A0A077Z9V7_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077Z9V7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 667 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	35	Very low	37.4	Very low	196 Å²	196	163.2 Å²	163.2	97%	0.966	78%	0.781	S	S	*	*				0	-53.8	0	-73.1	-61.9	-114.3	0	0	112.1	L3 I4	M1-L3 PolarHBondContact O-N 3.48Å; M1-I4 PolarHBondContact O-N 3.44Å
2	A	35.5	Very low	37.1	Very low	84 Å²	84	159.8 Å²	159.8	69%	0.694	78%	0.782	S	S	*	*	H	α-helix	trans	-60.2	-41.6	175.1	0	0	0	0	0	113.4	I4 R5	A2-I4 PolarHBondContact O-N 3.32Å; A2-I4 VanDerWaalsContact O-N 3.16Å; A2-R5 PolarHBondContact O-N 2.76Å; A2-R5 VanDerWaalsContact O-N 3.12Å
3	L	33.7	Very low	36.9	Very low	137 Å²	137	156.5 Å²	156.5	72%	0.717	78%	0.776	S	S	*	*	H	α-helix	trans	-64.2	-20.9	179.6	-131.6	104.5	0	0	0	114.8	M1	M1-L3 PolarHBondContact O-N 3.48Å
4	I	43	Very low	36.3	Very low	135 Å²	135	158.5 Å²	158.5	69%	0.692	78%	0.783	S	S	*	*	H	α-helix	trans	-84.7	-21.6	180	-64.5	174.1	0	0	0	110.8	M1 A2	M1-I4 PolarHBondContact O-N 3.44Å; A2-I4 PolarHBondContact O-N 3.32Å; A2-I4 VanDerWaalsContact O-N 3.16Å
5	R	45.5	Very low	36.1	Very low	227 Å²	227	156.9 Å²	156.9	86%	0.857	78%	0.779	S	S	*	*	H	α-helix	trans	-80.7	-23.8	178.1	-74.1	-172.6	176.9	-174	-0.9	113.4	A2	A2-R5 PolarHBondContact O-N 2.76Å; A2-R5 VanDerWaalsContact O-N 3.12Å
6	E	45	Very low	35.7	Very low	162 Å²	162	159.6 Å²	159.6	76%	0.757	79%	0.788	S	S	*	*	H	α-helix	trans	-82.4	-28.3	-176	-112.1	175.1	173	0	0	114.2	G8	E6-G8 VanDerWaalsContact C-N 3.34Å; E6-G8 PolarHBondContact O-N 3.19Å
7	L	41.8	Very low	35.5	Very low	155 Å²	155	156.4 Å²	156.4	81%	0.812	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	9.4	-176.7	-71.1	166.9	0	0	0	114.3
8	G	37.3	Very low	35.2	Very low	46 Å²	46	153.5 Å²	153.5	47%	0.474	79%	0.789	S	S	.	*			trans	-98.4	13.8	-174.3	0	0	0	0	0	116.5	E6 W10	E6-G8 VanDerWaalsContact C-N 3.34Å; E6-G8 PolarHBondContact O-N 3.19Å; G8-W10 VanDerWaalsContact C-N 3.3Å; G8-W10 PolarHBondContact O-N 3.16Å
9	R	34	Very low	35	Very low	237 Å²	237	149.5 Å²	149.5	89%	0.894	79%	0.79	S	S	*	*			trans	-76.9	80.4	177.2	-72.8	-166.3	-172.9	-141.1	4.1	111.2	Q11	R9-Q11 PolarHBondContact O-N 3.28Å
10	W	30.9	Very low	34.7	Very low	244 Å²	244	153.7 Å²	153.7	92%	0.924	79%	0.794	S	S	*	*			trans	-66.3	112.1	165.7	-79.9	74.7	0	0	0	109.6	G8	G8-W10 VanDerWaalsContact C-N 3.3Å; G8-W10 PolarHBondContact O-N 3.16Å
11	Q	29.7	Very low	34.6	Very low	172 Å²	172	154.5 Å²	154.5	80%	0.804	80%	0.8	S	S	*	*			trans	-88.4	131.9	166.8	-73.2	-169.2	-23	0	0	109.4	R9 V13	R9-Q11 PolarHBondContact O-N 3.28Å; Q11-V13 PolarHBondContact O-N 3.19Å
