312-Q316 PolarHBondContact O-N 3.48Å; Q313-Q316 PolarHBondContact O-N 3.04Å; R314-Q316 VanDerWaalsContact C-N 3.31Å
317	L	96.1	Very high	96.8	Very high	72 Å²	72	69.2 Å²	69.2	38%	0.377	33%	0.331	S	S	.	.			trans	-101.3	144.7	175.6	-59.9	175.1	0	0	0	110	C312 R315 A319 V327	C312-L317 CarbonylContact C-O 3.59Å; C312-L317 HydrophobicContact CB-CB 4.18Å; C312-L317 PolarHBondContact O-N 3Å; R315-L317 HydrophobicContact CB-CD1 3.96Å; R315-L317 HydrophobicContact CB-CG 3.95Å; R315-L317 PolarHBondContact O-N 3.32Å; L317-A319 PolarHBondContact O-N 3.17Å; L317-V327 HydrophobicContact CD1-CG1 4.15Å
318	E	95.8	Very high	96.8	Very high	156 Å²	156	69.2 Å²	69.2	73%	0.729	33%	0.331	S	S	*	.			trans	-66.6	132.4	168.6	-171.8	-178.9	-179.9	0	0	109.8	T320 S323	E318-T320 HydrophobicContact CB-CG2 4.21Å; E318-T320 HydrophobicContact CG-CG2 3.86Å; E318-T320 PolarHBondContact O-N 3.48Å; E318-S323 WeakPolarHBondContact O-CB 3.2Å; E318-S323 PolarHBondContact O-OG 3.05Å
319	A	96.1	Very high	96.7	Very high	41 Å²	41	70.7 Å²	70.7	34%	0.339	35%	0.346	S	S	.	.			trans	-76.3	52.2	-175.4	0	0	0	0	0	113.4	E309 C312 L317 K324	E309-A319 HydrophobicContact CG-CB 4.41Å; C312-A319 HydrophobicContact CB-CB 4.2Å; L317-A319 PolarHBondContact O-N 3.17Å; A319-K324 WeakPolarHBondContact O-CE 3.44Å
320	T	97.1	Very high	96.7	Very high	45 Å²	45	71.2 Å²	71.2	28%	0.276	36%	0.357	S	S	.	.			trans	-74.4	158.6	173.9	75.4	0	0	0	0	111.2	E318 L322 S323 K324	E318-T320 HydrophobicContact CB-CG2 4.21Å; E318-T320 HydrophobicContact CG-CG2 3.86Å; E318-T320 PolarHBondContact O-N 3.48Å; T320-L322 PolarHBondContact O-N 2.99Å; T320-S323 WeakPolarHBondContact O-CB 3.49Å; T320-S323 PolarHBondContact O-N 3.18Å; T320-S323 VanDerWaalsContact O-N 3.08Å; T320-S323 PolarHBondContact OG1-N 3.21Å; T320-S323 VanDerWaalsContact OG1-N 3.16Å; T320-S323 PolarHBondContact OG1-OG 3.2Å; T320-K324 WeakPolarHBondContact O-CG 3.47Å; T320-K324 PolarHBondContact O-N 3.43Å
321	P	96.4	Very high	96.8	Very high	52 Å²	52	67.5 Å²	67.5	34%	0.338	34%	0.342	S	S	.	.	H	α-helix	trans	-54.9	-37.6	176.8	-26.9	35.1	0	0	0	113.9	K324 R325 S352 G353 V354	P321-K324 PolarHBondContact O-N 2.89Å; P321-R325 WeakPolarHBondContact O-CB 3.26Å; P321-R325 PolarHBondContact O-N 3.25Å; P321-S352 WeakPolarHBondContact CG-O 3.43Å; P321-G353 WeakPolarHBondContact CB-O 3.16Å; P321-V354 HydrophobicContact CB-CG1 4.16Å
322	L	96	Very high	96.8	Very high	139 Å²	139	66.5 Å²	66.5	73%	0.728	34%	0.338	S	S	*	.	H	α-helix	trans	-67.3	-43.4	175.9	-67.9	175.8	0	0	0	111.9	T320 R325 H326	T320-L322 PolarHBondContact O-N 2.99Å; L322-R325 PolarHBondContact O-N 3.19Å; L322-H326 WeakPolarHBondContact O-CB 3.22Å; L322-H326 PolarHBondContact O-N 3.32Å
323	S	97.2	Very high	96.7	Very high	25 Å²	25	70.2 Å²	70.2	18%	0.175	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-44.9	175.6	-55.7	0	0	0	0	111.3	E318 T320 R325 H326 V327	E318-S323 WeakPolarHBondContact O-CB 3.2Å; E318-S323 PolarHBondContact O-OG 3.05Å; T320-S323 WeakPolarHBondContact O-CB 3.49Å; T320-S323 PolarHBondContact O-N 3.18Å; T320-S323 VanDerWaalsContact O-N 3.08Å; T320-S323 PolarHBondContact OG1-N 3.21Å; T320-S323 VanDerWaalsContact OG1-N 3.16Å; T320-S323 PolarHBondContact OG1-OG 3.2Å; S323-R325 PolarHBondContact O-N 3.33Å; S323-H326 WeakPolarHBondContact O-CB 3Å; S323-H326 PolarHBondContact O-N 2.93Å; S323-H326 VanDerWaalsContact O-N 3.16Å; S323-V327 PolarHBondContact O-N 3.18Å
324	K	98	Very high	96.8	Very high	29 Å²	29	66 Å²	66	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-46.7	177.2	-67.3	-176.8	-157.4	-175.1	0	111.1	I305 A308 E309 A319 T320 P321 H326 V327 L328	I305-K324 HydrophobicContact CG2-CD 4.01Å; A308-K324 HydrophobicContact CB-CB 3.91Å; A308-K324 HydrophobicContact CB-CG 4.15Å; E309-K324 HydrophobicContact CG-CD 3.92Å; E309-K324 IonicContact OE1-NZ 3.55Å; E309-K324 PolarHBondContact OE1-NZ 3.32Å; A319-K324 WeakPolarHBondContact O-CE 3.44Å; T320-K324 WeakPolarHBondContact O-CG 3.47Å; T320-K324 PolarHBondContact O-N 3.43Å; P321-K324 PolarHBondContact O-N 2.89Å; K324-H326 VanDerWaalsContact C-N 3.32Å; K324-H326 PolarHBondContact O-N 3.33Å; K324-V327 VanDerWaalsContact O-CG2 3.27Å; K324-V327 WeakPolarHBondContact O-CG2 3.42Å; K324-V327 PolarHBondContact O-N 3.42Å; K324-L328 WeakPolarHBondContact O-CB 3.34Å; K324-L328 VanDerWaalsContact O-CG 3.25Å; K324-L328 WeakPolarHBondContact O-CG 3.49Å; K324-L328 PolarHBondContact O-N 3.14Å; K324-L328 VanDerWaalsContact O-N 3.12Å
325	R	97.2	Very high	96.9	Very high	52 Å²	52	60.2 Å²	60.2	20%	0.196	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-42	175.4	-169.2	-176	-177.2	109.7	1.7	111.9	P321 L322 S323 L328 G329 F332 V354 E359	P321-R325 WeakPolarHBondContact O-CB 3.26Å; P321-R325 PolarHBondContact O-N 3.25Å; L322-R325 PolarHBondContact O-N 3.19Å; S323-R325 PolarHBondContact O-N 3.33Å; R325-L328 PolarHBondContact O-N 3.01Å; R325-G329 PolarHBondContact O-N 2.88Å; R325-F332 VanDerWaalsContact NH1-CE1 3.29Å; R325-V354 WeakPolarHBondContact CD-O 3.03Å; R325-V354 PolarHBondContact NH1-O 3.44Å; R325-E359 IonicContact CZ-OE1 3.73Å; R325-E359 IonicContact CZ-OE2 2.64Å; R325-E359 IonicContact NH1-OE1 3.63Å; R325-E359 IonicContact NH1-OE2 2.71Å; R325-E359 PolarHBondContact NH1-OE2 3.04Å; R325-E359 IonicContact NH2-OE1 3.66Å; R325-E359 PolarHBondContact NH2-OE1 2.71Å; R325-E359 IonicContact NH2-OE2 3.56Å; R325-E359 PolarHBondContact NH2-OE2 3.23Å
326	H	97.3	Very high	97	Very high	136 Å²	136	55.1 Å²	55.1	63%	0.63	30%	0.295	S	S	*	.	H	α-helix	trans	-62.5	-47.3	179.5	177.5	69.4	0	0	0	112.4	L322 S323 K324 L328 G329	L322-H326 WeakPolarHBondContact O-CB 3.22Å; L322-H326 PolarHBondContact O-N 3.32Å; S323-H326 WeakPolarHBondContact O-CB 3Å; S323-H326 PolarHBondContact O-N 2.93Å; S323-H326 VanDerWaalsContact O-N 3.16Å; K324-H326 VanDerWaalsContact C-N 3.32Å; K324-H326 PolarHBondContact O-N 3.33Å; H326-L328 VanDerWaalsContact C-N 3.33Å; H326-L328 PolarHBondContact O-N 2.81Å; H326-G329 PolarHBondContact O-N 2.89Å
327	V	97.6	Very high	97	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-28.8	-179.8	-60.7	0	0	0	0	113	W307 A308 E311 L317 S323 K324 G329	W307-V327 HydrophobicContact CZ3-CG2 4.45Å; A308-V327 HydrophobicContact CB-CG2 3.83Å; E311-V327 HydrophobicContact CB-CB 4.37Å; E311-V327 HydrophobicContact CB-CG2 4.19Å; E311-V327 HydrophobicContact CG-CB 3.84Å; E311-V327 HydrophobicContact CG-CG1 4.19Å; E311-V327 HydrophobicContact CG-CG2 4.21Å; L317-V327 HydrophobicContact CD1-CG1 4.15Å; S323-V327 PolarHBondContact O-N 3.18Å; K324-V327 VanDerWaalsContact O-CG2 3.27Å; K324-V327 WeakPolarHBondContact O-CG2 3.42Å; K324-V327 PolarHBondContact O-N 3.42Å; V327-G329 VanDerWaalsContact C-N 3.34Å
328	L	97.8	Very high	97	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.6	-24.8	174.3	-72	171.1	0	0	0	113.3	F281 L284 T304 I305 W307 A308 K324 R325 H326 S330 A331 F332	F281-L328 VanDerWaalsContact CE2-O 3.29Å; F281-L328 WeakPolarHBondContact CE2-O 3.49Å; L284-L328 HydrophobicContact CD2-CD2 4.1Å; T304-L328 HydrophobicContact CG2-CD1 3.95Å; T304-L328 HydrophobicContact CG2-CD2 3.38Å; T304-L328 HydrophobicContact CG2-CG 4.32Å; I305-L328 HydrophobicContact CD1-CD1 4.23Å; W307-L328 HydrophobicContact CE3-CD2 3.64Å; W307-L328 HydrophobicContact CZ3-CD2 3.87Å; A308-L328 HydrophobicContact CB-CD1 3.85Å; A308-L328 HydrophobicContact CB-CD2 3.98Å; A308-L328 HydrophobicContact CB-CG 3.67Å; K324-L328 WeakPolarHBondContact O-CB 3.34Å; K324-L328 VanDerWaalsContact O-CG 3.25Å; K324-L328 WeakPolarHBondContact O-CG 3.49Å; K324-L328 PolarHBondContact O-N 3.14Å; K324-L328 VanDerWaalsContact O-N 3.12Å; R325-L328 PolarHBondContact O-N 3.01Å; H326-L328 VanDerWaalsContact C-N 3.33Å; H326-L328 PolarHBondContact O-N 2.81Å; L328-S330 PolarHBondContact O-N 3.41Å; L328-A331 WeakPolarHBondContact O-CA 3.22Å; L328-A331 VanDerWaalsContact O-CB 3.28Å; L328-A331 WeakPolarHBondContact O-CB 3.23Å; L328-A331 PolarHBondContact O-N 3.33Å; L328-F332 HydrophobicContact CB-CB 3.93Å; L328-F332 HydrophobicContact CD1-CD2 3.86Å; L328-F332 PolarHBondContact O-N 3.3Å
329	G	96.4	Very high	97	Very high	32 Å²	32	37.4 Å²	37.4	33%	0.33	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	46.3	-125.1	173	0	0	0	0	0	113.9	R325 H326 V327 A331 F332 H333	R325-G329 PolarHBondContact O-N 2.88Å; H326-G329 PolarHBondContact O-N 2.89Å; V327-G329 VanDerWaalsContact C-N 3.34Å; G329-A331 VanDerWaalsContact C-N 3.3Å; G329-A331 PolarHBondContact O-N 2.9Å; G329-F332 WeakPolarHBondContact O-CB 3.44Å; G329-H333 PolarHBondContact O-ND1 2.82Å
330	S	96.9	Very high	97	Very high	72 Å²	72	35.9 Å²	35.9	50%	0.503	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-67.9	-26.1	178.4	56.4	0	0	0	0	113.9	L328 F332 H333	L328-S330 PolarHBondContact O-N 3.41Å; S330-F332 PolarHBondContact O-N 2.92Å; S330-H333 PolarHBondContact O-N 2.95Å
331	A	97.6	Very high	96.9	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-66.9	-28.1	-178.2	0	0	0	0	0	111.9	F281 L284 L288 L328 G329 H333 L334	F281-A331 HydrophobicContact CE2-CB 3.95Å; F281-A331 HydrophobicContact CZ-CB 4.01Å; L284-A331 HydrophobicContact CD2-CB 4.03Å; L284-A331 HydrophobicContact CG-CB 4.48Å; L288-A331 HydrophobicContact CD1-CB 4.18Å; L328-A331 WeakPolarHBondContact O-CA 3.22Å; L328-A331 VanDerWaalsContact O-CB 3.28Å; L328-A331 WeakPolarHBondContact O-CB 3.23Å; L328-A331 PolarHBondContact O-N 3.33Å; G329-A331 VanDerWaalsContact C-N 3.3Å; G329-A331 PolarHBondContact O-N 2.9Å; A331-H333 PolarHBondContact O-N 3.4Å; A331-L334 HydrophobicContact CB-CD1 4.48Å; A331-L334 VanDerWaalsContact O-CB 3.28Å; A331-L334 WeakPolarHBondContact O-CB 3.5Å; A331-L334 PolarHBondContact O-N 2.86Å
332	F	97.3	Very high	96.9	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-56.1	-36.7	174.2	-172.8	-106.7	0	0	0	113.2	F301 R325 L328 G329 S330 L334 I335 F337 V354 L355 F377	F301-F332 HydrophobicContact CE2-CE2 4.49Å; R325-F332 VanDerWaalsContact NH1-CE1 3.29Å; L328-F332 HydrophobicContact CB-CB 3.93Å; L328-F332 HydrophobicContact CD1-CD2 3.86Å; L328-F332 PolarHBondContact O-N 3.3Å; G329-F332 WeakPolarHBondContact O-CB 3.44Å; S330-F332 PolarHBondContact O-N 2.92Å; F332-L334 PolarHBondContact O-N 2.91Å; F332-I335 PolarHBondContact O-N 2.69Å; F332-F337 HydrophobicContact CE1-CE2 4.12Å; F332-F337 HydrophobicContact CE1-CZ 4.48Å; F332-F337 HydrophobicContact CE2-CE2 4.25Å; F332-F337 AromaticContact CE2-CZ 3.84Å; F332-F337 HydrophobicContact CE2-CZ 3.84Å; F332-F337 AromaticContact CZ-CE2 3.84Å; F332-F337 HydrophobicContact CZ-CE2 3.84Å; F332-F337 AromaticContact CZ-CZ 3.76Å; F332-F337 HydrophobicContact CZ-CZ 3.76Å; F332-V354 HydrophobicContact CE2-CB 4.37Å; F332-V354 HydrophobicContact CE2-CG2 3.76Å; F332-V354 HydrophobicContact CZ-CG2 3.89Å; F332-L355 HydrophobicContact CE1-CD2 3.66Å; F332-L355 HydrophobicContact CZ-CD2 3.51Å; F332-L355 HydrophobicContact CZ-CG 4.19Å; F332-F377 AromaticContact CD1-CE1 3.95Å; F332-F377 HydrophobicContact CD1-CE1 3.95Å; F332-F377 HydrophobicContact CD1-CZ 4.38Å; F332-F377 AromaticContact CE1-CE1 3.74Å; F332-F377 HydrophobicContact CE1-CE1 3.74Å; F332-F377 AromaticContact CE1-CZ 3.83Å; F332-F377 HydrophobicContact CE1-CZ 3.83Å
333	H	97.1	Very high	96.9	Very high	77 Å²	77	39 Å²	39	36%	0.356	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-78.5	0.5	-178.5	-57.1	86.5	0	0	0	113.1	G329 S330 A331 P378	G329-H333 PolarHBondContact O-ND1 2.82Å; S330-H333 PolarHBondContact O-N 2.95Å; A331-H333 PolarHBondContact O-N 3.4Å; H333-P378 VanDerWaalsContact O-CD 3.26Å; H333-P378 WeakPolarHBondContact O-CD 3.04Å
334	L	98	Very high	96.8	Very high	33 Å²	33	39.5 Å²	39.5	17%	0.173	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-89.2	-13.1	173.3	-58.7	173.9	0	0	0	112.6	T285 L288 R289 A331 F332	T285-L334 HydrophobicContact CG2-CD1 3.93Å; L288-L334 HydrophobicContact CB-CB 3.91Å; L288-L334 HydrophobicContact CB-CD1 3.82Å; R289-L334 HydrophobicContact CG-CD1 3.66Å; R289-L334 HydrophobicContact CG-CD2 3.7Å; R289-L334 HydrophobicContact CG-CG 4.29Å; A331-L334 HydrophobicContact CB-CD1 4.48Å; A331-L334 VanDerWaalsContact O-CB 3.28Å; A331-L334 WeakPolarHBondContact O-CB 3.5Å; A331-L334 PolarHBondContact O-N 2.86Å; F332-L334 PolarHBondContact O-N 2.91Å
335	I	97.9	Very high	96.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-74.6	130	176.4	-53.5	-59.4	0	0	0	109.3	L288 E297 I300 F301 T304 F332 F337 M340	L288-I335 HydrophobicContact CD1-CD1 4Å; L288-I335 HydrophobicContact CD2-CD1 3.77Å; L288-I335 HydrophobicContact CG-CD1 4.44Å; E297-I335 HydrophobicContact CG-CG2 4.15Å; E297-I335 WeakPolarHBondContact OE1-CA 3.29Å; I300-I335 HydrophobicContact CG2-CD1 3.87Å; F301-I335 HydrophobicContact CB-CG2 4.22Å; F301-I335 HydrophobicContact CD2-CG2 4.39Å; T304-I335 HydrophobicContact CG2-CD1 4.33Å; F332-I335 PolarHBondContact O-N 2.69Å; I335-F337 VanDerWaalsContact C-N 3.32Å; I335-F337 HydrophobicContact CB-CD2 4.3Å; I335-F337 HydrophobicContact CB-CE1 4.25Å; I335-F337 HydrophobicContact CB-CE2 3.78Å; I335-F337 HydrophobicContact CB-CZ 3.76Å; I335-F337 HydrophobicContact CG1-CZ 4.41Å; I335-F337 HydrophobicContact CG2-CD1 3.83Å; I335-F337 HydrophobicContact CG2-CD2 4.21Å; I335-F337 HydrophobicContact CG2-CE1 3.5Å; I335-F337 HydrophobicContact CG2-CE2 3.9Å; I335-F337 HydrophobicContact CG2-CG 4.17Å; I335-F337 HydrophobicContact CG2-CZ 3.54Å; I335-F337 PolarHBondContact O-N 3.01Å; I335-M340 HydrophobicContact CG2-CE 3.86Å
336	R	97.1	Very high	96.6	Very high	9 Å²	9	37.3 Å²	37.3	3%	0.034	20%	0.203	C	C	.	.			trans	-92.6	56.3	-172.9	-43.1	-167	-170.3	-169.8	-4.8	111.4	E291 E297 P338 A339 P378 T380 P381 R382	E291-R336 IonicContact OE1-CZ 2.66Å; E291-R336 IonicContact OE1-NH1 2.62Å; E291-R336 PolarHBondContact OE1-NH1 3.1Å; E291-R336 IonicContact OE1-NH2 3.47Å; E291-R336 PolarHBondContact OE1-NH2 2.86Å; E291-R336 IonicContact OE2-CZ 3.57Å; E291-R336 IonicContact OE2-NH1 3.25Å; E291-R336 PolarHBondContact OE2-NH1 3.42Å; E291-R336 IonicContact OE2-NH2 3.41Å; E291-R336 PolarHBondContact OE2-NH2 2.81Å; E297-R336 HydrophobicContact CG-CB 3.96Å; E297-R336 PolarHBondContact OE1-N 2.92Å; R336-P338 VanDerWaalsContact C-N 3.29Å; R336-A339 HydrophobicContact CB-CB 3.97Å; R336-A339 WeakPolarHBondContact O-CA 3.2Å; R336-A339 WeakPolarHBondContact O-CB 3.37Å; R336-A339 PolarHBondContact O-N 3.21Å; R336-P378 WeakPolarHBondContact CA-O 3.47Å; R336-P378 HydrophobicContact CG-CB 4.04Å; R336-P378 HydrophobicContact CG-CG 4.4Å; R336-T380 WeakPolarHBondContact CD-O 3.33Å; R336-T380 PolarHBondContact NH1-O 2.95Å; R336-T380 VanDerWaalsContact NH1-O 3.09Å; R336-P381 PolarHBondContact NH1-O 3.44Å; R336-R382 VanDerWaalsContact NH1-CA 3.31Å
337	F	97.3	Very high	96.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-47.6	-42.2	-179.5	-58.8	-69.6	0	0	0	114.8	F301 F332 I335 A339 M340 F345 V349 L355 I363 F377	F301-F337 AromaticContact CD2-CE1 3.44Å; F301-F337 HydrophobicContact CD2-CE1 3.44Å; F301-F337 VanDerWaalsContact CD2-CE1 3.44Å; F301-F337 AromaticContact CD2-CZ 3.8Å; F301-F337 HydrophobicContact CD2-CZ 3.8Å; F301-F337 AromaticContact CE2-CE1 3.7Å; F301-F337 HydrophobicContact CE2-CE1 3.7Å; F301-F337 AromaticContact CE2-CZ 3.9Å; F301-F337 HydrophobicContact CE2-CZ 3.9Å; F301-F337 HydrophobicContact CG-CE1 4.09Å; F332-F337 HydrophobicContact CE1-CE2 4.12Å; F332-F337 HydrophobicContact CE1-CZ 4.48Å; F332-F337 HydrophobicContact CE2-CE2 4.25Å; F332-F337 AromaticContact CE2-CZ 3.84Å; F332-F337 HydrophobicContact CE2-CZ 3.84Å; F332-F337 AromaticContact CZ-CE2 3.84Å; F332-F337 HydrophobicContact CZ-CE2 3.84Å; F332-F337 AromaticContact CZ-CZ 3.76Å; F332-F337 HydrophobicContact CZ-CZ 3.76Å; I335-F337 VanDerWaalsContact C-N 3.32Å; I335-F337 HydrophobicContact CB-CD2 4.3Å; I335-F337 HydrophobicContact CB-CE1 4.25Å; I335-F337 HydrophobicContact CB-CE2 3.78Å; I335-F337 HydrophobicContact CB-CZ 3.76Å; I335-F337 HydrophobicContact CG1-CZ 4.41Å; I335-F337 HydrophobicContact CG2-CD1 3.83Å; I335-F337 HydrophobicContact CG2-CD2 4.21Å; I335-F337 HydrophobicContact CG2-CE1 3.5Å; I335-F337 HydrophobicContact CG2-CE2 3.9Å; I335-F337 HydrophobicContact CG2-CG 4.17Å; I335-F337 HydrophobicContact CG2-CZ 3.54Å; I335-F337 PolarHBondContact O-N 3.01Å; F337-A339 PolarHBondContact O-N 2.92Å; F337-M340 HydrophobicContact CD1-CE 3.53Å; F337-M340 HydrophobicContact CD1-SD 4.06Å; F337-M340 HydrophobicContact CE1-CE 3.98Å; F337-M340 HydrophobicContact CG-CE 4.46Å; F337-M340 WeakPolarHBondContact O-CB 3.4Å; F337-M340 PolarHBondContact O-N 3.29Å; F337-M340 VanDerWaalsContact O-N 3.12Å; F337-F345 HydrophobicContact CB-CD2 4.2Å; F337-F345 HydrophobicContact CB-CE2 4.02Å; F337-F345 HydrophobicContact CD1-CD2 4.37Å; F337-F345 HydrophobicContact CD1-CE2 4.28Å; F337-F345 HydrophobicContact CG-CE2 4.39Å; F337-V349 HydrophobicContact CD1-CB 4.39Å; F337-V349 HydrophobicContact CD1-CG1 3.65Å; F337-V349 HydrophobicContact CD1-CG2 3.9Å; F337-V349 HydrophobicContact CE1-CB 4.39Å; F337-V349 HydrophobicContact CE1-CG1 3.44Å; F337-V349 VanDerWaalsContact CE1-CG1 3.44Å; F337-V349 HydrophobicContact CE1-CG2 3.98Å; F337-V349 HydrophobicContact CZ-CG1 4.32Å; F337-L355 HydrophobicContact CD2-CD2 4.42Å; F337-L355 HydrophobicContact CE2-CD2 4.09Å; F337-L355 HydrophobicContact CZ-CD2 4.45Å; F337-I363 HydrophobicContact CB-CD1 3.8Å; F337-I363 HydrophobicContact CD2-CD1 4.48Å; F337-I363 HydrophobicContact CG-CD1 4.34Å; F337-F377 HydrophobicContact CD2-CB 4.41Å; F337-F377 AromaticContact CD2-CD1 3.5Å; F337-F377 HydrophobicContact CD2-CD1 3.5Å; F337-F377 VanDerWaalsContact CD2-CD1 3.5Å; F337-F377 HydrophobicContact CD2-CD2 4.24Å; F337-F377 AromaticContact CD2-CE1 3.72Å; F337-F377 HydrophobicContact CD2-CE1 3.72Å; F337-F377 HydrophobicContact CD2-CE2 4.42Å; F337-F377 AromaticContact CD2-CG 3.78Å; F337-F377 HydrophobicContact CD2-CG 3.78Å; F337-F377 HydrophobicContact CD2-CZ 4.19Å; F337-F377 AromaticContact CE2-CD1 3.74Å; F337-F377 HydrophobicContact CE2-CD1 3.74Å; F337-F377 AromaticContact CE2-CE1 3.57Å; F337-F377 HydrophobicContact CE2-CE1 3.57Å; F337-F377 HydrophobicContact CE2-CG 4.46Å; F337-F377 HydrophobicContact CE2-CZ 4.17Å