12	P	33.8	Very low	34.3	Very low	123 Å²	123	155.1 Å²	155.1	80%	0.799	80%	0.797	S	S	*	*			trans	-72.4	125.4	-179.5	29.2	-31.1	0	0	0	109.9	E14	P12-E14 PolarHBondContact O-N 2.85Å
13	V	34	Very low	34.1	Very low	116 Å²	116	159.5 Å²	159.5	70%	0.703	80%	0.803	S	S	*	*			trans	-76.6	109.5	175.6	178.8	0	0	0	0	108.7	Q11 N15	Q11-V13 PolarHBondContact O-N 3.19Å; V13-N15 PolarHBondContact O-N 3.22Å
14	E	29.4	Very low	33.9	Very low	185 Å²	185	160.7 Å²	160.7	86%	0.864	81%	0.81	S	S	*	*			trans	-69.8	91.8	170.9	-71.2	-177.2	164.2	0	0	109.8	P12 E16	P12-E14 PolarHBondContact O-N 2.85Å; E14-E16 PolarHBondContact O-N 3.24Å
15	N	33.2	Very low	33.2	Very low	135 Å²	135	162.4 Å²	162.4	72%	0.722	82%	0.82	S	S	*	*			trans	-88.2	92.1	170.6	-85.3	-25.2	0	0	0	109.9	V13 S17	V13-N15 PolarHBondContact O-N 3.22Å; N15-S17 PolarHBondContact O-N 3.43Å; N15-S17 VanDerWaalsContact O-N 3.07Å
16	E	29.3	Very low	32.4	Very low	200 Å²	200	159.4 Å²	159.4	94%	0.935	81%	0.813	S	S	*	*			trans	-64.7	97.9	158.8	-72.3	-169.7	152.7	0	0	109.4	E14	E14-E16 PolarHBondContact O-N 3.24Å
17	S	33.2	Very low	31.6	Very low	105 Å²	105	160.2 Å²	160.2	73%	0.734	82%	0.822	S	S	*	*			trans	-141.9	109.9	162.7	53.7	0	0	0	0	110.5	N15	N15-S17 PolarHBondContact O-N 3.43Å; N15-S17 VanDerWaalsContact O-N 3.07Å
18	A	29.5	Very low	30.9	Very low	104 Å²	104	155.3 Å²	155.3	86%	0.86	81%	0.809	S	S	*	*			trans	-61.4	137.2	-174.6	0	0	0	0	0	113.5
19	G	30.8	Very low	30.5	Very low	77 Å²	77	160.8 Å²	160.8	79%	0.794	83%	0.827	S	S	*	*			trans	54.9	82.9	140.6	0	0	0	0	0	117.7
20	R	30.3	Very low	30.1	Very low	234 Å²	234	156.8 Å²	156.8	88%	0.883	82%	0.817	S	S	*	*			trans	-137.9	113.1	150.4	-98.7	-176	-82.4	174.2	-4.1	110.7	K22	R20-K22 PolarHBondContact O-N 3.38Å; R20-K22 VanDerWaalsContact O-N 3.15Å
21	D	30.9	Very low	30	Very low	170 Å²	170	154 Å²	154	91%	0.909	81%	0.814	S	S	*	*			trans	-30.4	102.5	175.9	-62.7	-38.1	0	0	0	114.3	E23	D21-E23 VanDerWaalsContact C-N 3.33Å; D21-E23 PolarHBondContact O-N 2.85Å
22	K	30.2	Very low	29.9	Very low	209 Å²	209	153.5 Å²	153.5	91%	0.909	81%	0.812	S	S	*	*			trans	-90	64.3	168	-70.9	-175.3	178.6	177.4	0	110.4	R20	R20-K22 PolarHBondContact O-N 3.38Å; R20-K22 VanDerWaalsContact O-N 3.15Å
23	E	31.4	Very low	29.5	Very low	177 Å²	177	155.3 Å²	155.3	83%	0.827	81%	0.814	S	S	*	*			trans	-135.7	81.3	165.2	-82.4	-167.8	166.3	0	0	109.1	D21	D21-E23 VanDerWaalsContact C-N 3.33Å; D21-E23 PolarHBondContact O-N 2.85Å
24	L	29.1	Very low	29.2	Very low	162 Å²	162	153.3 Å²	153.3	85%	0.848	80%	0.802	S	S	*	*	S	Bend	trans	161	81.2	148.8	-109.1	75.6	0	0	0	108.8
25	D	28.4	Very low	28.8	Very low	171 Å²	171	151.8 Å²	151.8	91%	0.914	80%	0.799	S	S	*	*			trans	-159.8	21.4	151.3	-97.3	-20.2	0	0	0	112.4