338	P	95.5	Very high	96.3	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.052	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-68.4	-13.3	178.3	-14.4	29.1	0	0	0	114.5	R336 H366 H367 L375 F377 P378 K379	R336-P338 VanDerWaalsContact C-N 3.29Å; P338-H366 VanDerWaalsContact CB-CD2 3.48Å; P338-H366 WeakPolarHBondContact CB-CD2 3.26Å; P338-H367 PolarHBondContact O-NE2 2.91Å; P338-L375 HydrophobicContact CB-CD1 3.92Å; P338-L375 HydrophobicContact CG-CD1 3.47Å; P338-L375 VanDerWaalsContact CG-CD1 3.47Å; P338-F377 HydrophobicContact CG-CB 4.13Å; P338-P378 WeakPolarHBondContact CD-O 3.39Å; P338-K379 HydrophobicContact CB-CB 4.43Å; P338-K379 HydrophobicContact CB-CG 4.43Å; P338-K379 HydrophobicContact CG-CG 4.46Å
339	A	95.1	Very high	96.3	Very high	31 Å²	31	38.2 Å²	38.2	26%	0.256	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-91.8	-5.9	174.9	0	0	0	0	0	113.1	R336 F337 P381	R336-A339 HydrophobicContact CB-CB 3.97Å; R336-A339 WeakPolarHBondContact O-CA 3.2Å; R336-A339 WeakPolarHBondContact O-CB 3.37Å; R336-A339 PolarHBondContact O-N 3.21Å; F337-A339 PolarHBondContact O-N 2.92Å; A339-P381 HydrophobicContact CB-CB 4.38Å; A339-P381 HydrophobicContact CB-CG 4.04Å
340	M	96.7	Very high	96.2	Very high	10 Å²	10	39 Å²	39	5%	0.049	21%	0.212	C	C	.	.	S	Bend	trans	-72.4	159.8	173.9	-67.5	178.8	-171.5	0	0	110.9	E297 F301 I335 F337 F345 V349 H367	E297-M340 HydrophobicContact CB-CE 4.04Å; E297-M340 HydrophobicContact CB-CG 3.78Å; E297-M340 HydrophobicContact CG-CE 3.6Å; E297-M340 HydrophobicContact CG-CG 4.09Å; E297-M340 WeakPolarHBondContact O-CE 3.46Å; F301-M340 HydrophobicContact CB-CE 3.73Å; F301-M340 HydrophobicContact CG-CE 4.35Å; I335-M340 HydrophobicContact CG2-CE 3.86Å; F337-M340 HydrophobicContact CD1-CE 3.53Å; F337-M340 HydrophobicContact CD1-SD 4.06Å; F337-M340 HydrophobicContact CE1-CE 3.98Å; F337-M340 HydrophobicContact CG-CE 4.46Å; F337-M340 WeakPolarHBondContact O-CB 3.4Å; F337-M340 PolarHBondContact O-N 3.29Å; F337-M340 VanDerWaalsContact O-N 3.12Å; M340-F345 HydrophobicContact CB-CB 4.33Å; M340-F345 HydrophobicContact SD-CD2 4.42Å; M340-V349 HydrophobicContact CE-CG2 3.99Å; M340-V349 HydrophobicContact SD-CG2 3.56Å; M340-V349 VanDerWaalsContact SD-CG2 3.56Å; M340-H367 PolarHBondContact O-NE2 3.33Å
341	K	95.7	Very high	96	Very high	132 Å²	132	41.5 Å²	41.5	57%	0.574	22%	0.22	S	C	*	.			trans	-67.5	143.7	165	-64.4	177.6	-176.3	168.1	0	109.4	E343 E344 F345	K341-E343 PolarHBondContact O-N 3.31Å; K341-E344 HydrophobicContact CB-CB 4.3Å; K341-E344 HydrophobicContact CB-CG 4.08Å; K341-E344 PolarHBondContact O-N 2.65Å; K341-E344 VanDerWaalsContact O-N 3.1Å; K341-F345 PolarHBondContact O-N 3.35Å
342	V	95.5	Very high	95.8	Very high	33 Å²	33	43 Å²	43	20%	0.2	23%	0.231	C	C	.	.	H	α-helix	trans	-56.5	-38.9	-178.4	-179.7	0	0	0	0	111.4	F345 A346 F364 H367 F368	V342-F345 PolarHBondContact O-N 3.22Å; V342-A346 VanDerWaalsContact O-CB 3.32Å; V342-A346 WeakPolarHBondContact O-CB 3.12Å; V342-A346 PolarHBondContact O-N 3.28Å; V342-F364 HydrophobicContact CG1-CD1 4.32Å; V342-F364 HydrophobicContact CG1-CE1 4.06Å; V342-H367 HydrophobicContact CG2-CB 3.67Å; V342-H367 WeakPolarHBondContact CG2-CD2 3.34Å; V342-F368 HydrophobicContact CG1-CE2 4.31Å; V342-F368 HydrophobicContact CG1-CZ 4.04Å
343	E	95.6	Very high	95.7	Very high	135 Å²	135	45.1 Å²	45.1	63%	0.631	25%	0.252	S	S	*	.	H	α-helix	trans	-67.3	-43.8	179.9	-57.5	73.8	-157.4	0	0	111.5	K341 A346 V347	K341-E343 PolarHBondContact O-N 3.31Å; E343-A346 PolarHBondContact O-N 3.11Å; E343-V347 WeakPolarHBondContact O-CB 3.35Å; E343-V347 VanDerWaalsContact O-CG2 3.31Å; E343-V347 WeakPolarHBondContact O-CG2 3.42Å; E343-V347 PolarHBondContact O-N 3.24Å
344	E	95.4	Very high	95.7	Very high	36 Å²	36	41.7 Å²	41.7	17%	0.168	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-44.6	176.7	-66.9	176	169.2	0	0	110.2	S298 K341 A346 V347 E348	S298-E344 PolarHBondContact OG-OE2 3.39Å; K341-E344 HydrophobicContact CB-CB 4.3Å; K341-E344 HydrophobicContact CB-CG 4.08Å; K341-E344 PolarHBondContact O-N 2.65Å; K341-E344 VanDerWaalsContact O-N 3.1Å; E344-A346 PolarHBondContact O-N 3.44Å; E344-V347 PolarHBondContact O-N 3.26Å; E344-E348 VanDerWaalsContact O-CB 3.3Å; E344-E348 WeakPolarHBondContact O-CB 3.46Å; E344-E348 PolarHBondContact O-N 3.18Å
345	F	96.8	Very high	95.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-59.1	-48.5	175.9	176.6	-101.8	0	0	0	112.1	F337 M340 K341 V342 V347 V349 V350 L355 I363 F364	F337-F345 HydrophobicContact CB-CD2 4.2Å; F337-F345 HydrophobicContact CB-CE2 4.02Å; F337-F345 HydrophobicContact CD1-CD2 4.37Å; F337-F345 HydrophobicContact CD1-CE2 4.28Å; F337-F345 HydrophobicContact CG-CE2 4.39Å; M340-F345 HydrophobicContact CB-CB 4.33Å; M340-F345 HydrophobicContact SD-CD2 4.42Å; K341-F345 PolarHBondContact O-N 3.35Å; V342-F345 PolarHBondContact O-N 3.22Å; F345-V347 PolarHBondContact O-N 3.35Å; F345-V349 HydrophobicContact CD2-CB 3.73Å; F345-V349 HydrophobicContact CD2-CG1 4.05Å; F345-V349 HydrophobicContact CD2-CG2 3.88Å; F345-V349 HydrophobicContact CE2-CB 3.92Å; F345-V349 HydrophobicContact CE2-CG1 3.77Å; F345-V349 HydrophobicContact CE2-CG2 4.44Å; F345-V349 HydrophobicContact CG-CB 4.47Å; F345-V349 WeakPolarHBondContact O-CA 3.41Å; F345-V349 VanDerWaalsContact O-CB 3.31Å; F345-V349 WeakPolarHBondContact O-CB 3.43Å; F345-V349 PolarHBondContact O-N 3.26Å; F345-V350 HydrophobicContact CD1-CG2 4.02Å; F345-V350 HydrophobicContact CE1-CG2 3.6Å; F345-V350 HydrophobicContact CZ-CG2 4.02Å; F345-V350 PolarHBondContact O-N 3.46Å; F345-L355 HydrophobicContact CE2-CD1 3.58Å; F345-L355 HydrophobicContact CZ-CD1 3.77Å; F345-I363 HydrophobicContact CD1-CG2 4.2Å; F345-I363 HydrophobicContact CD2-CG2 4.12Å; F345-I363 HydrophobicContact CE1-CB 4.19Å; F345-I363 HydrophobicContact CE1-CG2 3.8Å; F345-I363 HydrophobicContact CE2-CB 4.28Å; F345-I363 HydrophobicContact CE2-CD1 3.82Å; F345-I363 HydrophobicContact CE2-CG2 3.72Å; F345-I363 HydrophobicContact CG-CG2 4.36Å; F345-I363 HydrophobicContact CZ-CB 3.77Å; F345-I363 HydrophobicContact CZ-CD1 3.84Å; F345-I363 HydrophobicContact CZ-CG1 4.43Å; F345-I363 HydrophobicContact CZ-CG2 3.55Å; F345-F364 HydrophobicContact CD1-CD1 4.46Å; F345-F364 AromaticContact CD1-CE1 3.97Å; F345-F364 HydrophobicContact CD1-CE1 3.97Å; F345-F364 HydrophobicContact CD1-CE2 4.35Å; F345-F364 AromaticContact CD1-CZ 3.9Å; F345-F364 HydrophobicContact CD1-CZ 3.9Å; F345-F364 HydrophobicContact CE1-CD1 4.49Å; F345-F364 HydrophobicContact CE1-CD2 4.16Å; F345-F364 HydrophobicContact CE1-CE1 4.22Å; F345-F364 AromaticContact CE1-CE2 3.86Å; F345-F364 HydrophobicContact CE1-CE2 3.86Å; F345-F364 HydrophobicContact CE1-CG 4.45Å; F345-F364 AromaticContact CE1-CZ 3.89Å; F345-F364 HydrophobicContact CE1-CZ 3.89Å
346	A	95	Very high	95.4	Very high	35 Å²	35	43.9 Å²	43.9	29%	0.289	25%	0.251	S	S	.	.	I	π-helix	trans	-64.5	-38.7	-178.7	0	0	0	0	0	112.7	V342 E343 E344 F364	V342-A346 VanDerWaalsContact O-CB 3.32Å; V342-A346 WeakPolarHBondContact O-CB 3.12Å; V342-A346 PolarHBondContact O-N 3.28Å; E343-A346 PolarHBondContact O-N 3.11Å; E344-A346 PolarHBondContact O-N 3.44Å; A346-F364 HydrophobicContact CB-CE1 4.28Å; A346-F364 HydrophobicContact CB-CZ 4.03Å
347	V	94.8	Very high	95.3	Very high	96 Å²	96	48.3 Å²	48.3	58%	0.582	28%	0.284	S	S	*	.	I	π-helix	trans	-82.8	-45.4	-176.6	174.6	0	0	0	0	112	E343 E344 F345 N351	E343-V347 WeakPolarHBondContact O-CB 3.35Å; E343-V347 VanDerWaalsContact O-CG2 3.31Å; E343-V347 WeakPolarHBondContact O-CG2 3.42Å; E343-V347 PolarHBondContact O-N 3.24Å; E344-V347 PolarHBondContact O-N 3.26Å; F345-V347 PolarHBondContact O-N 3.35Å; V347-N351 WeakPolarHBondContact O-CB 3.16Å; V347-N351 PolarHBondContact O-ND2 3.46Å
348	E	93.8	Very high	95.2	Very high	62 Å²	62	55.2 Å²	55.2	29%	0.29	32%	0.316	S	S	.	.	I	π-helix	trans	-92.7	-42.5	-170.3	-58	-173.9	-169.1	0	0	112.1	S298 E344	S298-E348 VanDerWaalsContact CB-OE2 3.27Å; S298-E348 WeakPolarHBondContact CB-OE2 3.48Å; E344-E348 VanDerWaalsContact O-CB 3.3Å; E344-E348 WeakPolarHBondContact O-CB 3.46Å; E344-E348 PolarHBondContact O-N 3.18Å
349	V	96.4	Very high	95.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-88.3	-51.6	-171.9	-172.2	0	0	0	0	111.6	F301 F337 M340 F345 N351 S352 L355	F301-V349 HydrophobicContact CD1-CG2 3.83Å; F301-V349 HydrophobicContact CE1-CB 4.2Å; F301-V349 HydrophobicContact CE1-CG1 4.32Å; F301-V349 HydrophobicContact CE1-CG2 3.91Å; F301-V349 HydrophobicContact CE2-CG1 4.21Å; F301-V349 HydrophobicContact CG-CG2 4.2Å; F301-V349 HydrophobicContact CZ-CB 4.34Å; F301-V349 HydrophobicContact CZ-CG1 3.96Å; F301-V349 HydrophobicContact CZ-CG2 4.34Å; F337-V349 HydrophobicContact CD1-CB 4.39Å; F337-V349 HydrophobicContact CD1-CG1 3.65Å; F337-V349 HydrophobicContact CD1-CG2 3.9Å; F337-V349 HydrophobicContact CE1-CB 4.39Å; F337-V349 HydrophobicContact CE1-CG1 3.44Å; F337-V349 VanDerWaalsContact CE1-CG1 3.44Å; F337-V349 HydrophobicContact CE1-CG2 3.98Å; F337-V349 HydrophobicContact CZ-CG1 4.32Å; M340-V349 HydrophobicContact CE-CG2 3.99Å; M340-V349 HydrophobicContact SD-CG2 3.56Å; M340-V349 VanDerWaalsContact SD-CG2 3.56Å; F345-V349 HydrophobicContact CD2-CB 3.73Å; F345-V349 HydrophobicContact CD2-CG1 4.05Å; F345-V349 HydrophobicContact CD2-CG2 3.88Å; F345-V349 HydrophobicContact CE2-CB 3.92Å; F345-V349 HydrophobicContact CE2-CG1 3.77Å; F345-V349 HydrophobicContact CE2-CG2 4.44Å; F345-V349 HydrophobicContact CG-CB 4.47Å; F345-V349 WeakPolarHBondContact O-CA 3.41Å; F345-V349 VanDerWaalsContact O-CB 3.31Å; F345-V349 WeakPolarHBondContact O-CB 3.43Å; F345-V349 PolarHBondContact O-N 3.26Å; V349-N351 VanDerWaalsContact C-N 3.32Å; V349-N351 PolarHBondContact O-N 3.38Å; V349-S352 WeakPolarHBondContact O-CB 3.49Å; V349-S352 PolarHBondContact O-N 3.45Å; V349-S352 VanDerWaalsContact O-N 3.11Å; V349-S352 PolarHBondContact O-OG 3.12Å; V349-L355 HydrophobicContact CG1-CD1 3.45Å; V349-L355 VanDerWaalsContact CG1-CD1 3.45Å; V349-L355 HydrophobicContact CG1-CG 4.06Å
350	V	94.6	Very high	95.2	Very high	49 Å²	49	55.6 Å²	55.6	30%	0.297	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-61.5	-42.3	-176.3	176.8	0	0	0	0	111.2	F345 S352 G353 F364	F345-V350 HydrophobicContact CD1-CG2 4.02Å; F345-V350 HydrophobicContact CE1-CG2 3.6Å; F345-V350 HydrophobicContact CZ-CG2 4.02Å; F345-V350 PolarHBondContact O-N 3.46Å; V350-S352 PolarHBondContact O-N 2.94Å; V350-G353 PolarHBondContact O-N 3.29Å; V350-F364 HydrophobicContact CG2-CE2 3.93Å; V350-F364 HydrophobicContact CG2-CZ 4.02Å
351	N	92.2	Very high	95	Very high	125 Å²	125	59.1 Å²	59.1	67%	0.668	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-68.6	-18.8	179.5	-69.1	-36.1	0	0	0	113.9	V347 V349 G353	V347-N351 WeakPolarHBondContact O-CB 3.16Å; V347-N351 PolarHBondContact O-ND2 3.46Å; V349-N351 VanDerWaalsContact C-N 3.32Å; V349-N351 PolarHBondContact O-N 3.38Å; N351-G353 PolarHBondContact O-N 2.81Å
352	S	94.5	Very high	95	Very high	32 Å²	32	55.9 Å²	55.9	22%	0.224	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-70.5	-20.1	175.8	76.7	0	0	0	0	113.1	F301 P321 V349 V350 V354	F301-S352 WeakPolarHBondContact CZ-OG 3.06Å; P321-S352 WeakPolarHBondContact CG-O 3.43Å; V349-S352 WeakPolarHBondContact O-CB 3.49Å; V349-S352 PolarHBondContact O-N 3.45Å; V349-S352 VanDerWaalsContact O-N 3.11Å; V349-S352 PolarHBondContact O-OG 3.12Å; V350-S352 PolarHBondContact O-N 2.94Å; S352-V354 PolarHBondContact O-N 3.32Å; S352-V354 VanDerWaalsContact OG-CG2 3.25Å; S352-V354 WeakPolarHBondContact OG-CG2 2.79Å; S352-V354 PolarHBondContact OG-N 3.24Å
353	G	94.6	Very high	94.9	Very high	44 Å²	44	54.4 Å²	54.4	45%	0.454	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	8.9	-179.4	0	0	0	0	0	115.3	P321 V350 N351	P321-G353 WeakPolarHBondContact CB-O 3.16Å; V350-G353 PolarHBondContact O-N 3.29Å; N351-G353 PolarHBondContact O-N 2.81Å
354	V	96.5	Very high	94.9	Very high	5 Å²	5	51 Å²	51	3%	0.03	30%	0.298	C	S	.	.			trans	-80.6	-23.5	-178	-56.7	0	0	0	0	113.2	F301 I305 P321 R325 F332 S352	F301-V354 HydrophobicContact CE2-CG2 3.89Å; F301-V354 HydrophobicContact CZ-CG2 3.88Å; I305-V354 HydrophobicContact CD1-CG1 3.87Å; I305-V354 HydrophobicContact CD1-CG2 4.28Å; P321-V354 HydrophobicContact CB-CG1 4.16Å; R325-V354 WeakPolarHBondContact CD-O 3.03Å; R325-V354 PolarHBondContact NH1-O 3.44Å; F332-V354 HydrophobicContact CE2-CB 4.37Å; F332-V354 HydrophobicContact CE2-CG2 3.76Å; F332-V354 HydrophobicContact CZ-CG2 3.89Å; S352-V354 PolarHBondContact O-N 3.32Å; S352-V354 VanDerWaalsContact OG-CG2 3.25Å; S352-V354 WeakPolarHBondContact OG-CG2 2.79Å; S352-V354 PolarHBondContact OG-N 3.24Å
355	L	96	Very high	94.8	Very high	15 Å²	15	54 Å²	54	8%	0.079	31%	0.314	C	S	.	.	S	Bend	trans	-85.5	146.4	172.3	-72.2	178	0	0	0	110.7	F332 F337 F345 V349 E359 C360 I363 F377	F332-L355 HydrophobicContact CE1-CD2 3.66Å; F332-L355 HydrophobicContact CZ-CD2 3.51Å; F332-L355 HydrophobicContact CZ-CG 4.19Å; F337-L355 HydrophobicContact CD2-CD2 4.42Å; F337-L355 HydrophobicContact CE2-CD2 4.09Å; F337-L355 HydrophobicContact CZ-CD2 4.45Å; F345-L355 HydrophobicContact CE2-CD1 3.58Å; F345-L355 HydrophobicContact CZ-CD1 3.77Å; V349-L355 HydrophobicContact CG1-CD1 3.45Å; V349-L355 VanDerWaalsContact CG1-CD1 3.45Å; V349-L355 HydrophobicContact CG1-CG 4.06Å; L355-E359 HydrophobicContact CB-CB 4.39Å; L355-E359 HydrophobicContact CD2-CB 4.17Å; L355-E359 WeakPolarHBondContact CD2-OE2 3.37Å; L355-C360 VanDerWaalsContact CB-SG 3.56Å; L355-I363 HydrophobicContact CD1-CD1 3.86Å; L355-F377 HydrophobicContact CD2-CE1 4.48Å; L355-F377 HydrophobicContact CD2-CE2 4.13Å; L355-F377 HydrophobicContact CD2-CZ 3.71Å
356	T	95.2	Very high	94.6	Very high	64 Å²	64	56.5 Å²	56.5	39%	0.393	33%	0.325	S	S	.	.			trans	-71.9	159	170.8	74.1	0	0	0	0	110.2	E358 E359 C360	T356-E358 PolarHBondContact O-N 2.89Å; T356-E359 PolarHBondContact N-OE2 3.47Å; T356-E359 PolarHBondContact O-N 3.49Å; T356-E359 VanDerWaalsContact OG1-CG 3.29Å; T356-E359 WeakPolarHBondContact OG1-CG 3.08Å; T356-E359 PolarHBondContact OG1-N 3.13Å; T356-E359 PolarHBondContact OG1-OE2 3.4Å; T356-C360 PolarHBondContact O-N 3.27Å; T356-C360 PolarHBondContact O-SG 3.05Å; T356-C360 VanDerWaalsContact O-SG 3.41Å
357	S	94.2	Very high	94.4	Very high	103 Å²	103	57.5 Å²	57.5	72%	0.72	32%	0.324	S	S	*	.	H	α-helix	trans	-59.5	-36.9	176.3	-53.9	0	0	0	0	112.3	C360 V361	S357-C360 PolarHBondContact O-N 3.38Å; S357-V361 WeakPolarHBondContact O-CG2 3.27Å; S357-V361 PolarHBondContact O-N 2.88Å
358	E	94.5	Very high	94.3	Very high	145 Å²	145	60.3 Å²	60.3	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-62.5	-48.6	175.9	-175.8	174.8	-165.3	0	0	111.3	T356 C360 V361 D362	T356-E358 PolarHBondContact O-N 2.89Å; E358-C360 VanDerWaalsContact C-N 3.33Å; E358-C360 PolarHBondContact O-N 3.01Å; E358-V361 PolarHBondContact O-N 3.21Å; E358-V361 VanDerWaalsContact O-N 3.16Å; E358-D362 PolarHBondContact O-N 3.02Å
359	E	95.7	Very high	94	Very high	29 Å²	29	59.6 Å²	59.6	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-41.9	177.1	-70.3	172.5	144.7	0	0	112.3	R325 L355 T356 D362 I363 F377	R325-E359 IonicContact CZ-OE1 3.73Å; R325-E359 IonicContact CZ-OE2 2.64Å; R325-E359 IonicContact NH1-OE1 3.63Å; R325-E359 IonicContact NH1-OE2 2.71Å; R325-E359 PolarHBondContact NH1-OE2 3.04Å; R325-E359 IonicContact NH2-OE1 3.66Å; R325-E359 PolarHBondContact NH2-OE1 2.71Å; R325-E359 IonicContact NH2-OE2 3.56Å; R325-E359 PolarHBondContact NH2-OE2 3.23Å; L355-E359 HydrophobicContact CB-CB 4.39Å; L355-E359 HydrophobicContact CD2-CB 4.17Å; L355-E359 WeakPolarHBondContact CD2-OE2 3.37Å; T356-E359 PolarHBondContact N-OE2 3.47Å; T356-E359 PolarHBondContact O-N 3.49Å; T356-E359 VanDerWaalsContact OG1-CG 3.29Å; T356-E359 WeakPolarHBondContact OG1-CG 3.08Å; T356-E359 PolarHBondContact OG1-N 3.13Å; T356-E359 PolarHBondContact OG1-OE2 3.4Å; E359-D362 PolarHBondContact O-N 3.18Å; E359-I363 WeakPolarHBondContact O-CB 3.3Å; E359-I363 WeakPolarHBondContact O-CD1 3.42Å; E359-I363 VanDerWaalsContact O-CG1 3.24Å; E359-I363 WeakPolarHBondContact O-CG1 3.31Å; E359-I363 PolarHBondContact O-N 3.07Å; E359-F377 HydrophobicContact CB-CE2 4.38Å; E359-F377 HydrophobicContact CG-CE2 4.17Å; E359-F377 WeakPolarHBondContact OE1-CZ 3.27Å
360	C	95.3	Very high	93.3	Very high	17 Å²	17	69.3 Å²	69.3	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-59.7	-47.4	175.2	-72.3	0	0	0	0	111.3	L355 T356 S357 E358 I363 F364	L355-C360 VanDerWaalsContact CB-SG 3.56Å; T356-C360 PolarHBondContact O-N 3.27Å; T356-C360 PolarHBondContact O-SG 3.05Å; T356-C360 VanDerWaalsContact O-SG 3.41Å; S357-C360 PolarHBondContact O-N 3.38Å; E358-C360 VanDerWaalsContact C-N 3.33Å; E358-C360 PolarHBondContact O-N 3.01Å; C360-I363 PolarHBondContact O-N 2.69Å; C360-F364 WeakPolarHBondContact O-CD2 3.48Å; C360-F364 PolarHBondContact O-N 3.05Å
361	V	93.8	Very high	92.6	Very high	85 Å²	85	75 Å²	75	52%	0.515	40%	0.397	S	S	.	.	H	α-helix	trans	-61.6	-45.5	177.3	172.5	0	0	0	0	110.8	S357 E358 I363 F364 M365	S357-V361 WeakPolarHBondContact O-CG2 3.27Å; S357-V361 PolarHBondContact O-N 2.88Å; E358-V361 PolarHBondContact O-N 3.21Å; E358-V361 VanDerWaalsContact O-N 3.16Å; V361-I363 VanDerWaalsContact C-N 3.35Å; V361-I363 PolarHBondContact O-N 2.97Å; V361-F364 PolarHBondContact O-N 3.09Å; V361-M365 HydrophobicContact CG1-CG 4.15Å; V361-M365 WeakPolarHBondContact O-CB 3.28Å; V361-M365 VanDerWaalsContact O-CG 3.27Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.38Å
362	D	94.2	Very high	91.8	Very high	64 Å²	64	76.8 Å²	76.8	34%	0.342	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-40.3	-179.1	-74.2	-19.1	0	0	0	112.5	E358 E359 M365 H366 L375	E358-D362 PolarHBondContact O-N 3.02Å; E359-D362 PolarHBondContact O-N 3.18Å; D362-M365 PolarHBondContact O-N 2.77Å; D362-H366 PolarHBondContact O-N 2.81Å; D362-L375 HydrophobicContact CB-CD2 3.66Å
363	I	94.8	Very high	91	Very high	1 Å²	1	76.4 Å²	76.4	1%	0.005	40%	0.398	C	S	.	.	H	α-helix	trans	-69.4	-40.9	175.8	-66.1	162.7	0	0	0	110.7	F337 F345 L355 E359 C360 V361 H366 H367 F377	F337-I363 HydrophobicContact CB-CD1 3.8Å; F337-I363 HydrophobicContact CD2-CD1 4.48Å; F337-I363 HydrophobicContact CG-CD1 4.34Å; F345-I363 HydrophobicContact CD1-CG2 4.2Å; F345-I363 HydrophobicContact CD2-CG2 4.12Å; F345-I363 HydrophobicContact CE1-CB 4.19Å; F345-I363 HydrophobicContact CE1-CG2 3.8Å; F345-I363 HydrophobicContact CE2-CB 4.28Å; F345-I363 HydrophobicContact CE2-CD1 3.82Å; F345-I363 HydrophobicContact CE2-CG2 3.72Å; F345-I363 HydrophobicContact CG-CG2 4.36Å; F345-I363 HydrophobicContact CZ-CB 3.77Å; F345-I363 HydrophobicContact CZ-CD1 3.84Å; F345-I363 HydrophobicContact CZ-CG1 4.43Å; F345-I363 HydrophobicContact CZ-CG2 3.55Å; L355-I363 HydrophobicContact CD1-CD1 3.86Å; E359-I363 WeakPolarHBondContact O-CB 3.3Å; E359-I363 WeakPolarHBondContact O-CD1 3.42Å; E359-I363 VanDerWaalsContact O-CG1 3.24Å; E359-I363 WeakPolarHBondContact O-CG1 3.31Å; E359-I363 PolarHBondContact O-N 3.07Å; C360-I363 PolarHBondContact O-N 2.69Å; V361-I363 VanDerWaalsContact C-N 3.35Å; V361-I363 PolarHBondContact O-N 2.97Å; I363-H366 WeakPolarHBondContact O-CB 3.49Å; I363-H366 PolarHBondContact O-N 3.45Å; I363-H367 PolarHBondContact O-N 3.31Å; I363-H367 PolarHBondContact O-ND1 3.37Å; I363-F377 HydrophobicContact CD1-CD2 4.02Å; I363-F377 HydrophobicContact CD1-CE2 4.14Å
364	F	94.1	Very high	90.6	Very high	63 Å²	63	82.5 Å²	82.5	28%	0.276	42%	0.415	S	S	.	.	H	α-helix	trans	-61.6	-45.4	172.8	-82.3	-59.7	0	0	0	111.3	V342 F345 A346 V350 C360 V361 H366 H367 F368	V342-F364 HydrophobicContact CG1-CD1 4.32Å; V342-F364 HydrophobicContact CG1-CE1 4.06Å; F345-F364 HydrophobicContact CD1-CD1 4.46Å; F345-F364 AromaticContact CD1-CE1 3.97Å; F345-F364 HydrophobicContact CD1-CE1 3.97Å; F345-F364 HydrophobicContact CD1-CE2 4.35Å; F345-F364 AromaticContact CD1-CZ 3.9Å; F345-F364 HydrophobicContact CD1-CZ 3.9Å; F345-F364 HydrophobicContact CE1-CD1 4.49Å; F345-F364 HydrophobicContact CE1-CD2 4.16Å; F345-F364 HydrophobicContact CE1-CE1 4.22Å; F345-F364 AromaticContact CE1-CE2 3.86Å; F345-F364 HydrophobicContact CE1-CE2 3.86Å; F345-F364 HydrophobicContact CE1-CG 4.45Å; F345-F364 AromaticContact CE1-CZ 3.89Å; F345-F364 HydrophobicContact CE1-CZ 3.89Å; A346-F364 HydrophobicContact CB-CE1 4.28Å; A346-F364 HydrophobicContact CB-CZ 4.03Å; V350-F364 HydrophobicContact CG2-CE2 3.93Å; V350-F364 HydrophobicContact CG2-CZ 4.02Å; C360-F364 WeakPolarHBondContact O-CD2 3.48Å; C360-F364 PolarHBondContact O-N 3.05Å; V361-F364 PolarHBondContact O-N 3.09Å; F364-H366 PolarHBondContact O-N 2.94Å; F364-H367 PolarHBondContact O-N 3.17Å; F364-F368 HydrophobicContact CD1-CE2 4.21Å; F364-F368 WeakPolarHBondContact O-CD2 3.47Å; F364-F368 PolarHBondContact O-N 2.88Å
365	M	93	Very high	90.3	Very high	101 Å²	101	83.6 Å²	83.6	50%	0.498	42%	0.42	S	S	.	.	H	α-helix	trans	-60	-35.2	177.3	-73	-59.3	-64.8	0	0	111.8	V361 D362 H367 F368 S369	V361-M365 HydrophobicContact CG1-CG 4.15Å; V361-M365 WeakPolarHBondContact O-CB 3.28Å; V361-M365 VanDerWaalsContact O-CG 3.27Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.38Å; D362-M365 PolarHBondContact O-N 2.77Å; M365-H367 VanDerWaalsContact C-N 3.27Å; M365-H367 PolarHBondContact O-N 3.41Å; M365-F368 PolarHBondContact O-N 3.17Å; M365-S369 WeakPolarHBondContact O-CA 3.28Å; M365-S369 WeakPolarHBondContact O-CB 3.25Å; M365-S369 PolarHBondContact O-N 3.21Å
366	H	93	Very high	90.1	Very high	51 Å²	51	86.1 Å²	86.1	24%	0.236	44%	0.443	C	S	.	.	H	α-helix	trans	-58.6	-36.1	174	-178	68.2	0	0	0	113.7	P338 D362 I363 F364 S373 L375	P338-H366 VanDerWaalsContact CB-CD2 3.48Å; P338-H366 WeakPolarHBondContact CB-CD2 3.26Å; D362-H366 PolarHBondContact O-N 2.81Å; I363-H366 WeakPolarHBondContact O-CB 3.49Å; I363-H366 PolarHBondContact O-N 3.45Å; F364-H366 PolarHBondContact O-N 2.94Å; H366-S373 PolarHBondContact ND1-OG 2.87Å; H366-L375 HydrophobicContact CB-CD1 3.85Å
367	H	91.7	Very high	90.1	Very high	56 Å²	56	83.5 Å²	83.5	26%	0.259	43%	0.426	S	S	.	.	H	α-helix	trans	-78.5	-23.9	-178.8	-69.4	91.1	0	0	0	113.6	P338 M340 V342 I363 F364 M365	P338-H367 PolarHBondContact O-NE2 2.91Å; M340-H367 PolarHBondContact O-NE2 3.33Å; V342-H367 HydrophobicContact CG2-CB 3.67Å; V342-H367 WeakPolarHBondContact CG2-CD2 3.34Å; I363-H367 PolarHBondContact O-N 3.31Å; I363-H367 PolarHBondContact O-ND1 3.37Å; F364-H367 PolarHBondContact O-N 3.17Å; M365-H367 VanDerWaalsContact C-N 3.27Å; M365-H367 PolarHBondContact O-N 3.41Å
368	F	91.7	Very high	90.2	Very high	155 Å²	155	80.8 Å²	80.8	68%	0.68	41%	0.407	S	S	*	.	H	α-helix	trans	-113.8	-11.3	-173.1	-62.4	-65.9	0	0	0	114.4	V342 F364 M365	V342-F368 HydrophobicContact CG1-CE2 4.31Å; V342-F368 HydrophobicContact CG1-CZ 4.04Å; F364-F368 HydrophobicContact CD1-CE2 4.21Å; F364-F368 WeakPolarHBondContact O-CD2 3.47Å; F364-F368 PolarHBondContact O-N 2.88Å; M365-F368 PolarHBondContact O-N 3.17Å
369	S	88.9	Confident	90.2	Very high	47 Å²	47	77.3 Å²	77.3	33%	0.329	39%	0.389	S	S	.	.			trans	-107.3	134.5	-178.9	-176.1	0	0	0	0	110.9	M365 K371	M365-S369 WeakPolarHBondContact O-CA 3.28Å; M365-S369 WeakPolarHBondContact O-CB 3.25Å; M365-S369 PolarHBondContact O-N 3.21Å; S369-K371 PolarHBondContact O-N 3.34Å; S369-K371 WeakPolarHBondContact OG-CB 3.47Å; S369-K371 PolarHBondContact OG-N 3.04Å
370	E	80.7	Confident	90.1	Very high	205 Å²	205	80.4 Å²	80.4	96%	0.958	41%	0.41	S	S	*	.	S	Bend	trans	-71.1	-14.9	171.2	-63	-177.8	171.1	0	0	112.7
371	K	80.3	Confident	90.1	Very high	169 Å²	169	83.9 Å²	83.9	74%	0.735	43%	0.433	S	S	*	.	S	Bend	trans	-76.4	130.5	-179.1	-172.6	179.7	178.4	-176.6	0	110.5	S369 S373	S369-K371 PolarHBondContact O-N 3.34Å; S369-K371 WeakPolarHBondContact OG-CB 3.47Å; S369-K371 PolarHBondContact OG-N 3.04Å; K371-S373 PolarHBondContact O-N 2.87Å
372	E	75.7	Confident	90.2	Very high	162 Å²	162	81.2 Å²	81.2	76%	0.757	41%	0.413	S	S	*	.			trans	-58.2	111.6	170.7	-69.9	-171	167.8	0	0	111.1
373	S	77.4	Confident	90.3	Very high	24 Å²	24	85.2 Å²	85.2	17%	0.168	43%	0.434	C	S	.	.			trans	-83	137.1	170.1	49.9	0	0	0	0	110.4	H366 K371 L375 K379	H366-S373 PolarHBondContact ND1-OG 2.87Å; K371-S373 PolarHBondContact O-N 2.87Å; S373-L375 PolarHBondContact O-N 3.39Å; S373-K379 WeakPolarHBondContact O-CE 3.44Å; S373-K379 PolarHBondContact O-NZ 2.89Å
374	Q	85.4	Confident	90.3	Very high	171 Å²	171	85.7 Å²	85.7	80%	0.799	44%	0.439	S	S	*	.			trans	-83.3	99.9	169.4	-66.8	-63.8	-24.6	0	0	107.4
375	L	90.3	Very high	90.3	Very high	28 Å²	28	84.4 Å²	84.4	15%	0.147	44%	0.435	C	S	.	.			trans	-102.9	147.4	-179.5	-59.4	179.6	0	0	0	110.1	P338 D362 H366 S373 F377 K379	P338-L375 HydrophobicContact CB-CD1 3.92Å; P338-L375 HydrophobicContact CG-CD1 3.47Å; P338-L375 VanDerWaalsContact CG-CD1 3.47Å; D362-L375 HydrophobicContact CB-CD2 3.66Å; H366-L375 HydrophobicContact CB-CD1 3.85Å; S373-L375 PolarHBondContact O-N 3.39Å; L375-F377 PolarHBondContact O-N 2.85Å; L375-K379 HydrophobicContact CD1-CG 4.47Å
376	A	91.7	Very high	90.3	Very high	68 Å²	68	84.1 Å²	84.1	56%	0.562	44%	0.44	S	S	*	.	S	Bend	trans	-74.8	1.3	172.1	0	0	0	0	0	113.7
377	F	96	Very high	90.5	Very high	9 Å²	9	84.5 Å²	84.5	4%	0.039	44%	0.444	C	S	.	.	S	Bend	trans	-121.9	145	-173.7	-55.8	-76.4	0	0	0	111.7	F332 F337 P338 L355 E359 I363 L375	F332-F377 AromaticContact CD1-CE1 3.95Å; F332-F377 HydrophobicContact CD1-CE1 3.95Å; F332-F377 HydrophobicContact CD1-CZ 4.38Å; F332-F377 AromaticContact CE1-CE1 3.74Å; F332-F377 HydrophobicContact CE1-CE1 3.74Å; F332-F377 AromaticContact CE1-CZ 3.83Å; F332-F377 HydrophobicContact CE1-CZ 3.83Å; F337-F377 HydrophobicContact CD2-CB 4.41Å; F337-F377 AromaticContact CD2-CD1 3.5Å; F337-F377 HydrophobicContact CD2-CD1 3.5Å; F337-F377 VanDerWaalsContact CD2-CD1 3.5Å; F337-F377 HydrophobicContact CD2-CD2 4.24Å; F337-F377 AromaticContact CD2-CE1 3.72Å; F337-F377 HydrophobicContact CD2-CE1 3.72Å; F337-F377 HydrophobicContact CD2-CE2 4.42Å; F337-F377 AromaticContact CD2-CG 3.78Å; F337-F377 HydrophobicContact CD2-CG 3.78Å; F337-F377 HydrophobicContact CD2-CZ 4.19Å; F337-F377 AromaticContact CE2-CD1 3.74Å; F337-F377 HydrophobicContact CE2-CD1 3.74Å; F337-F377 AromaticContact CE2-CE1 3.57Å; F337-F377 HydrophobicContact CE2-CE1 3.57Å; F337-F377 HydrophobicContact CE2-CG 4.46Å; F337-F377 HydrophobicContact CE2-CZ 4.17Å; P338-F377 HydrophobicContact CG-CB 4.13Å; L355-F377 HydrophobicContact CD2-CE1 4.48Å; L355-F377 HydrophobicContact CD2-CE2 4.13Å; L355-F377 HydrophobicContact CD2-CZ 3.71Å; E359-F377 HydrophobicContact CB-CE2 4.38Å; E359-F377 HydrophobicContact CG-CE2 4.17Å; E359-F377 WeakPolarHBondContact OE1-CZ 3.27Å; I363-F377 HydrophobicContact CD1-CD2 4.02Å; I363-F377 HydrophobicContact CD1-CE2 4.14Å; L375-F377 PolarHBondContact O-N 2.85Å
378	P	95.8	Very high	90.7	Very high	47 Å²	47	84.3 Å²	84.3	31%	0.305	44%	0.442	S	S	.	.			trans	-62.2	136.3	175.8	-18.7	29.7	0	0	0	111.6	H333 R336 P338	H333-P378 VanDerWaalsContact O-CD 3.26Å; H333-P378 WeakPolarHBondContact O-CD 3.04Å; R336-P378 WeakPolarHBondContact CA-O 3.47Å; R336-P378 HydrophobicContact CG-CB 4.04Å; R336-P378 HydrophobicContact CG-CG 4.4Å; P338-P378 WeakPolarHBondContact CD-O 3.39Å
379	K	94	Very high	91	Very high	71 Å²	71	82 Å²	82	31%	0.309	43%	0.429	S	S	.	.			trans	-97.1	-22.4	-173.5	-51	174.7	-168.2	176.9	0	113.8	P338 S373 L375	P338-K379 HydrophobicContact CB-CB 4.43Å; P338-K379 HydrophobicContact CB-CG 4.43Å; P338-K379 HydrophobicContact CG-CG 4.46Å; S373-K379 WeakPolarHBondContact O-CE 3.44Å; S373-K379 PolarHBondContact O-NZ 2.89Å; L375-K379 HydrophobicContact CD1-CG 4.47Å
380	T	94	Very high	91.4	Very high	95 Å²	95	79.8 Å²	79.8	58%	0.583	41%	0.414	S	S	*	.	S	Bend	trans	-87.6	130.6	-173.3	49.4	0	0	0	0	111	R336	R336-T380 WeakPolarHBondContact CD-O 3.33Å; R336-T380 PolarHBondContact NH1-O 2.95Å; R336-T380 VanDerWaalsContact NH1-O 3.09Å
381	P	95.9	Very high	92.2	Very high	90 Å²	90	73.2 Å²	73.2	58%	0.584	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-53.4	154.9	171.7	-23.6	32.2	0	0	0	112.2	R336 A339	R336-P381 PolarHBondContact NH1-O 3.44Å; A339-P381 HydrophobicContact CB-CB 4.38Å; A339-P381 HydrophobicContact CB-CG 4.04Å
382	R	96.8	Very high	93	Very high	29 Å²	29	65.3 Å²	65.3	11%	0.109	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-61.6	141.4	170.5	-68	176.5	-165	-87.6	-1.7	109.4	L288 R290 E297 R336 G384	L288-R382 PolarHBondContact O-NH1 2.85Å; L288-R382 PolarHBondContact O-NH2 2.92Å; L288-R382 VanDerWaalsContact O-NH2 3.13Å; R290-R382 PolarHBondContact O-NH1 2.8Å; E297-R382 IonicContact OE1-CZ 2.68Å; E297-R382 IonicContact OE1-NE 3.57Å; E297-R382 IonicContact OE1-NH2 2.7Å; E297-R382 PolarHBondContact OE1-NH2 3.31Å; E297-R382 IonicContact OE2-CZ 3.8Å; E297-R382 IonicContact OE2-NE 3.3Å; E297-R382 PolarHBondContact OE2-NE 2.92Å; E297-R382 IonicContact OE2-NH2 3.73Å; E297-R382 PolarHBondContact OE2-NH2 2.88Å; R336-R382 VanDerWaalsContact NH1-CA 3.31Å; R382-G384 PolarHBondContact O-N 2.91Å
383	L	95.3	Very high	94	Very high	148 Å²	148	57.7 Å²	57.7	78%	0.775	31%	0.313	S	S	*	.			trans	-63.5	-33.3	176.1	-65	178	0	0	0	111.4	E291	E291-L383 HydrophobicContact CB-CD1 4.32Å; E291-L383 HydrophobicContact CB-CG 4.46Å; E291-L383 PolarHBondContact O-N 2.76Å
384	G	94	Very high	94.8	Very high	11 Å²	11	63 Å²	63	11%	0.113	33%	0.334	C	S	.	.			trans	67.5	-160	-174.1	0	0	0	0	0	111.8	E291 R382	E291-G384 PolarHBondContact O-N 2.98Å; R382-G384 PolarHBondContact O-N 2.91Å
385	L	94	Very high	94.9	Very high	36 Å²	36	56.7 Å²	56.7	19%	0.188	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-93.5	135.5	178	-68.7	174.5	0	0	0	111	D264 A265 N294 L387 Y536	D264-L385 HydrophobicContact CB-CD1 3.96Å; D264-L385 HydrophobicContact CB-CD2 3.88Å; D264-L385 HydrophobicContact CB-CG 4.08Å; A265-L385 HydrophobicContact CB-CD1 3.9Å; N294-L385 HydrophobicContact CB-CD1 4.42Å; N294-L385 HydrophobicContact CB-CG 4.39Å; L385-L387 PolarHBondContact O-N 2.93Å; L385-Y536 HydrophobicContact CB-CD1 3.34Å; L385-Y536 HydrophobicContact CB-CD2 4.27Å; L385-Y536 HydrophobicContact CB-CE1 3.7Å; L385-Y536 HydrophobicContact CB-CG 3.67Å; L385-Y536 HydrophobicContact CD1-CD1 4.34Å; L385-Y536 HydrophobicContact CD1-CD2 3.88Å; L385-Y536 HydrophobicContact CD1-CG 3.77Å; L385-Y536 HydrophobicContact CG-CD1 4.49Å; L385-Y536 HydrophobicContact CG-CG 4.39Å; L385-Y536 VanDerWaalsContact O-CE1 3.26Å; L385-Y536 WeakPolarHBondContact O-CE1 3.44Å
386	P	94.4	Very high	94.7	Very high	94 Å²	94	57.8 Å²	57.8	61%	0.61	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-68.7	117	176.7	27.9	-33.3	0	0	0	110.5	K388	P386-K388 PolarHBondContact O-N 2.83Å
387	L	95.7	Very high	94	Very high	59 Å²	59	55.1 Å²	55.1	31%	0.309	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-71.2	123.7	-179.8	-171.2	72.4	0	0	0	111.5	L385 A423 F469 L534 Y536	L385-L387 PolarHBondContact O-N 2.93Å; L387-A423 HydrophobicContact CD1-CB 3.91Å; L387-F469 HydrophobicContact CD1-CE1 4.1Å; L387-F469 HydrophobicContact CD2-CE1 3.75Å; L387-F469 HydrophobicContact CD2-CZ 3.82Å; L387-L534 HydrophobicContact CD1-CB 4.16Å; L387-Y536 HydrophobicContact CB-CE1 3.99Å; L387-Y536 HydrophobicContact CD1-CD1 4.23Å; L387-Y536 HydrophobicContact CD1-CE1 3.61Å; L387-Y536 HydrophobicContact CG-CE1 4.45Å
388	K	97.4	Very high	92.7	Very high	53 Å²	53	62.5 Å²	62.5	23%	0.23	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	155.2	174.2	-61.1	163.8	-172.1	157.5	0	110.5	P386 H507 L534 F535 Y536	P386-K388 PolarHBondContact O-N 2.83Å; K388-H507 HydrophobicContact CD-CB 4.02Å; K388-L534 WeakPolarHBondContact O-CA 3.37Å; K388-F535 HydrophobicContact CB-CD1 3.91Å; K388-F535 HydrophobicContact CB-CD2 4.23Å; K388-F535 HydrophobicContact CB-CE1 3.54Å; K388-F535 HydrophobicContact CB-CE2 3.9Å; K388-F535 HydrophobicContact CB-CG 4.25Å; K388-F535 HydrophobicContact CB-CZ 3.54Å; K388-F535 WeakPolarHBondContact CB-O 3.44Å; K388-F535 HydrophobicContact CD-CD2 4.15Å; K388-F535 HydrophobicContact CD-CE2 3.53Å; K388-F535 HydrophobicContact CD-CZ 3.8Å; K388-F535 HydrophobicContact CG-CE2 4.38Å; K388-F535 HydrophobicContact CG-CZ 4.32Å; K388-F535 PolarHBondContact N-O 2.83Å; K388-F535 PolarHBondContact O-N 2.82Å; K388-Y536 WeakPolarHBondContact CE-OXT 3.45Å; K388-Y536 PolarHBondContact NZ-OXT 2.79Å
389	R	97.8	Very high	91.1	Very high	107 Å²	107	69.2 Å²	69.2	40%	0.404	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	116.9	-177.1	-59.6	178.1	177.9	-110.8	3	110	E532 L534	R389-E532 IonicContact CZ-OE2 3.91Å; R389-E532 IonicContact NH1-OE2 3.2Å; R389-E532 PolarHBondContact NH1-OE2 2.74Å; R389-L534 HydrophobicContact CG-CD2 3.84Å
390	C	98.1	Very high	89.6	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	98.6	169.4	176.4	0	0	0	0	109.4	F511 E532 I533 F535	C390-F511 HydrophobicContact CB-CD1 4.26Å; C390-F511 HydrophobicContact CB-CD2 3.89Å; C390-F511 HydrophobicContact CB-CE1 4.14Å; C390-F511 HydrophobicContact CB-CE2 3.76Å; C390-F511 HydrophobicContact CB-CG 4.14Å; C390-F511 HydrophobicContact CB-CZ 3.89Å; C390-F511 VanDerWaalsContact SG-CD2 3.53Å; C390-F511 WeakPolarHBondContact SG-CG 3.42Å; C390-E532 VanDerWaalsContact O-CA 3.28Å; C390-E532 WeakPolarHBondContact O-CA 3.46Å; C390-I533 HydrophobicContact CB-CB 4.37Å; C390-I533 PolarHBondContact N-O 2.55Å; C390-I533 PolarHBondContact O-N 3.21Å; C390-F535 HydrophobicContact CB-CE1 4.11Å
391	H	97.3	Very high	88.2	Confident	67 Å²	67	74.7 Å²	74.7	31%	0.31	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.9	178.2	-168	79.7	0	0	0	111	F393 I465 M501 P531 E532	H391-F393 PolarHBondContact CD2-O 2.97Å; H391-F393 PolarHBondContact NE2-O 2.82Å; H391-I465 WeakPolarHBondContact CE1-CD1 3.46Å; H391-I465 WeakPolarHBondContact ND1-CD1 3.47Å; H391-M501 WeakPolarHBondContact O-CE 3.28Å; H391-P531 WeakPolarHBondContact CA-O 3.45Å; H391-E532 HydrophobicContact CB-CG 4.28Å; H391-E532 IonicContact ND1-OE1 3.91Å; H391-E532 PolarHBondContact ND1-OE1 3.2Å
392	R	97.2	Very high	87.2	Confident	3 Å²	3	73.2 Å²	73.2	1%	0.011	36%	0.36	C	S	.	.			trans	-111.2	3.7	-169.4	72.6	171	-148.7	80.4	-9.6	116.3	G500 M501 V504 F513 G524 V525 I530 P531	R392-G500 CarbonylContact O-C 3.57Å; R392-G500 VanDerWaalsContact O-CA 3.23Å; R392-G500 WeakPolarHBondContact O-CA 3.44Å; R392-M501 PolarHBondContact O-N 3.35Å; R392-V504 HydrophobicContact CB-CG2 4.31Å; R392-F513 HydrophobicContact CB-CD2 4.21Å; R392-F513 HydrophobicContact CB-CE1 4.37Å; R392-F513 HydrophobicContact CB-CE2 3.69Å; R392-F513 HydrophobicContact CB-CZ 3.79Å; R392-F513 HydrophobicContact CG-CZ 4.4Å; R392-G524 PolarHBondContact NH2-O 3.12Å; R392-V525 PolarHBondContact NH1-O 3.07Å; R392-I530 WeakPolarHBondContact CD-O 3.2Å; R392-I530 PolarHBondContact NE-O 3.1Å; R392-P531 WeakPolarHBondContact CG-O 3.31Å; R392-P531 PolarHBondContact N-O 2.84Å
393	F	96.2	Very high	86.6	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.009	36%	0.36	C	S	.	.			trans	-115.6	153	175.4	-66.2	-58.5	0	0	0	110.1	H391 F428 Q498 G527 G528 P531	H391-F393 PolarHBondContact CD2-O 2.97Å; H391-F393 PolarHBondContact NE2-O 2.82Å; F393-F428 AromaticContact CD2-CE2 4Å; F393-F428 HydrophobicContact CD2-CE2 4Å; F393-F428 HydrophobicContact CE2-CE2 4.15Å; F393-Q498 WeakPolarHBondContact CB-O 3.17Å; F393-Q498 WeakPolarHBondContact CD1-O 3.14Å; F393-G527 VanDerWaalsContact CE1-CA 3.43Å; F393-G528 WeakPolarHBondContact CE2-O 3.02Å; F393-P531 HydrophobicContact CD2-CB 3.78Å; F393-P531 HydrophobicContact CE2-CB 4.19Å
394	Q	92.9	Very high	86.2	Confident	134 Å²	134	72.2 Å²	72.2	63%	0.626	35%	0.346	S	S	*	.	S	Bend	trans	-95.5	-24	174.3	-63.5	176.9	-18.7	0	0	111.6	Q498 E499 M501	Q394-Q498 PolarHBondContact N-O 3.38Å; Q394-E499 HydrophobicContact CB-CB 3.83Å; Q394-E499 HydrophobicContact CG-CB 4.34Å; Q394-E499 PolarHBondContact N-O 3.44Å; Q394-M501 HydrophobicContact CG-CE 4.34Å; Q394-M501 HydrophobicContact CG-CG 4.15Å; Q394-M501 HydrophobicContact CG-SD 4.02Å
395	S	88.5	Confident	85.8	Confident	39 Å²	39	73 Å²	73	27%	0.273	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.4	-179.3	56.2	0	0	0	0	112.3	G497 Q498 E499	S395-G497 WeakPolarHBondContact O-CA 2.99Å; S395-Q498 PolarHBondContact O-N 2.82Å; S395-E499 WeakPolarHBondContact CB-OE2 3.1Å; S395-E499 VanDerWaalsContact OG-CD 3.29Å; S395-E499 PolarHBondContact OG-OE2 3.37Å