26	F	28.3	Very low	28.7	Very low	163 Å²	163	151.9 Å²	151.9	72%	0.715	79%	0.791	S	S	*	*			trans	-111	60.5	-173.9	-154.5	-108.3	0	0	0	111.4	F30	F26-F30 HydrophobicContact CD1-CD2 4.46Å; F26-F30 AromaticContact CD1-CE2 3.88Å; F26-F30 HydrophobicContact CD1-CE2 3.88Å; F26-F30 AromaticContact CE1-CD2 3.94Å; F26-F30 HydrophobicContact CE1-CD2 3.94Å; F26-F30 AromaticContact CE1-CE2 3Å; F26-F30 HydrophobicContact CE1-CE2 3Å; F26-F30 AromaticContact CE1-CZ 3.49Å; F26-F30 HydrophobicContact CE1-CZ 3.49Å; F26-F30 VanDerWaalsContact CE1-CZ 3.49Å; F26-F30 HydrophobicContact CE2-CE2 4.03Å; F26-F30 HydrophobicContact CZ-CD2 4.28Å; F26-F30 AromaticContact CZ-CE2 3.13Å; F26-F30 HydrophobicContact CZ-CE2 3.13Å; F26-F30 AromaticContact CZ-CZ 3.57Å; F26-F30 HydrophobicContact CZ-CZ 3.57Å
27	L	28.3	Very low	28.6	Very low	180 Å²	180	149.8 Å²	149.8	94%	0.942	79%	0.786	S	S	*	*	S	Bend	trans	-145.1	20.9	177.9	-111.3	160.6	0	0	0	113.9
28	G	27.8	Very low	28.4	Very low	52 Å²	52	151.3 Å²	151.3	54%	0.536	79%	0.785	S	S	.	*	S	Bend	trans	-129.7	134.6	156.8	0	0	0	0	0	106.4
29	D	27.4	Very low	28.3	Very low	160 Å²	160	152 Å²	152	86%	0.856	78%	0.779	S	S	*	*			trans	92.8	33.9	170.4	-44.3	-18.7	0	0	0	117.4	E31	D29-E31 VanDerWaalsContact C-N 3.29Å; D29-E31 PolarHBondContact O-N 3.5Å
30	F	26.5	Very low	28.2	Very low	154 Å²	154	153.8 Å²	153.8	68%	0.675	78%	0.775	S	S	*	*			trans	-88	77.8	145.3	-90.6	-105.8	0	0	0	108.4	F26 E32	F26-F30 HydrophobicContact CD1-CD2 4.46Å; F26-F30 AromaticContact CD1-CE2 3.88Å; F26-F30 HydrophobicContact CD1-CE2 3.88Å; F26-F30 AromaticContact CE1-CD2 3.94Å; F26-F30 HydrophobicContact CE1-CD2 3.94Å; F26-F30 AromaticContact CE1-CE2 3Å; F26-F30 HydrophobicContact CE1-CE2 3Å; F26-F30 AromaticContact CE1-CZ 3.49Å; F26-F30 HydrophobicContact CE1-CZ 3.49Å; F26-F30 VanDerWaalsContact CE1-CZ 3.49Å; F26-F30 HydrophobicContact CE2-CE2 4.03Å; F26-F30 HydrophobicContact CZ-CD2 4.28Å; F26-F30 AromaticContact CZ-CE2 3.13Å; F26-F30 HydrophobicContact CZ-CE2 3.13Å; F26-F30 AromaticContact CZ-CZ 3.57Å; F26-F30 HydrophobicContact CZ-CZ 3.57Å; F30-E32 VanDerWaalsContact C-N 3.26Å; F30-E32 PolarHBondContact O-N 3.47Å
31	E	28.5	Very low	27.9	Very low	184 Å²	184	150.5 Å²	150.5	86%	0.86	78%	0.775	S	S	*	*			trans	-68.7	100.1	147.1	-77.9	-169.7	154.7	0	0	105.5	D29 L33	D29-E31 VanDerWaalsContact C-N 3.29Å; D29-E31 PolarHBondContact O-N 3.5Å; E31-L33 PolarHBondContact O-N 3.31Å
32	E	28.8	Very low	27.8	Very low	163 Å²	163	146.6 Å²	146.6	76%	0.762	76%	0.76	S	S	*	*			trans	-49.7	106.2	175.3	-83	176.7	154.9	0	0	109.9	F30 V34	F30-E32 VanDerWaalsContact C-N 3.26Å; F30-E32 PolarHBondContact O-N 3.47Å; E32-V34 VanDerWaalsContact C-N 3.29Å; E32-V34 HydrophobicContact CB-CG2 3.73Å; E32-V34 PolarHBondContact O-N 2.62Å