396	S	85.2	Confident	85.2	Confident	51 Å²	51	79.8 Å²	79.8	36%	0.357	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.3	170.7	63.8	0	0	0	0	109.7	F496	S396-F496 WeakPolarHBondContact CA-O 3.27Å
397	A	78	Confident	84.7	Confident	13 Å²	13	77.6 Å²	77.6	11%	0.107	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.4	-179.7	0	0	0	0	0	112.6	Y495 F496 Q498	A397-Y495 WeakPolarHBondContact O-CD1 3.31Å; A397-F496 HydrophobicContact CB-CD1 4.2Å; A397-F496 HydrophobicContact CB-CE1 3.58Å; A397-F496 HydrophobicContact CB-CE2 4.12Å; A397-F496 HydrophobicContact CB-CZ 3.55Å; A397-F496 PolarHBondContact N-O 2.79Å; A397-Q498 VanDerWaalsContact CB-CD 3.5Å; A397-Q498 HydrophobicContact CB-CG 3.91Å
398	Y	69.4	Low	84.5	Confident	164 Å²	164	80 Å²	80	64%	0.643	37%	0.369	S	S	*	.			trans	-113	-14.4	175.4	87.8	-88.2	0	0	0	114.1
399	R	61.3	Low	84.5	Confident	188 Å²	188	78.5 Å²	78.5	71%	0.709	36%	0.364	S	S	*	.	S	Bend	trans	-64.8	177.7	-173.3	-65.8	-170.7	178.9	177	2.5	111.5	N401	R399-N401 PolarHBondContact O-N 3.2Å
400	N	62.6	Low	84.4	Confident	157 Å²	157	73.4 Å²	73.4	84%	0.84	35%	0.345	S	S	*	.	S	Bend	trans	-44.8	-7.2	-174.5	-60.9	-13.2	0	0	0	118.7	Q402	N400-Q402 PolarHBondContact O-N 2.67Å
401	N	65	Low	84.4	Confident	124 Å²	124	73.4 Å²	73.4	66%	0.663	35%	0.345	S	S	*	.			trans	-97.8	46.9	-179.9	-69.4	-21.5	0	0	0	112.7	R399 F496	R399-N401 PolarHBondContact O-N 3.2Å; N401-F496 HydrophobicContact CB-CE1 4.35Å; N401-F496 HydrophobicContact CB-CZ 4.3Å; N401-F496 WeakPolarHBondContact O-CE1 3.3Å
402	Q	73.9	Confident	84.5	Confident	58 Å²	58	70.2 Å²	70.2	27%	0.271	33%	0.331	S	S	.	.			trans	-65.2	148.7	-178.7	-58.1	168.2	-31.8	0	0	112.3	N400 S431 L493	N400-Q402 PolarHBondContact O-N 2.67Å; Q402-S431 VanDerWaalsContact CD-OG 3.28Å; Q402-S431 PolarHBondContact NE2-OG 3.02Å; Q402-L493 HydrophobicContact CB-CB 3.48Å; Q402-L493 VanDerWaalsContact CB-CB 3.48Å; Q402-L493 HydrophobicContact CB-CD1 3.94Å; Q402-L493 HydrophobicContact CB-CG 4.27Å; Q402-L493 HydrophobicContact CG-CB 4.32Å
403	W	85.3	Confident	84.5	Confident	31 Å²	31	72.4 Å²	72.4	12%	0.117	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-76	136.8	-174.3	-145.3	-96.6	0	0	0	111.5	Y405 D410 L493 S494 F496 N521 G528 Q529	W403-Y405 AromaticContact CD1-CE1 3.84Å; W403-D410 WeakPolarHBondContact CZ2-OD1 3.36Å; W403-D410 PolarHBondContact NE1-OD1 3.39Å; W403-D410 PolarHBondContact NE1-OD2 3.01Å; W403-L493 WeakPolarHBondContact O-CA 3.27Å; W403-L493 WeakPolarHBondContact O-CD2 3.44Å; W403-S494 VanDerWaalsContact CB-OG 3.24Å; W403-S494 WeakPolarHBondContact CB-OG 3.37Å; W403-S494 PolarHBondContact N-O 2.89Å; W403-S494 VanDerWaalsContact N-O 3.16Å; W403-S494 PolarHBondContact O-N 3.25Å; W403-F496 HydrophobicContact CB-CB 4.39Å; W403-F496 HydrophobicContact CD2-CB 3.95Å; W403-F496 HydrophobicContact CD2-CG 4.43Å; W403-F496 HydrophobicContact CE3-CB 3.25Å; W403-F496 AromaticContact CE3-CD1 3.96Å; W403-F496 HydrophobicContact CE3-CD1 3.96Å; W403-F496 AromaticContact CE3-CD2 3.66Å; W403-F496 HydrophobicContact CE3-CD2 3.66Å; W403-F496 HydrophobicContact CE3-CE2 4.47Å; W403-F496 AromaticContact CE3-CG 3.34Å; W403-F496 HydrophobicContact CE3-CG 3.34Å; W403-F496 HydrophobicContact CG-CB 4.47Å; W403-F496 HydrophobicContact CZ3-CB 3.75Å; W403-F496 AromaticContact CZ3-CD2 3.47Å; W403-F496 HydrophobicContact CZ3-CD2 3.47Å; W403-F496 VanDerWaalsContact CZ3-CD2 3.47Å; W403-F496 HydrophobicContact CZ3-CE2 4.2Å; W403-F496 AromaticContact CZ3-CG 3.69Å; W403-F496 HydrophobicContact CZ3-CG 3.69Å; W403-N521 VanDerWaalsContact CZ2-O 3.24Å; W403-N521 WeakPolarHBondContact CZ2-O 3.49Å; W403-N521 PolarHBondContact NE1-ND2 3.3Å; W403-N521 VanDerWaalsContact NE1-ND2 3.12Å; W403-G528 VanDerWaalsContact CH2-CA 3.45Å; W403-Q529 HydrophobicContact CD2-CG 3.94Å; W403-Q529 HydrophobicContact CG-CG 3.71Å; W403-Q529 HydrophobicContact CZ2-CG 4.37Å
404	R	86	Confident	84.7	Confident	126 Å²	126	72.3 Å²	72.3	48%	0.475	34%	0.341	S	S	.	.			trans	-108.9	142.6	-176.5	-76.6	177.9	-178	88	-0.6	110.8	L493 N521	R404-L493 HydrophobicContact CB-CD2 4.28Å; R404-L493 HydrophobicContact CG-CD2 3.39Å; R404-N521 PolarHBondContact O-ND2 2.94Å; R404-N521 PolarHBondContact O-OD1 3.25Å; R404-N521 VanDerWaalsContact O-OD1 3.1Å
405	Y	85.1	Confident	84.9	Confident	26 Å²	26	66.2 Å²	66.2	10%	0.102	31%	0.313	C	S	.	.			trans	-116.2	115	-178.9	-54.5	-62.5	0	0	0	108.6	W403 Y437 L488 S494 Q529	W403-Y405 AromaticContact CD1-CE1 3.84Å; Y405-Y437 HydrophobicContact CD2-CD1 4.31Å; Y405-Y437 AromaticContact CD2-CE1 3.63Å; Y405-Y437 HydrophobicContact CD2-CE1 3.63Å; Y405-Y437 HydrophobicContact CE2-CD1 4.09Å; Y405-Y437 AromaticContact CE2-CE1 3.29Å; Y405-Y437 HydrophobicContact CE2-CE1 3.29Å; Y405-Y437 AromaticContact CE2-CZ 3.93Å; Y405-L488 WeakPolarHBondContact CB-O 3.37Å; Y405-L488 HydrophobicContact CD1-CB 3.47Å; Y405-L488 VanDerWaalsContact CD1-CB 3.47Å; Y405-L488 HydrophobicContact CD1-CD1 4.4Å; Y405-L488 HydrophobicContact CE1-CB 3.52Å; Y405-L488 HydrophobicContact CE1-CD1 3.6Å; Y405-L488 HydrophobicContact CE1-CG 4.14Å; Y405-L488 HydrophobicContact CG-CB 4.14Å; Y405-S494 WeakPolarHBondContact OH-CB 3.5Å; Y405-S494 PolarHBondContact OH-OG 3.47Å; Y405-Q529 HydrophobicContact CE1-CG 4.16Å; Y405-Q529 PolarHBondContact OH-OE1 3.03Å
406	R	81.4	Confident	85.4	Confident	179 Å²	179	64.4 Å²	64.4	68%	0.675	30%	0.3	S	S	*	.	S	Bend	trans	-137.5	44.7	-177.1	-67.6	-172.4	175.8	178.6	-1	111.1	R408	R406-R408 HydrophobicContact CB-CG 4.46Å; R406-R408 PolarHBondContact O-N 2.66Å
407	G	83.7	Confident	86	Confident	49 Å²	49	65 Å²	65	51%	0.505	30%	0.299	S	S	.	.	S	Bend	trans	62.8	20.8	-172.2	0	0	0	0	0	113.4
408	R	92.8	Very high	86.8	Confident	109 Å²	109	71 Å²	71	41%	0.411	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-91.3	150.8	179.5	-64.2	177.6	-177	172.9	-3.3	109.5	R406 N521	R406-R408 HydrophobicContact CB-CG 4.46Å; R406-R408 PolarHBondContact O-N 2.66Å; R408-N521 HydrophobicContact CB-CB 3.6Å; R408-N521 WeakPolarHBondContact CD-OD1 3.41Å
409	C	96	Very high	88	Confident	21 Å²	21	65.7 Å²	65.7	14%	0.142	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.2	178.8	-174.6	0	0	0	0	110.5	I486 V487 T520 N521	C409-I486 WeakPolarHBondContact CA-O 3.35Å; C409-V487 HydrophobicContact CB-CG2 4.21Å; C409-T520 PolarHBondContact N-OG1 3.16Å; C409-T520 PolarHBondContact O-N 2.89Å; C409-T520 PolarHBondContact O-OG1 3.44Å; C409-N521 PolarHBondContact O-N 3.47Å
410	D	97.4	Very high	89.7	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.9	161.8	-79.5	-69.9	0	0	0	108.1	W403 I486 N521 T523 Q529	W403-D410 WeakPolarHBondContact CZ2-OD1 3.36Å; W403-D410 PolarHBondContact NE1-OD1 3.39Å; W403-D410 PolarHBondContact NE1-OD2 3.01Å; D410-I486 PolarHBondContact N-O 2.87Å; D410-I486 PolarHBondContact O-N 3.4Å; D410-N521 WeakPolarHBondContact OD1-CB 2.93Å; D410-N521 WeakPolarHBondContact OD2-CB 3.08Å; D410-N521 PolarHBondContact OD2-ND2 3.5Å; D410-T523 WeakPolarHBondContact CB-OG1 3.29Å; D410-T523 VanDerWaalsContact CG-OG1 3.31Å; D410-T523 VanDerWaalsContact OD1-CB 3.3Å; D410-T523 WeakPolarHBondContact OD1-CB 3.35Å; D410-T523 PolarHBondContact OD1-OG1 3.39Å; D410-Q529 HydrophobicContact CB-CB 4.06Å
411	S	98	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	142.8	-176.4	-175.9	0	0	0	0	113.2	T483 A484 S516 S519	S411-T483 WeakPolarHBondContact OG-CG2 3.37Å; S411-A484 CarbonylContact C-O 3.56Å; S411-A484 WeakPolarHBondContact CA-O 3.38Å; S411-A484 WeakPolarHBondContact CB-O 3.48Å; S411-A484 PolarHBondContact OG-O 2.97Å; S411-S516 WeakPolarHBondContact OG-CB 3.38Å; S411-S516 PolarHBondContact OG-OG 2.91Å; S411-S519 PolarHBondContact N-OG 3.29Å; S411-S519 WeakPolarHBondContact O-CB 3.01Å; S411-S519 PolarHBondContact O-OG 3.27Å
412	I	98.4	Very high	93	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	140.3	176.5	-169.2	72.1	0	0	0	109.4	A484 F513 Q514 T523 V525 I530	I412-A484 HydrophobicContact CG2-CB 3.99Å; I412-A484 PolarHBondContact N-O 2.79Å; I412-A484 PolarHBondContact O-N 3.08Å; I412-F513 HydrophobicContact CG1-CB 4.47Å; I412-F513 HydrophobicContact CG1-CD1 3.99Å; I412-Q514 WeakPolarHBondContact CD1-O 3.37Å; I412-T523 HydrophobicContact CB-CG2 4.26Å; I412-V525 HydrophobicContact CD1-CG2 4.38Å; I412-I530 HydrophobicContact CG2-CB 4.36Å; I412-I530 HydrophobicContact CG2-CD1 3.98Å; I412-I530 HydrophobicContact CG2-CG2 4.31Å
413	Q	98.4	Very high	94.1	Very high	49 Å²	49	41.5 Å²	41.5	23%	0.229	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	141.8	169.8	-71.6	-172.8	-39.5	0	0	110.1	Y481 Y482 T483 F513 Q514	Q413-Y481 HydrophobicContact CB-CD1 4.3Å; Q413-Y482 CarbonylContact C-O 3.46Å; Q413-Y482 WeakPolarHBondContact CA-O 3.16Å; Q413-T483 HydrophobicContact CG-CG2 4.43Å; Q413-T483 PolarHBondContact NE2-OG1 2.82Å; Q413-F513 WeakPolarHBondContact O-CA 3.43Å; Q413-Q514 HydrophobicContact CB-CB 4.19Å; Q413-Q514 PolarHBondContact N-O 3.16Å; Q413-Q514 PolarHBondContact O-N 2.85Å
414	F	98.6	Very high	94.7	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.3	173.7	73	-83.8	0	0	0	111.6	T416 V422 L443 I476 Y481 Y482 A484 F511 Q512 F513 I533	F414-T416 HydrophobicContact CD2-CG2 4.42Å; F414-V422 HydrophobicContact CE2-CG2 4.31Å; F414-V422 HydrophobicContact CZ-CG2 4.08Å; F414-L443 HydrophobicContact CE1-CD1 3.71Å; F414-L443 HydrophobicContact CZ-CD1 3.85Å; F414-I476 HydrophobicContact CE2-CD1 4.39Å; F414-I476 HydrophobicContact CE2-CG1 4.29Å; F414-I476 HydrophobicContact CE2-CG2 4.14Å; F414-I476 HydrophobicContact CZ-CD1 4.05Å; F414-I476 HydrophobicContact CZ-CG1 4.37Å; F414-Y481 WeakPolarHBondContact O-CA 3.29Å; F414-Y482 HydrophobicContact CZ-CG 4.44Å; F414-Y482 PolarHBondContact N-O 2.76Å; F414-Y482 PolarHBondContact O-N 2.92Å; F414-A484 HydrophobicContact CE1-CB 4.44Å; F414-F511 HydrophobicContact CD2-CD1 4.38Å; F414-Q512 CarbonylContact C-O 3.5Å; F414-Q512 WeakPolarHBondContact CA-O 3.47Å; F414-F513 HydrophobicContact CB-CD1 3.92Å; F414-F513 HydrophobicContact CB-CE1 3.94Å; F414-I533 HydrophobicContact CB-CD1 3.84Å; F414-I533 HydrophobicContact CD1-CD1 3.63Å; F414-I533 HydrophobicContact CD2-CD1 3.67Å; F414-I533 HydrophobicContact CE1-CD1 4.06Å; F414-I533 HydrophobicContact CE2-CD1 4.09Å; F414-I533 HydrophobicContact CG-CD1 3.42Å; F414-I533 VanDerWaalsContact CG-CD1 3.42Å; F414-I533 HydrophobicContact CZ-CD1 4.27Å
415	C	98.3	Very high	95.3	Very high	6 Å²	6	34 Å²	34	4%	0.041	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.5	173.3	-178.5	0	0	0	0	108.2	D479 Y481 F511 Q512	C415-D479 WeakPolarHBondContact SG-CA 3.44Å; C415-Y481 HydrophobicContact CB-CD1 3.78Å; C415-Y481 HydrophobicContact CB-CD2 4.07Å; C415-Y481 HydrophobicContact CB-CE1 3.62Å; C415-Y481 HydrophobicContact CB-CE2 3.9Å; C415-Y481 HydrophobicContact CB-CG 4.01Å; C415-F511 WeakPolarHBondContact O-CA 3.39Å; C415-Q512 PolarHBondContact N-O 2.82Å; C415-Q512 PolarHBondContact O-N 2.99Å
416	T	98.5	Very high	95.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.5	174.4	54.3	0	0	0	0	111.2	F414 R418 I420 A478 D479 V509 T510 F511	F414-T416 HydrophobicContact CD2-CG2 4.42Å; T416-R418 WeakPolarHBondContact CB-O 3.08Å; T416-R418 PolarHBondContact O-N 3.47Å; T416-R418 PolarHBondContact OG1-O 2.87Å; T416-I420 HydrophobicContact CG2-CD1 3.79Å; T416-I420 HydrophobicContact CG2-CG1 4.4Å; T416-A478 CarbonylContact O-C 3.5Å; T416-A478 WeakPolarHBondContact O-CA 3.49Å; T416-D479 PolarHBondContact O-N 3.18Å; T416-V509 HydrophobicContact CG2-CG1 4Å; T416-T510 WeakPolarHBondContact CA-O 3.36Å; T416-F511 HydrophobicContact CG2-CD1 3.43Å; T416-F511 VanDerWaalsContact CG2-CD1 3.43Å; T416-F511 HydrophobicContact CG2-CD2 4.37Å; T416-F511 HydrophobicContact CG2-CE1 3.39Å; T416-F511 HydrophobicContact CG2-CE2 4.33Å; T416-F511 HydrophobicContact CG2-CG 3.94Å; T416-F511 HydrophobicContact CG2-CZ 3.87Å
417	D	97.9	Very high	96.7	Very high	63 Å²	63	24.3 Å²	24.3	34%	0.337	12%	0.119	S	C	.	.	S	Bend	trans	-72	-10.2	175.9	62.4	-11.6	0	0	0	113.6	T510	D417-T510 VanDerWaalsContact CG-N 3.3Å; D417-T510 PolarHBondContact N-O 3.38Å; D417-T510 PolarHBondContact OD1-N 3.16Å; D417-T510 WeakPolarHBondContact OD2-CB 3.5Å; D417-T510 PolarHBondContact OD2-N 3.01Å; D417-T510 PolarHBondContact OD2-OG1 3.45Å
418	R	95.5	Very high	97.2	Very high	138 Å²	138	22.1 Å²	22.1	52%	0.521	10%	0.096	S	C	.	.	S	Bend	trans	-139.9	157.3	-177.9	-61	-175.2	72.8	-164.6	-1	110.9	T416 I420 N508	T416-R418 WeakPolarHBondContact CB-O 3.08Å; T416-R418 PolarHBondContact O-N 3.47Å; T416-R418 PolarHBondContact OG1-O 2.87Å; R418-I420 PolarHBondContact O-N 2.87Å; R418-N508 WeakPolarHBondContact CD-O 3.15Å
419	R	94.3	Very high	97.2	Very high	53 Å²	53	17 Å²	17	20%	0.2	8%	0.076	C	C	.	.			trans	-64.8	131.6	171.2	-172.6	-179.3	73.7	-179.9	12.3	110.1	E261 Q475 I476	E261-R419 IonicContact OE2-CZ 2.87Å; E261-R419 IonicContact OE2-NE 2.81Å; E261-R419 IonicContact OE2-NH2 3.57Å; E261-R419 PolarHBondContact OE2-NH2 3.21Å; R419-Q475 HydrophobicContact CG-CG 4.18Å; R419-I476 VanDerWaalsContact CA-O 3.25Å; R419-I476 WeakPolarHBondContact CA-O 3.46Å; R419-I476 WeakPolarHBondContact CG-O 3.47Å
420	I	96.9	Very high	97	Very high	6 Å²	6	16 Å²	16	3%	0.031	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	170	174.9	62.4	167.8	0	0	0	110.4	T416 R418 V422 I476 V509 F511 F535	T416-I420 HydrophobicContact CG2-CD1 3.79Å; T416-I420 HydrophobicContact CG2-CG1 4.4Å; R418-I420 PolarHBondContact O-N 2.87Å; I420-V422 HydrophobicContact CD1-CG2 4.02Å; I420-I476 HydrophobicContact CD1-CG1 4.45Å; I420-I476 HydrophobicContact CG1-CB 3.71Å; I420-I476 HydrophobicContact CG1-CG1 3.97Å; I420-I476 HydrophobicContact CG1-CG2 4.17Å; I420-I476 PolarHBondContact N-O 3.38Å; I420-I476 PolarHBondContact O-N 3.36Å; I420-V509 HydrophobicContact CG2-CG1 4.02Å; I420-V509 HydrophobicContact CG2-CG2 4.01Å; I420-F511 HydrophobicContact CD1-CE1 3.72Å; I420-F511 HydrophobicContact CD1-CZ 3.64Å; I420-F535 HydrophobicContact CB-CD2 4.05Å; I420-F535 HydrophobicContact CD1-CB 3.98Å; I420-F535 HydrophobicContact CD1-CD2 4.12Å; I420-F535 HydrophobicContact CD1-CG 4.11Å; I420-F535 HydrophobicContact CG2-CD2 3.92Å; I420-F535 HydrophobicContact CG2-CE2 4.19Å
421	F	97.6	Very high	96.6	Very high	10 Å²	10	16.9 Å²	16.9	4%	0.044	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.3	169.2	-65.8	-92.6	0	0	0	110.1	E261 M262 A265 Q266 A423 P473 V474 Q475 F535 Y536	E261-F421 HydrophobicContact CB-CE2 4.37Å; M262-F421 HydrophobicContact CB-CZ 4.38Å; A265-F421 HydrophobicContact CB-CB 3.88Å; A265-F421 HydrophobicContact CB-CD1 3.45Å; A265-F421 VanDerWaalsContact CB-CD1 3.45Å; A265-F421 HydrophobicContact CB-CD2 3.5Å; A265-F421 HydrophobicContact CB-CE1 3.75Å; A265-F421 HydrophobicContact CB-CE2 3.8Å; A265-F421 HydrophobicContact CB-CG 3.31Å; A265-F421 HydrophobicContact CB-CZ 3.92Å; Q266-F421 HydrophobicContact CG-CD1 4.33Å; Q266-F421 HydrophobicContact CG-CE1 4.21Å; F421-A423 PolarHBondContact O-N 2.62Å; F421-P473 HydrophobicContact CB-CB 3.86Å; F421-V474 CarbonylContact C-O 3.51Å; F421-V474 WeakPolarHBondContact CA-O 3.4Å; F421-Q475 HydrophobicContact CD1-CB 3.99Å; F421-Q475 HydrophobicContact CE1-CB 3.73Å; F421-Q475 HydrophobicContact CE1-CG 4.04Å; F421-Q475 HydrophobicContact CZ-CG 4.36Å; F421-F535 CarbonylContact O-C 3.51Å; F421-F535 WeakPolarHBondContact O-CA 3.2Å; F421-F535 WeakPolarHBondContact O-CB 3.2Å; F421-Y536 HydrophobicContact CB-CD2 4.48Å; F421-Y536 PolarHBondContact O-N 2.81Å
422	V	98.3	Very high	96	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	114	177.3	169.8	0	0	0	0	109.1	F414 I420 F425 L443 F470 P473 V474 I476 I533 L534	F414-V422 HydrophobicContact CE2-CG2 4.31Å; F414-V422 HydrophobicContact CZ-CG2 4.08Å; I420-V422 HydrophobicContact CD1-CG2 4.02Å; V422-F425 HydrophobicContact CG1-CE1 4.27Å; V422-F425 HydrophobicContact CG1-CZ 4.41Å; V422-L443 HydrophobicContact CB-CD2 4.47Å; V422-F470 HydrophobicContact CG1-CE2 4.33Å; V422-P473 CarbonylContact O-C 3.52Å; V422-P473 VanDerWaalsContact O-CA 3.29Å; V422-P473 WeakPolarHBondContact O-CA 3.06Å; V422-V474 PolarHBondContact N-O 3.08Å; V422-V474 PolarHBondContact O-N 2.94Å; V422-I476 HydrophobicContact CB-CD1 4.43Å; V422-I476 HydrophobicContact CB-CG1 4.19Å; V422-I476 HydrophobicContact CG2-CD1 4Å; V422-I476 HydrophobicContact CG2-CG1 3.47Å; V422-I476 VanDerWaalsContact CG2-CG1 3.47Å; V422-I533 HydrophobicContact CG1-CG2 4.24Å; V422-I533 HydrophobicContact CG2-CG2 3.81Å; V422-L534 CarbonylContact C-O 3.5Å
423	A	97.7	Very high	95.6	Very high	4 Å²	4	23.6 Å²	23.6	3%	0.033	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-26.9	176.1	0	0	0	0	0	111.9	L387 F421 F469 F470 L534 Y536	L387-A423 HydrophobicContact CD1-CB 3.91Å; F421-A423 PolarHBondContact O-N 2.62Å; A423-F469 HydrophobicContact CB-CD1 3.95Å; A423-F469 HydrophobicContact CB-CE1 4.31Å; A423-F469 CarbonylContact O-C 3.55Å; A423-F469 VanDerWaalsContact O-CA 3.27Å; A423-F469 WeakPolarHBondContact O-CA 3.3Å; A423-F470 PolarHBondContact O-N 2.96Å; A423-L534 PolarHBondContact N-O 2.84Å; A423-Y536 HydrophobicContact CB-CD2 4.34Å; A423-Y536 HydrophobicContact CB-CE2 3.75Å
424	G	98.2	Very high	95.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.9	-158.7	-179.1	0	0	0	0	0	113.2	V468 L534	G424-V468 CarbonylContact C-O 3.51Å; G424-V468 VanDerWaalsContact CA-O 3.29Å; G424-V468 WeakPolarHBondContact CA-O 3.47Å; G424-L534 PolarHBondContact N-O 3.48Å; G424-L534 WeakPolarHBondContact O-CB 3.45Å; G424-L534 PolarHBondContact O-N 2.85Å
425	F	98.5	Very high	95	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.5	-179.2	-55.4	-66.4	0	0	0	111	V422 L427 L441 L443 V468 F470 A484 I486 I530 E532 I533	V422-F425 HydrophobicContact CG1-CE1 4.27Å; V422-F425 HydrophobicContact CG1-CZ 4.41Å; F425-L427 HydrophobicContact CB-CD2 4.27Å; F425-L441 HydrophobicContact CD2-CD2 3.95Å; F425-L443 HydrophobicContact CZ-CD1 4.28Å; F425-V468 PolarHBondContact N-O 3.12Å; F425-V468 PolarHBondContact O-N 3.46Å; F425-F470 HydrophobicContact CD2-CE2 4.41Å; F425-F470 HydrophobicContact CD2-CZ 4.45Å; F425-F470 AromaticContact CE2-CE2 3.8Å; F425-F470 HydrophobicContact CE2-CE2 3.8Å; F425-F470 AromaticContact CE2-CZ 3.72Å; F425-F470 HydrophobicContact CE2-CZ 3.72Å; F425-F470 HydrophobicContact CZ-CE2 4.26Å; F425-F470 HydrophobicContact CZ-CZ 4.44Å; F425-A484 HydrophobicContact CD1-CB 4.22Å; F425-A484 HydrophobicContact CE1-CB 3.47Å; F425-A484 VanDerWaalsContact CE1-CB 3.47Å; F425-A484 HydrophobicContact CE2-CB 3.98Å; F425-A484 HydrophobicContact CZ-CB 3.33Å; F425-I486 HydrophobicContact CD2-CD1 3.62Å; F425-I486 HydrophobicContact CE2-CD1 4.19Å; F425-I486 HydrophobicContact CG-CD1 4.36Å; F425-I530 HydrophobicContact CB-CG2 4.37Å; F425-I530 HydrophobicContact CD1-CG2 4.31Å; F425-I530 HydrophobicContact CG-CG2 4.49Å; F425-E532 WeakPolarHBondContact CA-O 2.92Å; F425-I533 HydrophobicContact CD1-CG1 4.17Å; F425-I533 HydrophobicContact CE1-CG1 4.22Å
426	G	97.9	Very high	94.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135	163.3	0	0	0	0	0	109.3	I465 P531 E532	G426-I465 VanDerWaalsContact CA-CG2 3.41Å; G426-P531 WeakPolarHBondContact O-CD 3.32Å; G426-P531 WeakPolarHBondContact O-CG 3.28Å; G426-E532 PolarHBondContact N-O 3.05Å
427	L	97	Very high	94.7	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.7	-177.9	-56.9	178.7	0	0	0	110.7	F425 V439 F457 F466 V468 I486 L488 I530	F425-L427 HydrophobicContact CB-CD2 4.27Å; L427-V439 HydrophobicContact CD1-CG1 3.74Å; L427-V439 HydrophobicContact CD1-CG2 4.39Å; L427-F457 HydrophobicContact CB-CE1 4.35Å; L427-F457 HydrophobicContact CB-CZ 4.41Å; L427-F457 HydrophobicContact CD1-CE1 4.12Å; L427-F466 PolarHBondContact N-O 3.24Å; L427-F466 PolarHBondContact O-N 3.22Å; L427-V468 HydrophobicContact CD1-CB 4.42Å; L427-V468 HydrophobicContact CD1-CG2 3.87Å; L427-V468 HydrophobicContact CG-CG2 4.4Å; L427-I486 HydrophobicContact CD1-CG2 4.02Å; L427-I486 HydrophobicContact CD2-CD1 4.28Å; L427-I486 HydrophobicContact CD2-CG1 4.01Å; L427-I486 HydrophobicContact CD2-CG2 4.13Å; L427-L488 HydrophobicContact CD1-CD2 4.29Å; L427-I530 HydrophobicContact CD2-CG1 4.33Å
428	F	94.7	Very high	94.6	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.018	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	142.3	168	-75.5	-66.8	0	0	0	111.1	F393 I465 Y495 Q529 P531	F393-F428 AromaticContact CD2-CE2 4Å; F393-F428 HydrophobicContact CD2-CE2 4Å; F393-F428 HydrophobicContact CE2-CE2 4.15Å; F428-I465 HydrophobicContact CE1-CG1 4.26Å; F428-Y495 WeakPolarHBondContact CB-O 3.47Å; F428-Q529 PolarHBondContact N-O 3.28Å; F428-P531 HydrophobicContact CD2-CB 4.29Å; F428-P531 HydrophobicContact CD2-CG 3.89Å; F428-P531 HydrophobicContact CE2-CB 3.61Å; F428-P531 HydrophobicContact CE2-CG 3.72Å; F428-P531 HydrophobicContact CG-CG 4.37Å; F428-P531 HydrophobicContact CZ-CB 3.82Å; F428-P531 HydrophobicContact CZ-CG 4.08Å
429	G	93.5	Very high	94.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.			trans	-104	-174.5	176	0	0	0	0	0	113.3	S494 Y495	G429-S494 WeakPolarHBondContact O-CA 3.25Å; G429-S494 WeakPolarHBondContact O-CB 3.49Å; G429-Y495 PolarHBondContact O-N 3.04Å; G429-Y495 VanDerWaalsContact O-N 3.1Å
430	S	92.2	Very high	94.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-48	138.5	177.9	175.3	0	0	0	0	112.8	N432 G433 Y437 S459 G461 E492 Y495	S430-N432 PolarHBondContact OG-N 2.83Å; S430-N432 PolarHBondContact OG-O 3.23Å; S430-G433 WeakPolarHBondContact CB-O 3.24Å; S430-G433 PolarHBondContact OG-O 3.03Å; S430-Y437 VanDerWaalsContact CA-OH 3.23Å; S430-Y437 WeakPolarHBondContact CA-OH 3.5Å; S430-Y437 WeakPolarHBondContact CB-OH 3.38Å; S430-Y437 PolarHBondContact N-OH 3.44Å; S430-S459 VanDerWaalsContact N-CB 3.34Å; S430-S459 PolarHBondContact N-OG 2.94Å; S430-G461 CarbonylContact O-C 3.57Å; S430-G461 VanDerWaalsContact O-CA 3.28Å; S430-G461 WeakPolarHBondContact O-CA 3.21Å; S430-E492 WeakPolarHBondContact OG-CB 3.32Å; S430-Y495 VanDerWaalsContact O-CE2 3.3Å; S430-Y495 WeakPolarHBondContact O-CE2 3.46Å
431	S	88	Confident	94.8	Very high	20 Å²	20	28.8 Å²	28.8	14%	0.14	16%	0.159	C	C	.	.	S	Bend	trans	-95	-1.3	170.7	60.3	0	0	0	0	113.3	Q402 L493 Y495	Q402-S431 VanDerWaalsContact CD-OG 3.28Å; Q402-S431 PolarHBondContact NE2-OG 3.02Å; S431-L493 PolarHBondContact N-O 3.03Å; S431-L493 PolarHBondContact OG-O 3.33Å; S431-Y495 VanDerWaalsContact CA-CE2 3.42Å
432	N	86.5	Confident	94.8	Very high	103 Å²	103	30.5 Å²	30.5	55%	0.551	17%	0.167	S	C	*	.	S	Bend	trans	-130.3	69.9	-175.7	-172.7	34.7	0	0	0	110.4	S430 E492	S430-N432 PolarHBondContact OG-N 2.83Å; S430-N432 PolarHBondContact OG-O 3.23Å; N432-E492 WeakPolarHBondContact CB-OE2 3.49Å; N432-E492 PolarHBondContact ND2-OE2 3.22Å
433	G	88.3	Confident	94.8	Very high	39 Å²	39	30.5 Å²	30.5	40%	0.402	17%	0.167	S	C	.	.	S	Bend	trans	67	-169	-179.9	0	0	0	0	0	114	S430 A435 G461	S430-G433 WeakPolarHBondContact CB-O 3.24Å; S430-G433 PolarHBondContact OG-O 3.03Å; G433-A435 PolarHBondContact O-N 3.46Å; G433-G461 WeakPolarHBondContact O-CA 3.34Å; G433-G461 PolarHBondContact O-N 2.9Å
434	S	93	Very high	94.9	Very high	101 Å²	101	31.5 Å²	31.5	71%	0.706	17%	0.17	S	C	*	.	S	Bend	trans	-69.7	130.9	-174	-53.5	0	0	0	0	112.4	S459	S434-S459 CarbonylContact C-O 3.56Å; S434-S459 WeakPolarHBondContact CA-O 3.36Å; S434-S459 WeakPolarHBondContact CB-O 3.39Å
435	A	93.2	Very high	94.8	Very high	15 Å²	15	36.6 Å²	36.6	12%	0.124	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	150.6	177.9	0	0	0	0	0	111.5	G433 Y437 S459 E492	G433-A435 PolarHBondContact O-N 3.46Å; A435-Y437 HydrophobicContact CB-CE2 4.05Å; A435-S459 PolarHBondContact N-O 3.21Å; A435-S459 PolarHBondContact O-N 3.02Å; A435-E492 HydrophobicContact CB-CB 3.95Å; A435-E492 HydrophobicContact CB-CG 3.75Å
436	K	94.6	Very high	94.6	Very high	96 Å²	96	42.2 Å²	42.2	42%	0.417	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.2	172	-171.9	-178.5	-177.2	174	0	109.7	C456 F457 F458	K436-C456 VanDerWaalsContact CE-CB 3.44Å; K436-C456 WeakPolarHBondContact CE-SG 3.44Å; K436-C456 HydrophobicContact CG-CB 4.4Å; K436-F457 WeakPolarHBondContact CA-O 3.49Å; K436-F458 HydrophobicContact CB-CD1 3.84Å; K436-F458 HydrophobicContact CB-CE1 3.71Å; K436-F458 HydrophobicContact CB-CZ 4.47Å; K436-F458 HydrophobicContact CD-CD1 4.5Å; K436-F458 HydrophobicContact CD-CE1 3.67Å; K436-F458 HydrophobicContact CD-CE2 4.41Å; K436-F458 HydrophobicContact CD-CZ 3.63Å; K436-F458 HydrophobicContact CG-CD1 4.03Å; K436-F458 HydrophobicContact CG-CE1 3.7Å; K436-F458 HydrophobicContact CG-CE2 4.49Å; K436-F458 HydrophobicContact CG-CZ 3.96Å
437	Y	94.6	Very high	94.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.2	170.9	-68.6	-85.2	0	0	0	110.1	Y405 S430 A435 C456 F457 L488 E489 E492	Y405-Y437 HydrophobicContact CD2-CD1 4.31Å; Y405-Y437 AromaticContact CD2-CE1 3.63Å; Y405-Y437 HydrophobicContact CD2-CE1 3.63Å; Y405-Y437 HydrophobicContact CE2-CD1 4.09Å; Y405-Y437 AromaticContact CE2-CE1 3.29Å; Y405-Y437 HydrophobicContact CE2-CE1 3.29Å; Y405-Y437 AromaticContact CE2-CZ 3.93Å; S430-Y437 VanDerWaalsContact CA-OH 3.23Å; S430-Y437 WeakPolarHBondContact CA-OH 3.5Å; S430-Y437 WeakPolarHBondContact CB-OH 3.38Å; S430-Y437 PolarHBondContact N-OH 3.44Å; A435-Y437 HydrophobicContact CB-CE2 4.05Å; Y437-C456 CarbonylContact O-C 3.42Å; Y437-C456 WeakPolarHBondContact O-CA 3.43Å; Y437-C456 WeakPolarHBondContact O-CB 3.44Å; Y437-F457 HydrophobicContact CD2-CE1 4.35Å; Y437-F457 AromaticContact CD2-CE2 3.96Å; Y437-F457 HydrophobicContact CD2-CE2 3.96Å; Y437-F457 AromaticContact CD2-CZ 3.73Å; Y437-F457 HydrophobicContact CD2-CZ 3.73Å; Y437-F457 HydrophobicContact CG-CE1 4.26Å; Y437-F457 HydrophobicContact CG-CZ 4.05Å; Y437-F457 PolarHBondContact N-O 3.17Å; Y437-F457 PolarHBondContact O-N 3.47Å; Y437-F457 VanDerWaalsContact O-N 3.08Å; Y437-L488 HydrophobicContact CD1-CD2 4.37Å; Y437-L488 HydrophobicContact CG-CD2 4.32Å; Y437-E489 CarbonylContact C-O 3.58Å; Y437-E489 WeakPolarHBondContact CA-O 3.37Å; Y437-E492 PolarHBondContact OH-O 2.73Å
438	Q	96.2	Very high	94.4	Very high	95 Å²	95	51.2 Å²	51.2	44%	0.444	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.5	160.4	-59.1	-65.4	-13.9	0	0	108	T455 E489	Q438-T455 PolarHBondContact OE1-O 3.21Å; Q438-E489 HydrophobicContact CB-CB 4.28Å; Q438-E489 PolarHBondContact N-O 2.93Å; Q438-E489 PolarHBondContact O-N 3.46Å
439	V	96.1	Very high	94.5	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.9	-174	-163.9	0	0	0	0	109.6	L427 L441 D454 T455 F457 I486 V487 L488	L427-V439 HydrophobicContact CD1-CG1 3.74Å; L427-V439 HydrophobicContact CD1-CG2 4.39Å; V439-L441 HydrophobicContact CB-CD1 3.96Å; V439-L441 HydrophobicContact CG1-CD1 3.49Å; V439-L441 VanDerWaalsContact CG1-CD1 3.49Å; V439-L441 HydrophobicContact CG1-CG 4.17Å; V439-D454 WeakPolarHBondContact O-CA 3.44Å; V439-T455 HydrophobicContact CB-CG2 4.49Å; V439-T455 PolarHBondContact N-O 3.49Å; V439-T455 PolarHBondContact O-N 2.91Å; V439-F457 HydrophobicContact CG2-CD1 3.49Å; V439-F457 VanDerWaalsContact CG2-CD1 3.49Å; V439-F457 HydrophobicContact CG2-CE1 3.62Å; V439-I486 HydrophobicContact CG1-CG2 3.66Å; V439-V487 WeakPolarHBondContact CA-O 3.48Å; V439-L488 HydrophobicContact CB-CD2 4.39Å; V439-L488 HydrophobicContact CG1-CD2 4.15Å; V439-L488 HydrophobicContact CG2-CD2 3.59Å
440	R	97.4	Very high	94.6	Very high	115 Å²	115	57.5 Å²	57.5	43%	0.434	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118.6	159.3	-180	168.9	-66.8	155.8	2.4	109	E442 L453 D454 I486 V487	R440-E442 HydrophobicContact CG-CG 4.29Å; R440-L453 WeakPolarHBondContact CA-O 3.43Å; R440-D454 WeakPolarHBondContact CA-OD1 3.36Å; R440-D454 WeakPolarHBondContact CB-OD1 3.46Å; R440-D454 WeakPolarHBondContact CG-OD1 3.49Å; R440-D454 IonicContact CZ-OD1 3.53Å; R440-D454 IonicContact CZ-OD2 3.62Å; R440-D454 IonicContact NE-OD1 2.73Å; R440-D454 PolarHBondContact NE-OD1 3.16Å; R440-D454 IonicContact NE-OD2 3.47Å; R440-D454 PolarHBondContact NE-OD2 2.87Å; R440-D454 IonicContact NH2-OD1 3.46Å; R440-D454 PolarHBondContact NH2-OD1 3.35Å; R440-D454 IonicContact NH2-OD2 2.89Å; R440-D454 PolarHBondContact NH2-OD2 3.1Å; R440-I486 WeakPolarHBondContact O-CA 3.09Å; R440-V487 HydrophobicContact CB-CB 4.19Å; R440-V487 PolarHBondContact N-O 3.3Å; R440-V487 PolarHBondContact O-N 2.73Å
441	L	97.6	Very high	94.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	137.5	172.4	-69.3	83.8	0	0	0	109.1	F425 V439 S452 L453 T455 V468 F470 I486	F425-L441 HydrophobicContact CD2-CD2 3.95Å; V439-L441 HydrophobicContact CB-CD1 3.96Å; V439-L441 HydrophobicContact CG1-CD1 3.49Å; V439-L441 VanDerWaalsContact CG1-CD1 3.49Å; V439-L441 HydrophobicContact CG1-CG 4.17Å; L441-S452 CarbonylContact O-C 3.59Å; L441-S452 WeakPolarHBondContact O-CA 3.35Å; L441-S452 PolarHBondContact O-OG 3.38Å; L441-L453 PolarHBondContact N-O 2.66Å; L441-L453 PolarHBondContact O-N 2.68Å; L441-T455 HydrophobicContact CD1-CG2 3.79Å; L441-V468 HydrophobicContact CD1-CB 4.27Å; L441-V468 HydrophobicContact CD1-CG1 3.44Å; L441-V468 VanDerWaalsContact CD1-CG1 3.44Å; L441-V468 HydrophobicContact CD2-CB 3.99Å; L441-V468 HydrophobicContact CD2-CG1 3.84Å; L441-V468 HydrophobicContact CG-CG1 4.29Å; L441-F470 HydrophobicContact CB-CD1 4.48Å; L441-F470 HydrophobicContact CB-CE1 3.74Å; L441-F470 HydrophobicContact CB-CZ 4.11Å; L441-I486 HydrophobicContact CB-CD1 4.22Å; L441-I486 HydrophobicContact CD2-CD1 4.35Å; L441-I486 HydrophobicContact CG-CD1 3.82Å
442	E	98.1	Very high	95.3	Very high	46 Å²	46	60.4 Å²	60.4	22%	0.215	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.2	169.9	-66.4	-176.5	164.8	0	0	109.9	R440 K444 A451 G485	R440-E442 HydrophobicContact CG-CG 4.29Å; E442-K444 WeakPolarHBondContact OE2-CE 3.1Å; E442-K444 IonicContact OE2-NZ 2.86Å; E442-K444 PolarHBondContact OE2-NZ 2.92Å; E442-A451 WeakPolarHBondContact CA-O 3.42Å; E442-G485 PolarHBondContact N-O 3.35Å; E442-G485 PolarHBondContact O-N 2.55Å
443	L	98.5	Very high	95.8	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126	166.6	176.7	66.7	0	0	0	108.2	F414 V422 F425 L450 A451 F470 V474 I476 Y482 T483	F414-L443 HydrophobicContact CE1-CD1 3.71Å; F414-L443 HydrophobicContact CZ-CD1 3.85Å; V422-L443 HydrophobicContact CB-CD2 4.47Å; F425-L443 HydrophobicContact CZ-CD1 4.28Å; L443-L450 PolarHBondContact O-N 3.1Å; L443-A451 PolarHBondContact N-O 3.36Å; L443-A451 PolarHBondContact O-N 2.64Å; L443-F470 HydrophobicContact CB-CE2 4.1Å; L443-F470 HydrophobicContact CB-CZ 3.73Å; L443-V474 HydrophobicContact CD2-CB 3.54Å; L443-V474 HydrophobicContact CD2-CG1 3.56Å; L443-V474 HydrophobicContact CD2-CG2 3.95Å; L443-I476 HydrophobicContact CD1-CD1 4.43Å; L443-I476 HydrophobicContact CD2-CD1 3.75Å; L443-Y482 HydrophobicContact CD1-CD1 4.35Å; L443-T483 WeakPolarHBondContact CA-O 3.45Å
444	K	98.3	Very high	96.3	Very high	24 Å²	24	59.9 Å²	59.9	10%	0.104	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.4	-174.6	-48.9	-179	-174.1	172.8	0	112.4	E442 Q448 V449 Y482 T483 E518	E442-K444 WeakPolarHBondContact OE2-CE 3.1Å; E442-K444 IonicContact OE2-NZ 2.86Å; E442-K444 PolarHBondContact OE2-NZ 2.92Å; K444-Q448 CarbonylContact C-O 3.57Å; K444-Q448 WeakPolarHBondContact CA-O 3.42Å; K444-Q448 WeakPolarHBondContact CB-O 3.34Å; K444-V449 HydrophobicContact CD-CG2 4.24Å; K444-V449 HydrophobicContact CG-CG2 4.13Å; K444-Y482 CarbonylContact O-C 3.46Å; K444-Y482 VanDerWaalsContact O-CA 3.26Å; K444-Y482 WeakPolarHBondContact O-CA 3.44Å; K444-T483 PolarHBondContact N-O 3.06Å; K444-T483 PolarHBondContact O-N 2.86Å; K444-E518 IonicContact NZ-OE2 2.76Å; K444-E518 PolarHBondContact NZ-OE2 2.98Å
445	R	97.2	Very high	96.4	Very high	107 Å²	107	57.4 Å²	57.4	40%	0.404	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	122	167.1	178	-178.2	173.6	-175.3	2.6	108.8	G447 Q448 L450 V480 Y482	R445-G447 PolarHBondContact O-N 2.93Å; R445-G447 VanDerWaalsContact O-N 3.1Å; R445-Q448 PolarHBondContact N-O 3.16Å; R445-Q448 WeakPolarHBondContact O-CB 3.39Å; R445-Q448 PolarHBondContact O-N 2.84Å; R445-L450 HydrophobicContact CB-CD1 3.77Å; R445-L450 HydrophobicContact CB-CD2 4.46Å; R445-L450 HydrophobicContact CB-CG 4.2Å; R445-V480 HydrophobicContact CG-CG1 4.25Å; R445-Y482 HydrophobicContact CB-CD1 4.01Å; R445-Y482 HydrophobicContact CB-CE1 3.98Å; R445-Y482 HydrophobicContact CG-CE1 4.36Å
446	S	94.5	Very high	96.6	Very high	118 Å²	118	58.7 Å²	58.7	83%	0.825	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	37.5	-179.7	-54.8	0	0	0	0	113.6	Q448	S446-Q448 VanDerWaalsContact C-N 3.3Å; S446-Q448 PolarHBondContact O-N 2.97Å
447	G	92	Very high	96.6	Very high	51 Å²	51	54.9 Å²	54.9	53%	0.526	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-13.6	-178.3	0	0	0	0	0	115.5	R445	R445-G447 PolarHBondContact O-N 2.93Å; R445-G447 VanDerWaalsContact O-N 3.1Å
448	Q	96.9	Very high	96.7	Very high	138 Å²	138	61.6 Å²	61.6	65%	0.645	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.5	173.9	-174.7	179.5	17.3	0	0	110.4	K444 R445 S446 L450	K444-Q448 CarbonylContact C-O 3.57Å; K444-Q448 WeakPolarHBondContact CA-O 3.42Å; K444-Q448 WeakPolarHBondContact CB-O 3.34Å; R445-Q448 PolarHBondContact N-O 3.16Å; R445-Q448 WeakPolarHBondContact O-CB 3.39Å; R445-Q448 PolarHBondContact O-N 2.84Å; S446-Q448 VanDerWaalsContact C-N 3.3Å; S446-Q448 PolarHBondContact O-N 2.97Å; Q448-L450 PolarHBondContact O-N 3.17Å
449	V	97.5	Very high	96.5	Very high	66 Å²	66	57.3 Å²	57.3	40%	0.4	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	120.6	173.4	-178.3	0	0	0	0	109.4	K444 A451	K444-V449 HydrophobicContact CD-CG2 4.24Å; K444-V449 HydrophobicContact CG-CG2 4.13Å; V449-A451 WeakPolarHBondContact CG1-O 3.47Å
450	L	96.6	Very high	96.4	Very high	70 Å²	70	60.5 Å²	60.5	37%	0.366	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-36.3	176.5	-59.6	-176.5	0	0	0	111.8	L443 R445 Q448 V474 Y482	L443-L450 PolarHBondContact O-N 3.1Å; R445-L450 HydrophobicContact CB-CD1 3.77Å; R445-L450 HydrophobicContact CB-CD2 4.46Å; R445-L450 HydrophobicContact CB-CG 4.2Å; Q448-L450 PolarHBondContact O-N 3.17Å; L450-V474 HydrophobicContact CB-CG1 4.17Å; L450-V474 HydrophobicContact CD1-CG1 4.44Å; L450-Y482 HydrophobicContact CD1-CD1 3.88Å; L450-Y482 HydrophobicContact CD1-CE1 3.49Å; L450-Y482 VanDerWaalsContact CD1-CE1 3.49Å
451	A	97	Very high	96	Very high	19 Å²	19	55.6 Å²	55.6	16%	0.157	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.9	173.1	0	0	0	0	0	110	E442 L443 V449 F470 V474	E442-A451 WeakPolarHBondContact CA-O 3.42Å; L443-A451 PolarHBondContact N-O 3.36Å; L443-A451 PolarHBondContact O-N 2.64Å; V449-A451 WeakPolarHBondContact CG1-O 3.47Å; A451-F470 HydrophobicContact CB-CD1 3.73Å; A451-F470 HydrophobicContact CB-CE1 3.8Å; A451-F470 HydrophobicContact CB-CG 4.2Å; A451-F470 HydrophobicContact CB-CZ 4.32Å; A451-V474 HydrophobicContact CB-CG2 3.47Å; A451-V474 VanDerWaalsContact CB-CG2 3.47Å
452	S	97.3	Very high	95.7	Very high	62 Å²	62	57.1 Å²	57.1	43%	0.434	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142.4	173.6	-174.7	0	0	0	0	109.6	L441	L441-S452 CarbonylContact O-C 3.59Å; L441-S452 WeakPolarHBondContact O-CA 3.35Å; L441-S452 PolarHBondContact O-OG 3.38Å
453	L	97.3	Very high	95.3	Very high	32 Å²	32	57.6 Å²	57.6	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	127.7	175.6	-178.8	66.5	0	0	0	110.5	R440 L441 T455 F469 F470 E471	R440-L453 WeakPolarHBondContact CA-O 3.43Å; L441-L453 PolarHBondContact N-O 2.66Å; L441-L453 PolarHBondContact O-N 2.68Å; L453-T455 HydrophobicContact CD2-CG2 4.14Å; L453-T455 HydrophobicContact CG-CG2 4.35Å; L453-F469 WeakPolarHBondContact CD2-O 3.49Å; L453-F470 HydrophobicContact CB-CD1 4.32Å; L453-E471 HydrophobicContact CD1-CG 4.09Å
454	D	97.5	Very high	95	Very high	99 Å²	99	63.7 Å²	63.7	53%	0.529	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.2	167.1	-75	-24.2	0	0	0	109	V439 R440	V439-D454 WeakPolarHBondContact O-CA 3.44Å; R440-D454 WeakPolarHBondContact CA-OD1 3.36Å; R440-D454 WeakPolarHBondContact CB-OD1 3.46Å; R440-D454 WeakPolarHBondContact CG-OD1 3.49Å; R440-D454 IonicContact CZ-OD1 3.53Å; R440-D454 IonicContact CZ-OD2 3.62Å; R440-D454 IonicContact NE-OD1 2.73Å; R440-D454 PolarHBondContact NE-OD1 3.16Å; R440-D454 IonicContact NE-OD2 3.47Å; R440-D454 PolarHBondContact NE-OD2 2.87Å; R440-D454 IonicContact NH2-OD1 3.46Å; R440-D454 PolarHBondContact NH2-OD1 3.35Å; R440-D454 IonicContact NH2-OD2 2.89Å; R440-D454 PolarHBondContact NH2-OD2 3.1Å