33	L	24	Very low	27.6	Very low	160 Å²	160	142.1 Å²	142.1	84%	0.838	76%	0.756	S	S	*	*			trans	-56.3	94.7	154.4	-84.6	147.4	0	0	0	107.5	E31	E31-L33 PolarHBondContact O-N 3.31Å
34	V	27.9	Very low	27.4	Very low	75 Å²	75	141.8 Å²	141.8	46%	0.455	75%	0.753	S	S	.	*			trans	-126.5	88.4	163.6	-128.7	0	0	0	0	107.2	E32 Y36	E32-V34 VanDerWaalsContact C-N 3.29Å; E32-V34 HydrophobicContact CB-CG2 3.73Å; E32-V34 PolarHBondContact O-N 2.62Å; V34-Y36 HydrophobicContact CB-CD2 3.9Å; V34-Y36 HydrophobicContact CB-CE2 3.68Å; V34-Y36 HydrophobicContact CG1-CD2 3.99Å; V34-Y36 HydrophobicContact CG1-CE2 3.35Å; V34-Y36 PolarHBondContact O-N 2.73Å; V34-Y36 VanDerWaalsContact O-N 3.15Å
35	D	22	Very low	27.2	Very low	152 Å²	152	143 Å²	143	81%	0.813	76%	0.755	S	S	*	*			trans	-58.1	112.3	165.1	-74.4	-36.5	0	0	0	108.1
36	Y	30.1	Very low	26.9	Very low	137 Å²	137	141.5 Å²	141.5	54%	0.537	75%	0.752	S	S	.	*			trans	-121	96.4	169.1	-82.5	-75.3	0	0	0	108.8	V34 L38	V34-Y36 HydrophobicContact CB-CD2 3.9Å; V34-Y36 HydrophobicContact CB-CE2 3.68Å; V34-Y36 HydrophobicContact CG1-CD2 3.99Å; V34-Y36 HydrophobicContact CG1-CE2 3.35Å; V34-Y36 PolarHBondContact O-N 2.73Å; V34-Y36 VanDerWaalsContact O-N 3.15Å; Y36-L38 VanDerWaalsContact C-N 3.31Å; Y36-L38 PolarHBondContact O-N 3.14Å
37	D	26.3	Very low	26.8	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	76%	0.755	S	S	*	*			trans	-70.6	89.3	159.7	-96.3	-22.9	0	0	0	109	T39	D37-T39 PolarHBondContact O-N 3Å
38	L	30	Very low	26.6	Very low	137 Å²	137	135.5 Å²	135.5	72%	0.717	75%	0.751	S	S	*	*			trans	-94	74.1	167.4	-73.4	170.9	0	0	0	109.6	Y36 T40	Y36-L38 VanDerWaalsContact C-N 3.31Å; Y36-L38 PolarHBondContact O-N 3.14Å; L38-T40 PolarHBondContact O-N 2.9Å
39	T	26.5	Very low	26.5	Very low	120 Å²	120	142.8 Å²	142.8	74%	0.736	77%	0.768	S	S	*	*			trans	-71.2	72.9	162.4	48.4	0	0	0	0	109.5	D37 N41	D37-T39 PolarHBondContact O-N 3Å; T39-N41 PolarHBondContact O-N 3.11Å
40	T	28.9	Very low	26.4	Very low	114 Å²	114	140.5 Å²	140.5	70%	0.699	77%	0.765	S	S	*	*			trans	-85.7	97.5	165.5	47.1	0	0	0	0	108.7	L38 S42	L38-T40 PolarHBondContact O-N 2.9Å; T40-S42 PolarHBondContact O-N 3.01Å
41	N	25	Very low	26.1	Very low	165 Å²	165	141.4 Å²	141.4	88%	0.882	77%	0.768	S	S	*	*			trans	-49.1	105.6	165.4	-79	-26.4	0	0	0	109.3	T39	T39-N41 PolarHBondContact O-N 3.11Å
42	S	28.1	Very low	26	Very low	87 Å²	87	141.1 Å²	141.1	61%	0.608	77%	0.771	S	S	*	*			trans	-112	105.4	162.5	51.8	0	0	0	0	107.8	T40 H44	T40-S42 PolarHBondContact O-N 3.01Å; S42-H44 PolarHBondContact O-N 3.18Å