455	T	96.8	Very high	94.9	Very high	49 Å²	49	64.3 Å²	64.3	30%	0.301	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	-172.2	-176.8	-169	0	0	0	0	111.2	Q438 V439 L441 L453 V468	Q438-T455 PolarHBondContact OE1-O 3.21Å; V439-T455 HydrophobicContact CB-CG2 4.49Å; V439-T455 PolarHBondContact N-O 3.49Å; V439-T455 PolarHBondContact O-N 2.91Å; L441-T455 HydrophobicContact CD1-CG2 3.79Å; L453-T455 HydrophobicContact CD2-CG2 4.14Å; L453-T455 HydrophobicContact CG-CG2 4.35Å; T455-V468 HydrophobicContact CG2-CG1 3.37Å
456	C	96.3	Very high	94.8	Very high	42 Å²	42	60.4 Å²	60.4	28%	0.284	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.9	173.9	65.3	0	0	0	0	111.7	K436 Y437	K436-C456 VanDerWaalsContact CE-CB 3.44Å; K436-C456 WeakPolarHBondContact CE-SG 3.44Å; K436-C456 HydrophobicContact CG-CB 4.4Å; Y437-C456 CarbonylContact O-C 3.42Å; Y437-C456 WeakPolarHBondContact O-CA 3.43Å; Y437-C456 WeakPolarHBondContact O-CB 3.44Å
457	F	95.6	Very high	95	Very high	17 Å²	17	57.2 Å²	57.2	8%	0.075	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.2	166.7	75.1	-87.4	0	0	0	110.8	L427 K436 Y437 V439 F466 V468 L488	L427-F457 HydrophobicContact CB-CE1 4.35Å; L427-F457 HydrophobicContact CB-CZ 4.41Å; L427-F457 HydrophobicContact CD1-CE1 4.12Å; K436-F457 WeakPolarHBondContact CA-O 3.49Å; Y437-F457 HydrophobicContact CD2-CE1 4.35Å; Y437-F457 AromaticContact CD2-CE2 3.96Å; Y437-F457 HydrophobicContact CD2-CE2 3.96Å; Y437-F457 AromaticContact CD2-CZ 3.73Å; Y437-F457 HydrophobicContact CD2-CZ 3.73Å; Y437-F457 HydrophobicContact CG-CE1 4.26Å; Y437-F457 HydrophobicContact CG-CZ 4.05Å; Y437-F457 PolarHBondContact N-O 3.17Å; Y437-F457 PolarHBondContact O-N 3.47Å; Y437-F457 VanDerWaalsContact O-N 3.08Å; V439-F457 HydrophobicContact CG2-CD1 3.49Å; V439-F457 VanDerWaalsContact CG2-CD1 3.49Å; V439-F457 HydrophobicContact CG2-CE1 3.62Å; F457-F466 HydrophobicContact CD2-CB 3.48Å; F457-F466 VanDerWaalsContact CD2-CB 3.48Å; F457-F466 HydrophobicContact CD2-CD1 4.07Å; F457-F466 HydrophobicContact CD2-CD2 4.24Å; F457-F466 AromaticContact CD2-CG 3.65Å; F457-F466 HydrophobicContact CD2-CG 3.65Å; F457-F466 HydrophobicContact CE2-CB 3.64Å; F457-F466 HydrophobicContact CE2-CD1 4.39Å; F457-F466 AromaticContact CE2-CD2 3.76Å; F457-F466 HydrophobicContact CE2-CD2 3.76Å; F457-F466 AromaticContact CE2-CG 3.65Å; F457-F466 HydrophobicContact CE2-CG 3.65Å; F457-F466 HydrophobicContact CG-CB 4.17Å; F457-F466 HydrophobicContact CZ-CB 4.43Å; F457-V468 HydrophobicContact CB-CG2 4.25Å; F457-V468 HydrophobicContact CD1-CG2 3.83Å; F457-V468 HydrophobicContact CG-CG2 4.24Å; F457-L488 HydrophobicContact CE1-CD2 3.73Å; F457-L488 HydrophobicContact CZ-CD2 4.32Å
458	F	95.3	Very high	95.3	Very high	141 Å²	141	55.2 Å²	55.2	62%	0.618	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.5	176.4	-67.9	-89.8	0	0	0	109.2	K436 F466	K436-F458 HydrophobicContact CB-CD1 3.84Å; K436-F458 HydrophobicContact CB-CE1 3.71Å; K436-F458 HydrophobicContact CB-CZ 4.47Å; K436-F458 HydrophobicContact CD-CD1 4.5Å; K436-F458 HydrophobicContact CD-CE1 3.67Å; K436-F458 HydrophobicContact CD-CE2 4.41Å; K436-F458 HydrophobicContact CD-CZ 3.63Å; K436-F458 HydrophobicContact CG-CD1 4.03Å; K436-F458 HydrophobicContact CG-CE1 3.7Å; K436-F458 HydrophobicContact CG-CE2 4.49Å; K436-F458 HydrophobicContact CG-CZ 3.96Å; F458-F466 WeakPolarHBondContact O-CD1 3.14Å; F458-F466 WeakPolarHBondContact O-CE1 3.37Å
459	S	93.9	Very high	95.3	Very high	4 Å²	4	52.6 Å²	52.6	3%	0.028	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143.5	167.3	-178.7	0	0	0	0	109.9	S430 S434 A435 G461 F466	S430-S459 VanDerWaalsContact N-CB 3.34Å; S430-S459 PolarHBondContact N-OG 2.94Å; S434-S459 CarbonylContact C-O 3.56Å; S434-S459 WeakPolarHBondContact CA-O 3.36Å; S434-S459 WeakPolarHBondContact CB-O 3.39Å; A435-S459 PolarHBondContact N-O 3.21Å; A435-S459 PolarHBondContact O-N 3.02Å; S459-G461 PolarHBondContact OG-N 2.71Å; S459-F466 WeakPolarHBondContact OG-CE2 3.45Å; S459-F466 WeakPolarHBondContact OG-CZ 3.35Å
460	D	92.7	Very high	95.2	Very high	70 Å²	70	50.2 Å²	50.2	37%	0.374	27%	0.274	S	S	.	.			trans	-92.8	4.1	172.9	66.3	-3	0	0	0	113	S462 K464 F466	D460-S462 VanDerWaalsContact C-N 3.3Å; D460-S462 WeakPolarHBondContact OD1-CB 3.36Å; D460-S462 PolarHBondContact OD1-N 3.36Å; D460-S462 PolarHBondContact OD1-OG 3.22Å; D460-S462 PolarHBondContact OD2-OG 3.11Å; D460-K464 IonicContact OD2-NZ 2.65Å; D460-K464 PolarHBondContact OD2-NZ 3.43Å; D460-F466 WeakPolarHBondContact OD1-CZ 3.49Å
461	G	89.7	Confident	95	Very high	13 Å²	13	54.4 Å²	54.4	13%	0.134	29%	0.292	C	S	.	.	S	Bend	trans	84.4	-1.1	-176.3	0	0	0	0	0	114.6	S430 G433 S459 Y495	S430-G461 CarbonylContact O-C 3.57Å; S430-G461 VanDerWaalsContact O-CA 3.28Å; S430-G461 WeakPolarHBondContact O-CA 3.21Å; G433-G461 WeakPolarHBondContact O-CA 3.34Å; G433-G461 PolarHBondContact O-N 2.9Å; S459-G461 PolarHBondContact OG-N 2.71Å; G461-Y495 WeakPolarHBondContact O-CE2 3.47Å; G461-Y495 PolarHBondContact O-OH 2.8Å
462	S	90.7	Very high	94.8	Very high	31 Å²	31	55.2 Å²	55.2	22%	0.217	29%	0.292	C	S	.	.	S	Bend	trans	-84.6	163.9	174.9	75.1	0	0	0	0	112	D460 K464 Y495	D460-S462 VanDerWaalsContact C-N 3.3Å; D460-S462 WeakPolarHBondContact OD1-CB 3.36Å; D460-S462 PolarHBondContact OD1-N 3.36Å; D460-S462 PolarHBondContact OD1-OG 3.22Å; D460-S462 PolarHBondContact OD2-OG 3.11Å; S462-K464 PolarHBondContact O-N 2.59Å; S462-K464 VanDerWaalsContact O-N 3.16Å; S462-K464 WeakPolarHBondContact OG-CB 3.42Å; S462-K464 WeakPolarHBondContact OG-CD 3.27Å; S462-K464 WeakPolarHBondContact OG-CG 3.01Å; S462-K464 PolarHBondContact OG-N 3.36Å; S462-Y495 WeakPolarHBondContact O-CD2 3.47Å; S462-Y495 VanDerWaalsContact O-CE2 3.27Å; S462-Y495 WeakPolarHBondContact O-CE2 3.41Å
463	S	89.3	Confident	94.8	Very high	57 Å²	57	52.8 Å²	52.8	40%	0.399	28%	0.275	S	S	.	.	S	Bend	trans	-75.2	10.2	173.4	58.4	0	0	0	0	113.8
464	K	92.6	Very high	94.8	Very high	128 Å²	128	52.1 Å²	52.1	56%	0.557	27%	0.272	S	S	*	.			trans	-62.8	158.8	176.2	-69.8	174.5	-168.1	160.6	0	111.1	D460 S462 F466	D460-K464 IonicContact OD2-NZ 2.65Å; D460-K464 PolarHBondContact OD2-NZ 3.43Å; S462-K464 PolarHBondContact O-N 2.59Å; S462-K464 VanDerWaalsContact O-N 3.16Å; S462-K464 WeakPolarHBondContact OG-CB 3.42Å; S462-K464 WeakPolarHBondContact OG-CD 3.27Å; S462-K464 WeakPolarHBondContact OG-CG 3.01Å; S462-K464 PolarHBondContact OG-N 3.36Å; K464-F466 HydrophobicContact CB-CZ 4.36Å; K464-F466 WeakPolarHBondContact O-CD2 3.48Å; K464-F466 WeakPolarHBondContact O-CE2 3.18Å
465	I	95.3	Very high	94.7	Very high	36 Å²	36	49 Å²	49	19%	0.185	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.3	178.7	-60.3	159.7	0	0	0	108	H391 G426 F428 P467 P531 E532	H391-I465 WeakPolarHBondContact CE1-CD1 3.46Å; H391-I465 WeakPolarHBondContact ND1-CD1 3.47Å; G426-I465 VanDerWaalsContact CA-CG2 3.41Å; F428-I465 HydrophobicContact CE1-CG1 4.26Å; I465-P467 WeakPolarHBondContact O-CD 3.48Å; I465-P531 HydrophobicContact CB-CG 4.41Å; I465-P531 HydrophobicContact CD1-CB 4.03Å; I465-P531 HydrophobicContact CD1-CG 4.17Å; I465-P531 HydrophobicContact CG1-CB 4.23Å; I465-P531 HydrophobicContact CG1-CG 3.86Å; I465-P531 HydrophobicContact CG2-CG 3.72Å; I465-E532 HydrophobicContact CD1-CG 3.94Å; I465-E532 WeakPolarHBondContact CD1-OE1 3.31Å; I465-E532 HydrophobicContact CG2-CB 4.42Å; I465-E532 HydrophobicContact CG2-CG 4.07Å
466	F	97	Very high	94.7	Very high	26 Å²	26	46.7 Å²	46.7	11%	0.114	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.3	-176.8	-61.2	-87	0	0	0	108.7	L427 F457 F458 S459 D460 K464	L427-F466 PolarHBondContact N-O 3.24Å; L427-F466 PolarHBondContact O-N 3.22Å; F457-F466 HydrophobicContact CD2-CB 3.48Å; F457-F466 VanDerWaalsContact CD2-CB 3.48Å; F457-F466 HydrophobicContact CD2-CD1 4.07Å; F457-F466 HydrophobicContact CD2-CD2 4.24Å; F457-F466 AromaticContact CD2-CG 3.65Å; F457-F466 HydrophobicContact CD2-CG 3.65Å; F457-F466 HydrophobicContact CE2-CB 3.64Å; F457-F466 HydrophobicContact CE2-CD1 4.39Å; F457-F466 AromaticContact CE2-CD2 3.76Å; F457-F466 HydrophobicContact CE2-CD2 3.76Å; F457-F466 AromaticContact CE2-CG 3.65Å; F457-F466 HydrophobicContact CE2-CG 3.65Å; F457-F466 HydrophobicContact CG-CB 4.17Å; F457-F466 HydrophobicContact CZ-CB 4.43Å; F458-F466 WeakPolarHBondContact O-CD1 3.14Å; F458-F466 WeakPolarHBondContact O-CE1 3.37Å; S459-F466 WeakPolarHBondContact OG-CE2 3.45Å; S459-F466 WeakPolarHBondContact OG-CZ 3.35Å; D460-F466 WeakPolarHBondContact OD1-CZ 3.49Å; K464-F466 HydrophobicContact CB-CZ 4.36Å; K464-F466 WeakPolarHBondContact O-CD2 3.48Å; K464-F466 WeakPolarHBondContact O-CE2 3.18Å
467	P	97.5	Very high	94.6	Very high	51 Å²	51	48 Å²	48	33%	0.331	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	133.6	179.2	30.4	-33.9	0	0	0	110.3	I465 F469 L534	I465-P467 WeakPolarHBondContact O-CD 3.48Å; P467-F469 HydrophobicContact CB-CE2 3.81Å; P467-F469 HydrophobicContact CB-CZ 3.8Å; P467-F469 HydrophobicContact CG-CE2 4.18Å; P467-F469 HydrophobicContact CG-CZ 4.4Å; P467-L534 HydrophobicContact CB-CD1 3.44Å; P467-L534 VanDerWaalsContact CB-CD1 3.44Å
468	V	97.8	Very high	94.7	Very high	8 Å²	8	48.9 Å²	48.9	5%	0.048	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121	172.9	-168.8	0	0	0	0	108.3	G424 F425 L427 L441 T455 F457	G424-V468 CarbonylContact C-O 3.51Å; G424-V468 VanDerWaalsContact CA-O 3.29Å; G424-V468 WeakPolarHBondContact CA-O 3.47Å; F425-V468 PolarHBondContact N-O 3.12Å; F425-V468 PolarHBondContact O-N 3.46Å; L427-V468 HydrophobicContact CD1-CB 4.42Å; L427-V468 HydrophobicContact CD1-CG2 3.87Å; L427-V468 HydrophobicContact CG-CG2 4.4Å; L441-V468 HydrophobicContact CD1-CB 4.27Å; L441-V468 HydrophobicContact CD1-CG1 3.44Å; L441-V468 VanDerWaalsContact CD1-CG1 3.44Å; L441-V468 HydrophobicContact CD2-CB 3.99Å; L441-V468 HydrophobicContact CD2-CG1 3.84Å; L441-V468 HydrophobicContact CG-CG1 4.29Å; T455-V468 HydrophobicContact CG2-CG1 3.37Å; F457-V468 HydrophobicContact CB-CG2 4.25Å; F457-V468 HydrophobicContact CD1-CG2 3.83Å; F457-V468 HydrophobicContact CG-CG2 4.24Å
469	F	96.9	Very high	94.8	Very high	83 Å²	83	48.1 Å²	48.1	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	148.6	-170.4	-60.2	-81.7	0	0	0	111.6	L387 A423 L453 P467 L534	L387-F469 HydrophobicContact CD1-CE1 4.1Å; L387-F469 HydrophobicContact CD2-CE1 3.75Å; L387-F469 HydrophobicContact CD2-CZ 3.82Å; A423-F469 HydrophobicContact CB-CD1 3.95Å; A423-F469 HydrophobicContact CB-CE1 4.31Å; A423-F469 CarbonylContact O-C 3.55Å; A423-F469 VanDerWaalsContact O-CA 3.27Å; A423-F469 WeakPolarHBondContact O-CA 3.3Å; L453-F469 WeakPolarHBondContact CD2-O 3.49Å; P467-F469 HydrophobicContact CB-CE2 3.81Å; P467-F469 HydrophobicContact CB-CZ 3.8Å; P467-F469 HydrophobicContact CG-CE2 4.18Å; P467-F469 HydrophobicContact CG-CZ 4.4Å; F469-L534 HydrophobicContact CD1-CD1 4.23Å; F469-L534 HydrophobicContact CE1-CB 4.49Å; F469-L534 HydrophobicContact CE1-CD1 3.75Å; F469-L534 HydrophobicContact CZ-CD1 4.09Å
470	F	96.7	Very high	94.9	Very high	16 Å²	16	49.6 Å²	49.6	7%	0.07	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	163.8	160.7	-66.3	-70.2	0	0	0	110.2	V422 A423 F425 L441 L443 A451 L453 Q472 V474	V422-F470 HydrophobicContact CG1-CE2 4.33Å; A423-F470 PolarHBondContact O-N 2.96Å; F425-F470 HydrophobicContact CD2-CE2 4.41Å; F425-F470 HydrophobicContact CD2-CZ 4.45Å; F425-F470 AromaticContact CE2-CE2 3.8Å; F425-F470 HydrophobicContact CE2-CE2 3.8Å; F425-F470 AromaticContact CE2-CZ 3.72Å; F425-F470 HydrophobicContact CE2-CZ 3.72Å; F425-F470 HydrophobicContact CZ-CE2 4.26Å; F425-F470 HydrophobicContact CZ-CZ 4.44Å; L441-F470 HydrophobicContact CB-CD1 4.48Å; L441-F470 HydrophobicContact CB-CE1 3.74Å; L441-F470 HydrophobicContact CB-CZ 4.11Å; L443-F470 HydrophobicContact CB-CE2 4.1Å; L443-F470 HydrophobicContact CB-CZ 3.73Å; A451-F470 HydrophobicContact CB-CD1 3.73Å; A451-F470 HydrophobicContact CB-CE1 3.8Å; A451-F470 HydrophobicContact CB-CG 4.2Å; A451-F470 HydrophobicContact CB-CZ 4.32Å; L453-F470 HydrophobicContact CB-CD1 4.32Å; F470-Q472 WeakPolarHBondContact CB-O 3.24Å; F470-Q472 PolarHBondContact O-N 3.02Å; F470-V474 HydrophobicContact CD2-CG2 4.29Å
471	E	92.6	Very high	95.2	Very high	158 Å²	158	49.9 Å²	49.9	74%	0.738	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	-34.5	173.8	-65.3	-173.9	166.1	0	0	112.2	L453	L453-E471 HydrophobicContact CD1-CG 4.09Å
472	Q	92.6	Very high	95.6	Very high	37 Å²	37	49.4 Å²	49.4	17%	0.173	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.4	178.1	-66.2	-66.4	-56.8	0	0	109.5	L269 F470	L269-Q472 HydrophobicContact CD1-CB 4.12Å; L269-Q472 HydrophobicContact CD1-CG 4.09Å; L269-Q472 HydrophobicContact CD2-CG 4.24Å; L269-Q472 HydrophobicContact CG-CB 4.47Å; L269-Q472 HydrophobicContact CG-CG 3.91Å; F470-Q472 WeakPolarHBondContact CB-O 3.24Å; F470-Q472 PolarHBondContact O-N 3.02Å
473	P	96.7	Very high	96	Very high	10 Å²	10	48.1 Å²	48.1	7%	0.065	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	138.1	172.8	-25.4	36.4	0	0	0	112	A265 Q266 F421 V422 Y536	A265-P473 WeakPolarHBondContact O-CD 3.21Å; A265-P473 VanDerWaalsContact O-CG 3.23Å; A265-P473 WeakPolarHBondContact O-CG 2.87Å; Q266-P473 WeakPolarHBondContact CG-O 3.43Å; Q266-P473 PolarHBondContact NE2-O 3.45Å; F421-P473 HydrophobicContact CB-CB 3.86Å; V422-P473 CarbonylContact O-C 3.52Å; V422-P473 VanDerWaalsContact O-CA 3.29Å; V422-P473 WeakPolarHBondContact O-CA 3.06Å; P473-Y536 HydrophobicContact CB-CD2 4.2Å; P473-Y536 HydrophobicContact CB-CE2 4.27Å; P473-Y536 HydrophobicContact CG-CD2 3.98Å; P473-Y536 HydrophobicContact CG-CE2 3.6Å
474	V	96.7	Very high	96.4	Very high	18 Å²	18	45.4 Å²	45.4	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.9	-176.9	-171.4	0	0	0	0	109.7	F421 V422 L443 L450 A451 F470 I476	F421-V474 CarbonylContact C-O 3.51Å; F421-V474 WeakPolarHBondContact CA-O 3.4Å; V422-V474 PolarHBondContact N-O 3.08Å; V422-V474 PolarHBondContact O-N 2.94Å; L443-V474 HydrophobicContact CD2-CB 3.54Å; L443-V474 HydrophobicContact CD2-CG1 3.56Å; L443-V474 HydrophobicContact CD2-CG2 3.95Å; L450-V474 HydrophobicContact CB-CG1 4.17Å; L450-V474 HydrophobicContact CD1-CG1 4.44Å; A451-V474 HydrophobicContact CB-CG2 3.47Å; A451-V474 VanDerWaalsContact CB-CG2 3.47Å; F470-V474 HydrophobicContact CD2-CG2 4.29Å; V474-I476 PolarHBondContact O-N 2.85Å
475	Q	95.8	Very high	96.7	Very high	34 Å²	34	39.4 Å²	39.4	16%	0.159	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.1	176.7	-174.8	168.1	-48.8	0	0	111.3	R419 F421 E477	R419-Q475 HydrophobicContact CG-CG 4.18Å; F421-Q475 HydrophobicContact CD1-CB 3.99Å; F421-Q475 HydrophobicContact CE1-CB 3.73Å; F421-Q475 HydrophobicContact CE1-CG 4.04Å; F421-Q475 HydrophobicContact CZ-CG 4.36Å; Q475-E477 PolarHBondContact NE2-OE1 3.39Å
476	I	96.9	Very high	96.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123	174.8	-56	-53.8	0	0	0	107.5	F414 R419 I420 V422 L443 V474 Y482	F414-I476 HydrophobicContact CE2-CD1 4.39Å; F414-I476 HydrophobicContact CE2-CG1 4.29Å; F414-I476 HydrophobicContact CE2-CG2 4.14Å; F414-I476 HydrophobicContact CZ-CD1 4.05Å; F414-I476 HydrophobicContact CZ-CG1 4.37Å; R419-I476 VanDerWaalsContact CA-O 3.25Å; R419-I476 WeakPolarHBondContact CA-O 3.46Å; R419-I476 WeakPolarHBondContact CG-O 3.47Å; I420-I476 HydrophobicContact CD1-CG1 4.45Å; I420-I476 HydrophobicContact CG1-CB 3.71Å; I420-I476 HydrophobicContact CG1-CG1 3.97Å; I420-I476 HydrophobicContact CG1-CG2 4.17Å; I420-I476 PolarHBondContact N-O 3.38Å; I420-I476 PolarHBondContact O-N 3.36Å; V422-I476 HydrophobicContact CB-CD1 4.43Å; V422-I476 HydrophobicContact CB-CG1 4.19Å; V422-I476 HydrophobicContact CG2-CD1 4Å; V422-I476 HydrophobicContact CG2-CG1 3.47Å; V422-I476 VanDerWaalsContact CG2-CG1 3.47Å; L443-I476 HydrophobicContact CD1-CD1 4.43Å; L443-I476 HydrophobicContact CD2-CD1 3.75Å; V474-I476 PolarHBondContact O-N 2.85Å; I476-Y482 HydrophobicContact CB-CE2 4.25Å; I476-Y482 HydrophobicContact CD1-CD1 3.66Å; I476-Y482 HydrophobicContact CD1-CD2 4.17Å; I476-Y482 HydrophobicContact CD1-CE1 3.71Å; I476-Y482 HydrophobicContact CD1-CE2 4.26Å; I476-Y482 HydrophobicContact CD1-CG 3.9Å; I476-Y482 HydrophobicContact CG2-CD2 3.68Å; I476-Y482 HydrophobicContact CG2-CE2 3.49Å; I476-Y482 VanDerWaalsContact CG2-CE2 3.49Å; I476-Y482 HydrophobicContact CG2-CG 4.47Å
477	E	95.1	Very high	96.8	Very high	70 Å²	70	38.1 Å²	38.1	33%	0.327	20%	0.197	S	C	.	.			trans	-77.5	148.4	173	-62.6	-53.4	147.7	0	0	111.2	Q475 V480 Y482	Q475-E477 PolarHBondContact NE2-OE1 3.39Å; E477-V480 HydrophobicContact CB-CB 4.35Å; E477-V480 HydrophobicContact CB-CG2 4.04Å; E477-Y482 PolarHBondContact N-OH 3.26Å
478	A	96	Very high	96.6	Very high	36 Å²	36	35.7 Å²	35.7	30%	0.298	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	144.8	172.9	0	0	0	0	0	111.2	T416 V480	T416-A478 CarbonylContact O-C 3.5Å; T416-A478 WeakPolarHBondContact O-CA 3.49Å; A478-V480 PolarHBondContact O-N 3.18Å; A478-V480 VanDerWaalsContact O-N 3.12Å
479	D	97.3	Very high	96.3	Very high	124 Å²	124	40.6 Å²	40.6	66%	0.663	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	22.5	173.9	-55.1	-46.7	0	0	0	114.8	C415 T416	C415-D479 WeakPolarHBondContact SG-CA 3.44Å; T416-D479 PolarHBondContact O-N 3.18Å
480	V	97.6	Very high	96	Very high	35 Å²	35	37.9 Å²	37.9	21%	0.212	20%	0.198	C	C	.	.			trans	-115.7	133.8	175.9	177.3	0	0	0	0	109.8	R445 E477 A478 Y482	R445-V480 HydrophobicContact CG-CG1 4.25Å; E477-V480 HydrophobicContact CB-CB 4.35Å; E477-V480 HydrophobicContact CB-CG2 4.04Å; A478-V480 PolarHBondContact O-N 3.18Å; A478-V480 VanDerWaalsContact O-N 3.12Å; V480-Y482 HydrophobicContact CB-CD2 4.48Å; V480-Y482 HydrophobicContact CB-CE2 3.78Å; V480-Y482 HydrophobicContact CG1-CD2 4.23Å; V480-Y482 HydrophobicContact CG1-CE2 3.65Å; V480-Y482 WeakPolarHBondContact O-CD2 3.37Å; V480-Y482 WeakPolarHBondContact O-CE2 3.24Å
481	Y	98.2	Very high	95.5	Very high	76 Å²	76	44.8 Å²	44.8	30%	0.298	24%	0.236	S	C	.	.			trans	-80.7	130.1	175.3	-80.6	-88.5	0	0	0	112.1	Q413 F414 C415 Q514	Q413-Y481 HydrophobicContact CB-CD1 4.3Å; F414-Y481 WeakPolarHBondContact O-CA 3.29Å; C415-Y481 HydrophobicContact CB-CD1 3.78Å; C415-Y481 HydrophobicContact CB-CD2 4.07Å; C415-Y481 HydrophobicContact CB-CE1 3.62Å; C415-Y481 HydrophobicContact CB-CE2 3.9Å; C415-Y481 HydrophobicContact CB-CG 4.01Å; Y481-Q514 HydrophobicContact CE1-CB 4.35Å; Y481-Q514 HydrophobicContact CE1-CG 3.78Å; Y481-Q514 VanDerWaalsContact CZ-NE2 3.29Å; Y481-Q514 PolarHBondContact OH-NE2 3.05Å
482	Y	98.6	Very high	95.2	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.2	173	-67.5	-103.9	0	0	0	110.1	Q413 F414 L443 K444 R445 L450 I476 E477 V480	Q413-Y482 CarbonylContact C-O 3.46Å; Q413-Y482 WeakPolarHBondContact CA-O 3.16Å; F414-Y482 HydrophobicContact CZ-CG 4.44Å; F414-Y482 PolarHBondContact N-O 2.76Å; F414-Y482 PolarHBondContact O-N 2.92Å; L443-Y482 HydrophobicContact CD1-CD1 4.35Å; K444-Y482 CarbonylContact O-C 3.46Å; K444-Y482 VanDerWaalsContact O-CA 3.26Å; K444-Y482 WeakPolarHBondContact O-CA 3.44Å; R445-Y482 HydrophobicContact CB-CD1 4.01Å; R445-Y482 HydrophobicContact CB-CE1 3.98Å; R445-Y482 HydrophobicContact CG-CE1 4.36Å; L450-Y482 HydrophobicContact CD1-CD1 3.88Å; L450-Y482 HydrophobicContact CD1-CE1 3.49Å; L450-Y482 VanDerWaalsContact CD1-CE1 3.49Å; I476-Y482 HydrophobicContact CB-CE2 4.25Å; I476-Y482 HydrophobicContact CD1-CD1 3.66Å; I476-Y482 HydrophobicContact CD1-CD2 4.17Å; I476-Y482 HydrophobicContact CD1-CE1 3.71Å; I476-Y482 HydrophobicContact CD1-CE2 4.26Å; I476-Y482 HydrophobicContact CD1-CG 3.9Å; I476-Y482 HydrophobicContact CG2-CD2 3.68Å; I476-Y482 HydrophobicContact CG2-CE2 3.49Å; I476-Y482 VanDerWaalsContact CG2-CE2 3.49Å; I476-Y482 HydrophobicContact CG2-CG 4.47Å; E477-Y482 PolarHBondContact N-OH 3.26Å; V480-Y482 HydrophobicContact CB-CD2 4.48Å; V480-Y482 HydrophobicContact CB-CE2 3.78Å; V480-Y482 HydrophobicContact CG1-CD2 4.23Å; V480-Y482 HydrophobicContact CG1-CE2 3.65Å; V480-Y482 WeakPolarHBondContact O-CD2 3.37Å; V480-Y482 WeakPolarHBondContact O-CE2 3.24Å
483	T	98.6	Very high	95.2	Very high	4 Å²	4	40.7 Å²	40.7	3%	0.025	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.6	177.3	-55.2	0	0	0	0	109.3	S411 Q413 L443 K444	S411-T483 WeakPolarHBondContact OG-CG2 3.37Å; Q413-T483 HydrophobicContact CG-CG2 4.43Å; Q413-T483 PolarHBondContact NE2-OG1 2.82Å; L443-T483 WeakPolarHBondContact CA-O 3.45Å; K444-T483 PolarHBondContact N-O 3.06Å; K444-T483 PolarHBondContact O-N 2.86Å
484	A	98.5	Very high	94.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.2	163.5	0	0	0	0	0	108.5	S411 I412 F414 F425 I530	S411-A484 CarbonylContact C-O 3.56Å; S411-A484 WeakPolarHBondContact CA-O 3.38Å; S411-A484 WeakPolarHBondContact CB-O 3.48Å; S411-A484 PolarHBondContact OG-O 2.97Å; I412-A484 HydrophobicContact CG2-CB 3.99Å; I412-A484 PolarHBondContact N-O 2.79Å; I412-A484 PolarHBondContact O-N 3.08Å; F414-A484 HydrophobicContact CE1-CB 4.44Å; F425-A484 HydrophobicContact CD1-CB 4.22Å; F425-A484 HydrophobicContact CE1-CB 3.47Å; F425-A484 VanDerWaalsContact CE1-CB 3.47Å; F425-A484 HydrophobicContact CE2-CB 3.98Å; F425-A484 HydrophobicContact CZ-CB 3.33Å; A484-I530 HydrophobicContact CB-CD1 4.41Å
485	G	97.8	Very high	94.7	Very high	2 Å²	2	41 Å²	41	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.2	178.6	0	0	0	0	0	110.4	E442	E442-G485 PolarHBondContact N-O 3.35Å; E442-G485 PolarHBondContact O-N 2.55Å
486	I	97.7	Very high	94.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.1	-176.2	-51	-66.8	0	0	0	109.1	C409 D410 F425 L427 V439 R440 L441 L488 I530	C409-I486 WeakPolarHBondContact CA-O 3.35Å; D410-I486 PolarHBondContact N-O 2.87Å; D410-I486 PolarHBondContact O-N 3.4Å; F425-I486 HydrophobicContact CD2-CD1 3.62Å; F425-I486 HydrophobicContact CE2-CD1 4.19Å; F425-I486 HydrophobicContact CG-CD1 4.36Å; L427-I486 HydrophobicContact CD1-CG2 4.02Å; L427-I486 HydrophobicContact CD2-CD1 4.28Å; L427-I486 HydrophobicContact CD2-CG1 4.01Å; L427-I486 HydrophobicContact CD2-CG2 4.13Å; V439-I486 HydrophobicContact CG1-CG2 3.66Å; R440-I486 WeakPolarHBondContact O-CA 3.09Å; L441-I486 HydrophobicContact CB-CD1 4.22Å; L441-I486 HydrophobicContact CD2-CD1 4.35Å; L441-I486 HydrophobicContact CG-CD1 3.82Å; I486-L488 HydrophobicContact CG2-CD1 4.11Å; I486-L488 HydrophobicContact CG2-CG 3.87Å; I486-I530 HydrophobicContact CB-CD1 4.39Å; I486-I530 HydrophobicContact CG1-CD1 3.62Å; I486-I530 HydrophobicContact CG1-CG1 3.93Å
487	V	96.5	Very high	94.5	Very high	35 Å²	35	40.3 Å²	40.3	21%	0.212	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	110.7	166.4	-175.6	0	0	0	0	107.8	C409 V439 R440	C409-V487 HydrophobicContact CB-CG2 4.21Å; V439-V487 WeakPolarHBondContact CA-O 3.48Å; R440-V487 HydrophobicContact CB-CB 4.19Å; R440-V487 PolarHBondContact N-O 3.3Å; R440-V487 PolarHBondContact O-N 2.73Å
488	L	93.8	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.6	175.6	-80.8	157	0	0	0	109.7	Y405 L427 Y437 V439 F457 I486 Q529	Y405-L488 WeakPolarHBondContact CB-O 3.37Å; Y405-L488 HydrophobicContact CD1-CB 3.47Å; Y405-L488 VanDerWaalsContact CD1-CB 3.47Å; Y405-L488 HydrophobicContact CD1-CD1 4.4Å; Y405-L488 HydrophobicContact CE1-CB 3.52Å; Y405-L488 HydrophobicContact CE1-CD1 3.6Å; Y405-L488 HydrophobicContact CE1-CG 4.14Å; Y405-L488 HydrophobicContact CG-CB 4.14Å; L427-L488 HydrophobicContact CD1-CD2 4.29Å; Y437-L488 HydrophobicContact CD1-CD2 4.37Å; Y437-L488 HydrophobicContact CG-CD2 4.32Å; V439-L488 HydrophobicContact CB-CD2 4.39Å; V439-L488 HydrophobicContact CG1-CD2 4.15Å; V439-L488 HydrophobicContact CG2-CD2 3.59Å; F457-L488 HydrophobicContact CE1-CD2 3.73Å; F457-L488 HydrophobicContact CZ-CD2 4.32Å; I486-L488 HydrophobicContact CG2-CD1 4.11Å; I486-L488 HydrophobicContact CG2-CG 3.87Å; L488-Q529 HydrophobicContact CD1-CB 4.36Å; L488-Q529 HydrophobicContact CD1-CG 4.4Å
489	E	92.6	Very high	94.3	Very high	111 Å²	111	43.9 Å²	43.9	52%	0.519	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	123.9	171.9	-62.8	-173.9	172.2	0	0	110.3	Y437 Q438	Y437-E489 CarbonylContact C-O 3.58Å; Y437-E489 WeakPolarHBondContact CA-O 3.37Å; Q438-E489 HydrophobicContact CB-CB 4.28Å; Q438-E489 PolarHBondContact N-O 2.93Å; Q438-E489 PolarHBondContact O-N 3.46Å
490	G	89	Confident	94.3	Very high	25 Å²	25	38.2 Å²	38.2	26%	0.258	19%	0.194	S	C	.	.			trans	-170.7	160.3	178.1	0	0	0	0	0	111.2
491	N	86.5	Confident	94.3	Very high	162 Å²	162	38.8 Å²	38.8	87%	0.866	20%	0.195	S	C	*	.	S	Bend	trans	-79	-29.5	-177	-66.4	-20.3	0	0	0	112.7
492	E	87.7	Confident	94.3	Very high	63 Å²	63	39 Å²	39	29%	0.294	21%	0.205	S	C	.	.	S	Bend	trans	-92.6	147.3	-176.4	-62.3	-54.7	139.8	0	0	112	S430 N432 A435 Y437	S430-E492 WeakPolarHBondContact OG-CB 3.32Å; N432-E492 WeakPolarHBondContact CB-OE2 3.49Å; N432-E492 PolarHBondContact ND2-OE2 3.22Å; A435-E492 HydrophobicContact CB-CB 3.95Å; A435-E492 HydrophobicContact CB-CG 3.75Å; Y437-E492 PolarHBondContact OH-O 2.73Å
493	L	90.8	Very high	94.2	Very high	45 Å²	45	43.8 Å²	43.8	24%	0.236	23%	0.228	C	C	.	.			trans	-76.7	147.4	172.8	-52.9	178.1	0	0	0	110	Q402 W403 R404 S431	Q402-L493 HydrophobicContact CB-CB 3.48Å; Q402-L493 VanDerWaalsContact CB-CB 3.48Å; Q402-L493 HydrophobicContact CB-CD1 3.94Å; Q402-L493 HydrophobicContact CB-CG 4.27Å; Q402-L493 HydrophobicContact CG-CB 4.32Å; W403-L493 WeakPolarHBondContact O-CA 3.27Å; W403-L493 WeakPolarHBondContact O-CD2 3.44Å; R404-L493 HydrophobicContact CB-CD2 4.28Å; R404-L493 HydrophobicContact CG-CD2 3.39Å; S431-L493 PolarHBondContact N-O 3.03Å; S431-L493 PolarHBondContact OG-O 3.33Å
494	S	92	Very high	94.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-108.6	166.9	-176.8	69.4	0	0	0	0	114.5	W403 Y405 G429 Q529	W403-S494 VanDerWaalsContact CB-OG 3.24Å; W403-S494 WeakPolarHBondContact CB-OG 3.37Å; W403-S494 PolarHBondContact N-O 2.89Å; W403-S494 VanDerWaalsContact N-O 3.16Å; W403-S494 PolarHBondContact O-N 3.25Å; Y405-S494 WeakPolarHBondContact OH-CB 3.5Å; Y405-S494 PolarHBondContact OH-OG 3.47Å; G429-S494 WeakPolarHBondContact O-CA 3.25Å; G429-S494 WeakPolarHBondContact O-CB 3.49Å; S494-Q529 PolarHBondContact OG-NE2 3.46Å; S494-Q529 PolarHBondContact OG-OE1 3Å
495	Y	92.6	Very high	94.1	Very high	36 Å²	36	51.1 Å²	51.1	14%	0.141	26%	0.263	C	S	.	.			trans	-62.3	158.1	158.2	-65.3	-83.8	0	0	0	110.8	A397 F428 G429 S430 S431 G461 S462 Q529	A397-Y495 WeakPolarHBondContact O-CD1 3.31Å; F428-Y495 WeakPolarHBondContact CB-O 3.47Å; G429-Y495 PolarHBondContact O-N 3.04Å; G429-Y495 VanDerWaalsContact O-N 3.1Å; S430-Y495 VanDerWaalsContact O-CE2 3.3Å; S430-Y495 WeakPolarHBondContact O-CE2 3.46Å; S431-Y495 VanDerWaalsContact CA-CE2 3.42Å; G461-Y495 WeakPolarHBondContact O-CE2 3.47Å; G461-Y495 PolarHBondContact O-OH 2.8Å; S462-Y495 WeakPolarHBondContact O-CD2 3.47Å; S462-Y495 VanDerWaalsContact O-CE2 3.27Å; S462-Y495 WeakPolarHBondContact O-CE2 3.41Å; Y495-Q529 PolarHBondContact O-NE2 3.42Å
496	F	93.3	Very high	94.1	Very high	18 Å²	18	52.3 Å²	52.3	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	156.6	170.4	69.1	-78.4	0	0	0	109.6	S396 A397 N401 W403 Q498	S396-F496 WeakPolarHBondContact CA-O 3.27Å; A397-F496 HydrophobicContact CB-CD1 4.2Å; A397-F496 HydrophobicContact CB-CE1 3.58Å; A397-F496 HydrophobicContact CB-CE2 4.12Å; A397-F496 HydrophobicContact CB-CZ 3.55Å; A397-F496 PolarHBondContact N-O 2.79Å; N401-F496 HydrophobicContact CB-CE1 4.35Å; N401-F496 HydrophobicContact CB-CZ 4.3Å; N401-F496 WeakPolarHBondContact O-CE1 3.3Å; W403-F496 HydrophobicContact CB-CB 4.39Å; W403-F496 HydrophobicContact CD2-CB 3.95Å; W403-F496 HydrophobicContact CD2-CG 4.43Å; W403-F496 HydrophobicContact CE3-CB 3.25Å; W403-F496 AromaticContact CE3-CD1 3.96Å; W403-F496 HydrophobicContact CE3-CD1 3.96Å; W403-F496 AromaticContact CE3-CD2 3.66Å; W403-F496 HydrophobicContact CE3-CD2 3.66Å; W403-F496 HydrophobicContact CE3-CE2 4.47Å; W403-F496 AromaticContact CE3-CG 3.34Å; W403-F496 HydrophobicContact CE3-CG 3.34Å; W403-F496 HydrophobicContact CG-CB 4.47Å; W403-F496 HydrophobicContact CZ3-CB 3.75Å; W403-F496 AromaticContact CZ3-CD2 3.47Å; W403-F496 HydrophobicContact CZ3-CD2 3.47Å; W403-F496 VanDerWaalsContact CZ3-CD2 3.47Å; W403-F496 HydrophobicContact CZ3-CE2 4.2Å; W403-F496 AromaticContact CZ3-CG 3.69Å; W403-F496 HydrophobicContact CZ3-CG 3.69Å; F496-Q498 HydrophobicContact CD2-CG 4.18Å; F496-Q498 HydrophobicContact CE2-CG 3.64Å; F496-Q498 HydrophobicContact CZ-CG 4.3Å
497	G	94.3	Very high	93.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	151.9	-179.6	0	0	0	0	0	112.3	S395 G527 G528	S395-G497 WeakPolarHBondContact O-CA 2.99Å; G497-G527 WeakPolarHBondContact O-CA 3.15Å; G497-G528 PolarHBondContact N-O 2.9Å; G497-G528 PolarHBondContact O-N 3.48Å
498	Q	93.7	Very high	93.7	Very high	78 Å²	78	62.3 Å²	62.3	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	172	173.9	-66.8	-169.5	-35.4	0	0	109.9	F393 Q394 S395 A397 F496 G500 Q526	F393-Q498 WeakPolarHBondContact CB-O 3.17Å; F393-Q498 WeakPolarHBondContact CD1-O 3.14Å; Q394-Q498 PolarHBondContact N-O 3.38Å; S395-Q498 PolarHBondContact O-N 2.82Å; A397-Q498 VanDerWaalsContact CB-CD 3.5Å; A397-Q498 HydrophobicContact CB-CG 3.91Å; F496-Q498 HydrophobicContact CD2-CG 4.18Å; F496-Q498 HydrophobicContact CE2-CG 3.64Å; F496-Q498 HydrophobicContact CZ-CG 4.3Å; Q498-G500 PolarHBondContact O-N 2.87Å; Q498-Q526 CarbonylContact C-O 3.53Å
499	E	94.2	Very high	93.9	Very high	104 Å²	104	62.6 Å²	62.6	49%	0.486	32%	0.32	S	S	.	.	S	Bend	trans	54.8	43.9	178.2	-64	162.5	171.8	0	0	111.1	Q394 S395 Q526	Q394-E499 HydrophobicContact CB-CB 3.83Å; Q394-E499 HydrophobicContact CG-CB 4.34Å; Q394-E499 PolarHBondContact N-O 3.44Å; S395-E499 WeakPolarHBondContact CB-OE2 3.1Å; S395-E499 VanDerWaalsContact OG-CD 3.29Å; S395-E499 PolarHBondContact OG-OE2 3.37Å; E499-Q526 PolarHBondContact N-O 2.7Å; E499-Q526 VanDerWaalsContact N-O 3.16Å
500	G	96.4	Very high	94.2	Very high	4 Å²	4	58.5 Å²	58.5	4%	0.041	30%	0.302	C	S	.	.			trans	-71.2	134.9	-174.8	0	0	0	0	0	112.7	R392 Q498 V525 Q526	R392-G500 CarbonylContact O-C 3.57Å; R392-G500 VanDerWaalsContact O-CA 3.23Å; R392-G500 WeakPolarHBondContact O-CA 3.44Å; Q498-G500 PolarHBondContact O-N 2.87Å; G500-V525 CarbonylContact C-O 3.58Å; G500-V525 WeakPolarHBondContact CA-O 3.19Å; G500-Q526 PolarHBondContact N-O 3.32Å; G500-Q526 PolarHBondContact O-NE2 3.23Å
501	M	97.2	Very high	94.6	Very high	47 Å²	47	57.3 Å²	57.3	23%	0.232	29%	0.29	C	S	.	.			trans	-87.9	128.2	-174.4	-62.8	174.7	-74.6	0	0	109.7	H391 R392 Q394 E503 V504	H391-M501 WeakPolarHBondContact O-CE 3.28Å; R392-M501 PolarHBondContact O-N 3.35Å; Q394-M501 HydrophobicContact CG-CE 4.34Å; Q394-M501 HydrophobicContact CG-CG 4.15Å; Q394-M501 HydrophobicContact CG-SD 4.02Å; M501-E503 PolarHBondContact O-N 3.43Å; M501-V504 HydrophobicContact CB-CG2 3.72Å; M501-V504 HydrophobicContact CE-CG2 3.83Å; M501-V504 HydrophobicContact SD-CG2 4.33Å
502	P	97.6	Very high	95.2	Very high	80 Å²	80	53.3 Å²	53.3	52%	0.519	27%	0.266	S	S	.	.	S	Bend	trans	-70.1	-22.7	175.8	29.4	-34.5	0	0	0	112.3	Q512 F513 V525	P502-Q512 CarbonylContact O-C 3.53Å; P502-Q512 WeakPolarHBondContact O-CA 3.23Å; P502-F513 PolarHBondContact O-N 3.41Å; P502-V525 HydrophobicContact CB-CG1 3.97Å
503	E	98.2	Very high	95.7	Very high	106 Å²	106	50.7 Å²	50.7	50%	0.495	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.4	177.8	-172.6	171.9	103.1	0	0	109.8	M501 T510 F511 Q512	M501-E503 PolarHBondContact O-N 3.43Å; E503-T510 HydrophobicContact CG-CG2 3.68Å; E503-F511 CarbonylContact C-O 3.57Å; E503-F511 VanDerWaalsContact CA-O 3.22Å; E503-F511 WeakPolarHBondContact CA-O 3.15Å; E503-Q512 HydrophobicContact CG-CG 4.28Å; E503-Q512 PolarHBondContact OE2-NE2 3.25Å; E503-Q512 VanDerWaalsContact OE2-NE2 3.1Å
504	V	97.9	Very high	96.1	Very high	14 Å²	14	52.8 Å²	52.8	9%	0.085	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	126.7	-179.3	179	0	0	0	0	109.2	R392 M501 V506 F511 F513	R392-V504 HydrophobicContact CB-CG2 4.31Å; M501-V504 HydrophobicContact CB-CG2 3.72Å; M501-V504 HydrophobicContact CE-CG2 3.83Å; M501-V504 HydrophobicContact SD-CG2 4.33Å; V504-V506 HydrophobicContact CG1-CG2 3.77Å; V504-F511 PolarHBondContact N-O 3.45Å; V504-F511 PolarHBondContact O-N 3.45Å; V504-F513 HydrophobicContact CB-CE2 4.24Å; V504-F513 HydrophobicContact CG2-CD2 4.46Å; V504-F513 HydrophobicContact CG2-CE2 3.93Å
505	Q	97.4	Very high	96.3	Very high	144 Å²	144	56.8 Å²	56.8	67%	0.673	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.2	175.6	-166.4	-179.2	18.4	0	0	110.7	V509	Q505-V509 WeakPolarHBondContact CA-O 3.48Å
506	V	96.3	Very high	96.5	Very high	27 Å²	27	55.6 Å²	55.6	16%	0.164	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	124.2	-176.9	169.2	0	0	0	0	109.6	V504 N508 V509 F535	V504-V506 HydrophobicContact CG1-CG2 3.77Å; V506-N508 VanDerWaalsContact C-N 3.29Å; V506-N508 PolarHBondContact O-N 2.86Å; V506-V509 PolarHBondContact N-O 2.96Å; V506-V509 PolarHBondContact O-N 2.81Å; V506-F535 HydrophobicContact CG1-CE1 4.26Å; V506-F535 HydrophobicContact CG1-CZ 4.15Å
507	H	92.2	Very high	96.6	Very high	125 Å²	125	61.4 Å²	61.4	58%	0.579	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	43.2	176.9	-61.2	85.7	0	0	0	114.3	K388 V509	K388-H507 HydrophobicContact CD-CB 4.02Å; H507-V509 VanDerWaalsContact C-N 3.27Å; H507-V509 PolarHBondContact O-N 3.25Å
508	N	93.7	Very high	96.7	Very high	119 Å²	119	64.1 Å²	64.1	64%	0.636	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	25.5	-176.6	-49.5	-39.5	0	0	0	114.8	R418 V506	R418-N508 WeakPolarHBondContact CD-O 3.15Å; V506-N508 VanDerWaalsContact C-N 3.29Å; V506-N508 PolarHBondContact O-N 2.86Å
509	V	97.9	Very high	96.8	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.1	167.9	-175.6	0	0	0	0	108	T416 I420 Q505 V506 H507 F511 F535	T416-V509 HydrophobicContact CG2-CG1 4Å; I420-V509 HydrophobicContact CG2-CG1 4.02Å; I420-V509 HydrophobicContact CG2-CG2 4.01Å; Q505-V509 WeakPolarHBondContact CA-O 3.48Å; V506-V509 PolarHBondContact N-O 2.96Å; V506-V509 PolarHBondContact O-N 2.81Å; H507-V509 VanDerWaalsContact C-N 3.27Å; H507-V509 PolarHBondContact O-N 3.25Å; V509-F511 HydrophobicContact CB-CD2 4.44Å; V509-F511 HydrophobicContact CB-CE2 3.88Å; V509-F511 HydrophobicContact CG1-CD2 3.95Å; V509-F511 HydrophobicContact CG1-CE2 3.48Å; V509-F511 VanDerWaalsContact CG1-CE2 3.48Å; V509-F511 HydrophobicContact CG1-CZ 4Å; V509-F535 HydrophobicContact CB-CE2 4.48Å; V509-F535 HydrophobicContact CG2-CE2 4.07Å
510	T	98.5	Very high	96.9	Very high	24 Å²	24	61 Å²	61	15%	0.147	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118.2	176.4	-47.7	0	0	0	0	108.7	T416 D417 E503	T416-T510 WeakPolarHBondContact CA-O 3.36Å; D417-T510 VanDerWaalsContact CG-N 3.3Å; D417-T510 PolarHBondContact N-O 3.38Å; D417-T510 PolarHBondContact OD1-N 3.16Å; D417-T510 WeakPolarHBondContact OD2-CB 3.5Å; D417-T510 PolarHBondContact OD2-N 3.01Å; D417-T510 PolarHBondContact OD2-OG1 3.45Å; E503-T510 HydrophobicContact CG-CG2 3.68Å
511	F	98.6	Very high	96.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	131.3	175.6	-71.4	-102.9	0	0	0	109.7	C390 F414 C415 T416 I420 E503 V504 V509 F513 I533 F535	C390-F511 HydrophobicContact CB-CD1 4.26Å; C390-F511 HydrophobicContact CB-CD2 3.89Å; C390-F511 HydrophobicContact CB-CE1 4.14Å; C390-F511 HydrophobicContact CB-CE2 3.76Å; C390-F511 HydrophobicContact CB-CG 4.14Å; C390-F511 HydrophobicContact CB-CZ 3.89Å; C390-F511 VanDerWaalsContact SG-CD2 3.53Å; C390-F511 WeakPolarHBondContact SG-CG 3.42Å; F414-F511 HydrophobicContact CD2-CD1 4.38Å; C415-F511 WeakPolarHBondContact O-CA 3.39Å; T416-F511 HydrophobicContact CG2-CD1 3.43Å; T416-F511 VanDerWaalsContact CG2-CD1 3.43Å; T416-F511 HydrophobicContact CG2-CD2 4.37Å; T416-F511 HydrophobicContact CG2-CE1 3.39Å; T416-F511 HydrophobicContact CG2-CE2 4.33Å; T416-F511 HydrophobicContact CG2-CG 3.94Å; T416-F511 HydrophobicContact CG2-CZ 3.87Å; I420-F511 HydrophobicContact CD1-CE1 3.72Å; I420-F511 HydrophobicContact CD1-CZ 3.64Å; E503-F511 CarbonylContact C-O 3.57Å; E503-F511 VanDerWaalsContact CA-O 3.22Å; E503-F511 WeakPolarHBondContact CA-O 3.15Å; V504-F511 PolarHBondContact N-O 3.45Å; V504-F511 PolarHBondContact O-N 3.45Å; V509-F511 HydrophobicContact CB-CD2 4.44Å; V509-F511 HydrophobicContact CB-CE2 3.88Å; V509-F511 HydrophobicContact CG1-CD2 3.95Å; V509-F511 HydrophobicContact CG1-CE2 3.48Å; V509-F511 VanDerWaalsContact CG1-CE2 3.48Å; V509-F511 HydrophobicContact CG1-CZ 4Å; F511-F513 HydrophobicContact CB-CE2 3.74Å; F511-F513 HydrophobicContact CB-CZ 3.94Å; F511-F513 HydrophobicContact CD1-CZ 4.42Å; F511-F513 HydrophobicContact CG-CZ 4.5Å; F511-I533 HydrophobicContact CD1-CD1 4.1Å; F511-I533 HydrophobicContact CE1-CB 4.34Å; F511-I533 HydrophobicContact CE1-CD1 4.2Å; F511-I533 HydrophobicContact CE1-CG2 4.16Å; F511-F535 HydrophobicContact CE2-CD1 4.4Å; F511-F535 AromaticContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE2 4.41Å; F511-F535 AromaticContact CE2-CZ 3.79Å; F511-F535 HydrophobicContact CE2-CZ 3.79Å; F511-F535 AromaticContact CZ-CD1 3.78Å; F511-F535 HydrophobicContact CZ-CD1 3.78Å; F511-F535 HydrophobicContact CZ-CD2 4.39Å; F511-F535 AromaticContact CZ-CE1 3.65Å; F511-F535 HydrophobicContact CZ-CE1 3.65Å; F511-F535 HydrophobicContact CZ-CE2 4.26Å; F511-F535 HydrophobicContact CZ-CG 4.15Å; F511-F535 AromaticContact CZ-CZ 3.89Å; F511-F535 HydrophobicContact CZ-CZ 3.89Å
512	Q	98.5	Very high	96.5	Very high	79 Å²	79	62 Å²	62	37%	0.369	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.2	171.7	-67.9	-177.7	-13	0	0	110	F414 C415 P502 E503	F414-Q512 CarbonylContact C-O 3.5Å; F414-Q512 WeakPolarHBondContact CA-O 3.47Å; C415-Q512 PolarHBondContact N-O 2.82Å; C415-Q512 PolarHBondContact O-N 2.99Å; P502-Q512 CarbonylContact O-C 3.53Å; P502-Q512 WeakPolarHBondContact O-CA 3.23Å; E503-Q512 HydrophobicContact CG-CG 4.28Å; E503-Q512 PolarHBondContact OE2-NE2 3.25Å; E503-Q512 VanDerWaalsContact OE2-NE2 3.1Å
513	F	98.6	Very high	96.5	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.035	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.1	-175.8	-64	-82.1	0	0	0	112	R392 I412 Q413 F414 P502 V504 F511 V525 I533	R392-F513 HydrophobicContact CB-CD2 4.21Å; R392-F513 HydrophobicContact CB-CE1 4.37Å; R392-F513 HydrophobicContact CB-CE2 3.69Å; R392-F513 HydrophobicContact CB-CZ 3.79Å; R392-F513 HydrophobicContact CG-CZ 4.4Å; I412-F513 HydrophobicContact CG1-CB 4.47Å; I412-F513 HydrophobicContact CG1-CD1 3.99Å; Q413-F513 WeakPolarHBondContact O-CA 3.43Å; F414-F513 HydrophobicContact CB-CD1 3.92Å; F414-F513 HydrophobicContact CB-CE1 3.94Å; P502-F513 PolarHBondContact O-N 3.41Å; V504-F513 HydrophobicContact CB-CE2 4.24Å; V504-F513 HydrophobicContact CG2-CD2 4.46Å; V504-F513 HydrophobicContact CG2-CE2 3.93Å; F511-F513 HydrophobicContact CB-CE2 3.74Å; F511-F513 HydrophobicContact CB-CZ 3.94Å; F511-F513 HydrophobicContact CD1-CZ 4.42Å; F511-F513 HydrophobicContact CG-CZ 4.5Å; F513-V525 HydrophobicContact CB-CG2 4.5Å; F513-V525 WeakPolarHBondContact O-CG2 3.4Å; F513-I533 HydrophobicContact CE1-CD1 3.72Å; F513-I533 HydrophobicContact CE1-CG1 4.41Å; F513-I533 HydrophobicContact CZ-CD1 4.17Å
514	Q	98	Very high	96.4	Very high	89 Å²	89	53.9 Å²	53.9	42%	0.416	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.4	175.5	-65.8	-171.1	7.5	0	0	111.6	I412 Q413 Y481 S516	I412-Q514 WeakPolarHBondContact CD1-O 3.37Å; Q413-Q514 HydrophobicContact CB-CB 4.19Å; Q413-Q514 PolarHBondContact N-O 3.16Å; Q413-Q514 PolarHBondContact O-N 2.85Å; Y481-Q514 HydrophobicContact CE1-CB 4.35Å; Y481-Q514 HydrophobicContact CE1-CG 3.78Å; Y481-Q514 VanDerWaalsContact CZ-NE2 3.29Å; Y481-Q514 PolarHBondContact OH-NE2 3.05Å; Q514-S516 PolarHBondContact O-N 3.29Å
515	C	97.6	Very high	96.3	Very high	84 Å²	84	54.1 Å²	54.1	57%	0.568	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	130	174.8	-68	0	0	0	0	110.5
516	S	97.1	Very high	96.2	Very high	11 Å²	11	53.5 Å²	53.5	8%	0.077	31%	0.306	C	S	.	.			trans	-85.4	134.6	173	177.8	0	0	0	0	111	S411 Q514 E518 S519	S411-S516 WeakPolarHBondContact OG-CB 3.38Å; S411-S516 PolarHBondContact OG-OG 2.91Å; Q514-S516 PolarHBondContact O-N 3.29Å; S516-E518 PolarHBondContact O-N 3.36Å; S516-E518 WeakPolarHBondContact OG-CB 3.49Å; S516-E518 PolarHBondContact OG-N 3.04Å; S516-E518 VanDerWaalsContact OG-N 3.11Å; S516-S519 WeakPolarHBondContact O-CB 3.27Å; S516-S519 PolarHBondContact O-N 3.34Å
517	T	95.1	Very high	96.1	Very high	140 Å²	140	53 Å²	53	86%	0.859	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.8	170.3	53.3	0	0	0	0	112.9	S519	T517-S519 VanDerWaalsContact C-N 3.33Å
518	E	95.6	Very high	96.3	Very high	57 Å²	57	47 Å²	47	27%	0.266	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.2	176.6	-58.5	-177.8	-148.4	0	0	112.7	K444 S516 T520	K444-E518 IonicContact NZ-OE2 2.76Å; K444-E518 PolarHBondContact NZ-OE2 2.98Å; S516-E518 PolarHBondContact O-N 3.36Å; S516-E518 WeakPolarHBondContact OG-CB 3.49Å; S516-E518 PolarHBondContact OG-N 3.04Å; S516-E518 VanDerWaalsContact OG-N 3.11Å; E518-T520 PolarHBondContact O-N 3.43Å
519	S	96.5	Very high	96.3	Very high	28 Å²	28	41.4 Å²	41.4	20%	0.196	25%	0.249	C	C	.	.			trans	-75.2	108.7	-179.8	-165.1	0	0	0	0	110.9	S411 S516 T517 T523	S411-S519 PolarHBondContact N-OG 3.29Å; S411-S519 WeakPolarHBondContact O-CB 3.01Å; S411-S519 PolarHBondContact O-OG 3.27Å; S516-S519 WeakPolarHBondContact O-CB 3.27Å; S516-S519 PolarHBondContact O-N 3.34Å; T517-S519 VanDerWaalsContact C-N 3.33Å; S519-T523 VanDerWaalsContact CB-O 3.31Å; S519-T523 WeakPolarHBondContact CB-O 3.48Å; S519-T523 PolarHBondContact OG-N 2.78Å; S519-T523 PolarHBondContact OG-O 3.22Å
520	T	95.5	Very high	96.3	Very high	89 Å²	89	41.1 Å²	41.1	55%	0.546	25%	0.247	S	C	.	.			trans	-107.1	-7.4	180	53	0	0	0	0	112.8	C409 E518	C409-T520 PolarHBondContact N-OG1 3.16Å; C409-T520 PolarHBondContact O-N 2.89Å; C409-T520 PolarHBondContact O-OG1 3.44Å; E518-T520 PolarHBondContact O-N 3.43Å
521	N	94.5	Very high	96.2	Very high	16 Å²	16	40 Å²	40	9%	0.086	24%	0.24	C	C	.	.	S	Bend	trans	-108.8	4.9	179.5	-151.7	29.2	0	0	0	114.6	W403 R404 R408 C409 D410	W403-N521 VanDerWaalsContact CZ2-O 3.24Å; W403-N521 WeakPolarHBondContact CZ2-O 3.49Å; W403-N521 PolarHBondContact NE1-ND2 3.3Å; W403-N521 VanDerWaalsContact NE1-ND2 3.12Å; R404-N521 PolarHBondContact O-ND2 2.94Å; R404-N521 PolarHBondContact O-OD1 3.25Å; R404-N521 VanDerWaalsContact O-OD1 3.1Å; R408-N521 HydrophobicContact CB-CB 3.6Å; R408-N521 WeakPolarHBondContact CD-OD1 3.41Å; C409-N521 PolarHBondContact O-N 3.47Å; D410-N521 WeakPolarHBondContact OD1-CB 2.93Å; D410-N521 WeakPolarHBondContact OD2-CB 3.08Å; D410-N521 PolarHBondContact OD2-ND2 3.5Å
522	G	92.1	Very high	96.2	Very high	55 Å²	55	40.9 Å²	40.9	57%	0.567	24%	0.244	S	C	*	.			trans	96.9	1.1	170.3	0	0	0	0	0	115.5	G524	G522-G524 PolarHBondContact O-N 3.27Å
523	T	95.9	Very high	96.2	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.025	23%	0.227	C	C	.	.			trans	-63.4	125.6	170.8	-75.2	0	0	0	0	109.2	D410 I412 S519 G528 Q529 I530	D410-T523 WeakPolarHBondContact CB-OG1 3.29Å; D410-T523 VanDerWaalsContact CG-OG1 3.31Å; D410-T523 VanDerWaalsContact OD1-CB 3.3Å; D410-T523 WeakPolarHBondContact OD1-CB 3.35Å; D410-T523 PolarHBondContact OD1-OG1 3.39Å; I412-T523 HydrophobicContact CB-CG2 4.26Å; S519-T523 VanDerWaalsContact CB-O 3.31Å; S519-T523 WeakPolarHBondContact CB-O 3.48Å; S519-T523 PolarHBondContact OG-N 2.78Å; S519-T523 PolarHBondContact OG-O 3.22Å; T523-G528 VanDerWaalsContact OG1-CA 3.27Å; T523-G528 WeakPolarHBondContact OG1-CA 3.11Å; T523-Q529 PolarHBondContact OG1-N 3.06Å; T523-I530 HydrophobicContact CG2-CD1 4.42Å; T523-I530 HydrophobicContact CG2-CG1 4.49Å
524	G	96.2	Very high	96.2	Very high	12 Å²	12	36.9 Å²	36.9	12%	0.124	23%	0.225	C	C	.	.			trans	-149.8	-168.5	174.5	0	0	0	0	0	109.8	R392 G522 Q526 G527	R392-G524 PolarHBondContact NH2-O 3.12Å; G522-G524 PolarHBondContact O-N 3.27Å; G524-Q526 PolarHBondContact O-N 3.44Å; G524-G527 PolarHBondContact N-O 3.49Å
525	V	97	Very high	96.2	Very high	19 Å²	19	32.6 Å²	32.6	12%	0.115	21%	0.206	C	C	.	.	S	Bend	trans	-59.4	-47.2	-175.5	179.9	0	0	0	0	111.7	R392 I412 G500 P502 F513 G527	R392-V525 PolarHBondContact NH1-O 3.07Å; I412-V525 HydrophobicContact CD1-CG2 4.38Å; G500-V525 CarbonylContact C-O 3.58Å; G500-V525 WeakPolarHBondContact CA-O 3.19Å; P502-V525 HydrophobicContact CB-CG1 3.97Å; F513-V525 HydrophobicContact CB-CG2 4.5Å; F513-V525 WeakPolarHBondContact O-CG2 3.4Å; V525-G527 PolarHBondContact O-N 2.92Å
526	Q	95.5	Very high	96.1	Very high	130 Å²	130	31 Å²	31	61%	0.607	19%	0.188	S	C	*	.	S	Bend	trans	-74.7	-23.8	-172.8	-66.4	-61.6	-46.3	0	0	115.6	Q498 E499 G500 G524	Q498-Q526 CarbonylContact C-O 3.53Å; E499-Q526 PolarHBondContact N-O 2.7Å; E499-Q526 VanDerWaalsContact N-O 3.16Å; G500-Q526 PolarHBondContact N-O 3.32Å; G500-Q526 PolarHBondContact O-NE2 3.23Å; G524-Q526 PolarHBondContact O-N 3.44Å
527	G	94.2	Very high	96	Very high	17 Å²	17	32.1 Å²	32.1	18%	0.175	19%	0.194	C	C	.	.	S	Bend	trans	-166.6	154.1	-176.2	0	0	0	0	0	112.3	F393 G497 G524 V525	F393-G527 VanDerWaalsContact CE1-CA 3.43Å; G497-G527 WeakPolarHBondContact O-CA 3.15Å; G524-G527 PolarHBondContact N-O 3.49Å; V525-G527 PolarHBondContact O-N 2.92Å
528	G	95	Very high	96.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	164.5	-177.2	-173.9	0	0	0	0	0	116.9	F393 W403 G497 T523	F393-G528 WeakPolarHBondContact CE2-O 3.02Å; W403-G528 VanDerWaalsContact CH2-CA 3.45Å; G497-G528 PolarHBondContact N-O 2.9Å; G497-G528 PolarHBondContact O-N 3.48Å; T523-G528 VanDerWaalsContact OG1-CA 3.27Å; T523-G528 WeakPolarHBondContact OG1-CA 3.11Å
529	Q	95.2	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-90.9	-11.6	-179	-78.1	-61.4	-60	0	0	115.6	W403 Y405 D410 F428 L488 S494 Y495 T523 P531	W403-Q529 HydrophobicContact CD2-CG 3.94Å; W403-Q529 HydrophobicContact CG-CG 3.71Å; W403-Q529 HydrophobicContact CZ2-CG 4.37Å; Y405-Q529 HydrophobicContact CE1-CG 4.16Å; Y405-Q529 PolarHBondContact OH-OE1 3.03Å; D410-Q529 HydrophobicContact CB-CB 4.06Å; F428-Q529 PolarHBondContact N-O 3.28Å; L488-Q529 HydrophobicContact CD1-CB 4.36Å; L488-Q529 HydrophobicContact CD1-CG 4.4Å; S494-Q529 PolarHBondContact OG-NE2 3.46Å; S494-Q529 PolarHBondContact OG-OE1 3Å; Y495-Q529 PolarHBondContact O-NE2 3.42Å; T523-Q529 PolarHBondContact OG1-N 3.06Å; Q529-P531 WeakPolarHBondContact O-CD 3.44Å
530	I	97.2	Very high	96.1	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	15%	0.15	C	C	.	.			trans	-109.4	82.7	-173	-50.7	173.5	0	0	0	108.7	R392 I412 F425 L427 A484 I486 T523	R392-I530 WeakPolarHBondContact CD-O 3.2Å; R392-I530 PolarHBondContact NE-O 3.1Å; I412-I530 HydrophobicContact CG2-CB 4.36Å; I412-I530 HydrophobicContact CG2-CD1 3.98Å; I412-I530 HydrophobicContact CG2-CG2 4.31Å; F425-I530 HydrophobicContact CB-CG2 4.37Å; F425-I530 HydrophobicContact CD1-CG2 4.31Å; F425-I530 HydrophobicContact CG-CG2 4.49Å; L427-I530 HydrophobicContact CD2-CG1 4.33Å; A484-I530 HydrophobicContact CB-CD1 4.41Å; I486-I530 HydrophobicContact CB-CD1 4.39Å; I486-I530 HydrophobicContact CG1-CD1 3.62Å; I486-I530 HydrophobicContact CG1-CG1 3.93Å; T523-I530 HydrophobicContact CG2-CD1 4.42Å; T523-I530 HydrophobicContact CG2-CG1 4.49Å
531	P	97	Very high	96.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.126	C	C	.	.			trans	-74.9	-29.5	-179.8	27.3	-37.8	0	0	0	114.9	H391 R392 F393 G426 F428 I465 Q529	H391-P531 WeakPolarHBondContact CA-O 3.45Å; R392-P531 WeakPolarHBondContact CG-O 3.31Å; R392-P531 PolarHBondContact N-O 2.84Å; F393-P531 HydrophobicContact CD2-CB 3.78Å; F393-P531 HydrophobicContact CE2-CB 4.19Å; G426-P531 WeakPolarHBondContact O-CD 3.32Å; G426-P531 WeakPolarHBondContact O-CG 3.28Å; F428-P531 HydrophobicContact CD2-CB 4.29Å; F428-P531 HydrophobicContact CD2-CG 3.89Å; F428-P531 HydrophobicContact CE2-CB 3.61Å; F428-P531 HydrophobicContact CE2-CG 3.72Å; F428-P531 HydrophobicContact CG-CG 4.37Å; F428-P531 HydrophobicContact CZ-CB 3.82Å; F428-P531 HydrophobicContact CZ-CG 4.08Å; I465-P531 HydrophobicContact CB-CG 4.41Å; I465-P531 HydrophobicContact CD1-CB 4.03Å; I465-P531 HydrophobicContact CD1-CG 4.17Å; I465-P531 HydrophobicContact CG1-CB 4.23Å; I465-P531 HydrophobicContact CG1-CG 3.86Å; I465-P531 HydrophobicContact CG2-CG 3.72Å; Q529-P531 WeakPolarHBondContact O-CD 3.44Å
532	E	97.9	Very high	96.2	Very high	19 Å²	19	20.7 Å²	20.7	9%	0.089	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.3	-173.6	-63.9	-179.1	169	0	0	112.9	R389 C390 H391 F425 G426 I465 L534	R389-E532 IonicContact CZ-OE2 3.91Å; R389-E532 IonicContact NH1-OE2 3.2Å; R389-E532 PolarHBondContact NH1-OE2 2.74Å; C390-E532 VanDerWaalsContact O-CA 3.28Å; C390-E532 WeakPolarHBondContact O-CA 3.46Å; H391-E532 HydrophobicContact CB-CG 4.28Å; H391-E532 IonicContact ND1-OE1 3.91Å; H391-E532 PolarHBondContact ND1-OE1 3.2Å; F425-E532 WeakPolarHBondContact CA-O 2.92Å; G426-E532 PolarHBondContact N-O 3.05Å; I465-E532 HydrophobicContact CD1-CG 3.94Å; I465-E532 WeakPolarHBondContact CD1-OE1 3.31Å; I465-E532 HydrophobicContact CG2-CB 4.42Å; I465-E532 HydrophobicContact CG2-CG 4.07Å; E532-L534 HydrophobicContact CB-CD2 4.21Å
533	I	98.5	Very high	96.5	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.015	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.9	156.9	-60.2	179.2	0	0	0	107.4	C390 F414 V422 F425 F511 F513	C390-I533 HydrophobicContact CB-CB 4.37Å; C390-I533 PolarHBondContact N-O 2.55Å; C390-I533 PolarHBondContact O-N 3.21Å; F414-I533 HydrophobicContact CB-CD1 3.84Å; F414-I533 HydrophobicContact CD1-CD1 3.63Å; F414-I533 HydrophobicContact CD2-CD1 3.67Å; F414-I533 HydrophobicContact CE1-CD1 4.06Å; F414-I533 HydrophobicContact CE2-CD1 4.09Å; F414-I533 HydrophobicContact CG-CD1 3.42Å; F414-I533 VanDerWaalsContact CG-CD1 3.42Å; F414-I533 HydrophobicContact CZ-CD1 4.27Å; V422-I533 HydrophobicContact CG1-CG2 4.24Å; V422-I533 HydrophobicContact CG2-CG2 3.81Å; F425-I533 HydrophobicContact CD1-CG1 4.17Å; F425-I533 HydrophobicContact CE1-CG1 4.22Å; F511-I533 HydrophobicContact CD1-CD1 4.1Å; F511-I533 HydrophobicContact CE1-CB 4.34Å; F511-I533 HydrophobicContact CE1-CD1 4.2Å; F511-I533 HydrophobicContact CE1-CG2 4.16Å; F513-I533 HydrophobicContact CE1-CD1 3.72Å; F513-I533 HydrophobicContact CE1-CG1 4.41Å; F513-I533 HydrophobicContact CZ-CD1 4.17Å
534	L	98.4	Very high	96.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	178.5	-50.9	174.5	0	0	0	108.2	L387 K388 R389 V422 A423 G424 P467 F469 E532	L387-L534 HydrophobicContact CD1-CB 4.16Å; K388-L534 WeakPolarHBondContact O-CA 3.37Å; R389-L534 HydrophobicContact CG-CD2 3.84Å; V422-L534 CarbonylContact C-O 3.5Å; A423-L534 PolarHBondContact N-O 2.84Å; G424-L534 PolarHBondContact N-O 3.48Å; G424-L534 WeakPolarHBondContact O-CB 3.45Å; G424-L534 PolarHBondContact O-N 2.85Å; P467-L534 HydrophobicContact CB-CD1 3.44Å; P467-L534 VanDerWaalsContact CB-CD1 3.44Å; F469-L534 HydrophobicContact CD1-CD1 4.23Å; F469-L534 HydrophobicContact CE1-CB 4.49Å; F469-L534 HydrophobicContact CE1-CD1 3.75Å; F469-L534 HydrophobicContact CZ-CD1 4.09Å; E532-L534 HydrophobicContact CB-CD2 4.21Å
535	F	98.1	Very high	96.6	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	165.9	-171.9	73.6	-78.9	0	0	0	113.3	K388 C390 I420 F421 V506 V509 F511	K388-F535 HydrophobicContact CB-CD1 3.91Å; K388-F535 HydrophobicContact CB-CD2 4.23Å; K388-F535 HydrophobicContact CB-CE1 3.54Å; K388-F535 HydrophobicContact CB-CE2 3.9Å; K388-F535 HydrophobicContact CB-CG 4.25Å; K388-F535 HydrophobicContact CB-CZ 3.54Å; K388-F535 WeakPolarHBondContact CB-O 3.44Å; K388-F535 HydrophobicContact CD-CD2 4.15Å; K388-F535 HydrophobicContact CD-CE2 3.53Å; K388-F535 HydrophobicContact CD-CZ 3.8Å; K388-F535 HydrophobicContact CG-CE2 4.38Å; K388-F535 HydrophobicContact CG-CZ 4.32Å; K388-F535 PolarHBondContact N-O 2.83Å; K388-F535 PolarHBondContact O-N 2.82Å; C390-F535 HydrophobicContact CB-CE1 4.11Å; I420-F535 HydrophobicContact CB-CD2 4.05Å; I420-F535 HydrophobicContact CD1-CB 3.98Å; I420-F535 HydrophobicContact CD1-CD2 4.12Å; I420-F535 HydrophobicContact CD1-CG 4.11Å; I420-F535 HydrophobicContact CG2-CD2 3.92Å; I420-F535 HydrophobicContact CG2-CE2 4.19Å; F421-F535 CarbonylContact O-C 3.51Å; F421-F535 WeakPolarHBondContact O-CA 3.2Å; F421-F535 WeakPolarHBondContact O-CB 3.2Å; V506-F535 HydrophobicContact CG1-CE1 4.26Å; V506-F535 HydrophobicContact CG1-CZ 4.15Å; V509-F535 HydrophobicContact CB-CE2 4.48Å; V509-F535 HydrophobicContact CG2-CE2 4.07Å; F511-F535 HydrophobicContact CE2-CD1 4.4Å; F511-F535 AromaticContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE2 4.41Å; F511-F535 AromaticContact CE2-CZ 3.79Å; F511-F535 HydrophobicContact CE2-CZ 3.79Å; F511-F535 AromaticContact CZ-CD1 3.78Å; F511-F535 HydrophobicContact CZ-CD1 3.78Å; F511-F535 HydrophobicContact CZ-CD2 4.39Å; F511-F535 AromaticContact CZ-CE1 3.65Å; F511-F535 HydrophobicContact CZ-CE1 3.65Å; F511-F535 HydrophobicContact CZ-CE2 4.26Å; F511-F535 HydrophobicContact CZ-CG 4.15Å; F511-F535 AromaticContact CZ-CZ 3.89Å; F511-F535 HydrophobicContact CZ-CZ 3.89Å
536	Y	95.5	Very high	96.6	Very high	51 Å²	51	20.1 Å²	20.1	20%	0.2	10%	0.099	C	C	.	.			trans	-107.9	0	171.4	-59.1	-57.9	0	0	0	111.5	L385 L387 K388 F421 A423 P473	L385-Y536 HydrophobicContact CB-CD1 3.34Å; L385-Y536 HydrophobicContact CB-CD2 4.27Å; L385-Y536 HydrophobicContact CB-CE1 3.7Å; L385-Y536 HydrophobicContact CB-CG 3.67Å; L385-Y536 HydrophobicContact CD1-CD1 4.34Å; L385-Y536 HydrophobicContact CD1-CD2 3.88Å; L385-Y536 HydrophobicContact CD1-CG 3.77Å; L385-Y536 HydrophobicContact CG-CD1 4.49Å; L385-Y536 HydrophobicContact CG-CG 4.39Å; L385-Y536 VanDerWaalsContact O-CE1 3.26Å; L385-Y536 WeakPolarHBondContact O-CE1 3.44Å; L387-Y536 HydrophobicContact CB-CE1 3.99Å; L387-Y536 HydrophobicContact CD1-CD1 4.23Å; L387-Y536 HydrophobicContact CD1-CE1 3.61Å; L387-Y536 HydrophobicContact CG-CE1 4.45Å; K388-Y536 WeakPolarHBondContact CE-OXT 3.45Å; K388-Y536 PolarHBondContact NZ-OXT 2.79Å; F421-Y536 HydrophobicContact CB-CD2 4.48Å; F421-Y536 PolarHBondContact O-N 2.81Å; A423-Y536 HydrophobicContact CB-CD2 4.34Å; A423-Y536 HydrophobicContact CB-CE2 3.75Å; P473-Y536 HydrophobicContact CB-CD2 4.2Å; P473-Y536 HydrophobicContact CB-CE2 4.27Å; P473-Y536 HydrophobicContact CG-CD2 3.98Å; P473-Y536 HydrophobicContact CG-CE2 3.6Å

Retrieved 536 of 536 residues in 632.3 ms (Link to these results)

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