43	S	26.3	Very low	25.8	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	77%	0.77	S	S	*	*			trans	-56.8	98.8	168.2	38.5	0	0	0	0	109.6	Q45	S43-Q45 PolarHBondContact O-N 3.39Å
44	H	27.2	Very low	25.6	Very low	169 Å²	169	138 Å²	138	78%	0.782	77%	0.77	S	S	*	*			trans	-86.3	96.9	168.5	-85.7	-59	0	0	0	109.3	S42	S42-H44 PolarHBondContact O-N 3.18Å
45	Q	25.2	Very low	25.5	Very low	187 Å²	187	139.4 Å²	139.4	87%	0.874	78%	0.783	S	S	*	*			trans	-60.5	135.3	162.3	-78.3	179.6	-8.5	0	0	110.2	S43	S43-Q45 PolarHBondContact O-N 3.39Å
46	T	22	Very low	25.5	Very low	141 Å²	141	138.3 Å²	138.3	87%	0.865	78%	0.782	S	S	*	*			trans	-66.3	118.4	-179.7	45.3	0	0	0	0	111.7
47	G	26.8	Very low	25.1	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	79%	0.791	S	S	*	*			trans	-113.6	105.3	168.6	0	0	0	0	0	110.5	K49	G47-K49 PolarHBondContact O-N 3.32Å
48	V	23.5	Very low	25.1	Very low	143 Å²	143	138.9 Å²	138.9	87%	0.867	80%	0.796	S	S	*	*			trans	-54.8	125.4	174.1	177.3	0	0	0	0	109.9
49	K	25.2	Very low	24.8	Very low	204 Å²	204	141.5 Å²	141.5	89%	0.887	80%	0.804	S	S	*	*			trans	-116.1	115.7	168.5	-86.7	-171.1	173.8	-174.3	0	110.2	G47	G47-K49 PolarHBondContact O-N 3.32Å
50	S	25.9	Very low	25.2	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	81%	0.805	S	S	*	*			trans	-64.8	143.2	176.9	38.6	0	0	0	0	112.6
51	K	21	Very low	25	Very low	173 Å²	173	146 Å²	146	75%	0.752	82%	0.816	S	S	*	*			trans	-47.7	132.7	164.2	-115.7	173.3	169.7	-168.2	0	110.8
52	L	25.6	Very low	24.8	Very low	177 Å²	177	148.2 Å²	148.2	93%	0.927	82%	0.818	S	S	*	*			trans	-135.8	129.2	151.8	-135.3	91.4	0	0	0	108.8
53	E	23.6	Very low	24.7	Very low	157 Å²	157	156.1 Å²	156.1	73%	0.734	83%	0.834	S	S	*	*			trans	-89.5	165.4	-164.8	-72.5	171.1	166.7	0	0	113
54	A	21.7	Very low	24.6	Very low	100 Å²	100	160.6 Å²	160.6	83%	0.826	84%	0.839	S	S	*	*			trans	-76.6	151.9	-172.6	0	0	0	0	0	114.3
55	S	24.9	Very low	24.3	Very low	106 Å²	106	162.4 Å²	162.4	74%	0.741	85%	0.845	S	S	*	*			trans	-142.1	112.5	150.4	43.6	0	0	0	0	106.7
56	T	21.9	Very low	24.3	Very low	129 Å²	129	165.7 Å²	165.7	79%	0.791	85%	0.849	S	S	*	*				41.3	135.5	83.6	56	0	0	0	0	113.6
57	S	21.6	Very low	24.3	Very low	102 Å²	102	168.9 Å²	168.9	71%	0.713	85%	0.851	S	S	*	*			cis	176.8	125.7	-11.2	45.2	0	0	0	0	103.8
58	E	26	Very low	24	Very low	202 Å²	202	172.1 Å²	172.1	94%	0.944	85%	0.851	S	S	*	*			trans	-142.5	138.3	167	-91.9	-167.9	169.7	0	0	112.4
59	Q	24.6	Very low	24.1	Very low	192 Å²	192	175.5 Å²	175.5	90%	0.897	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91.3	168.6	-156	-87.5	-161.3	4.6	0	0	115.6
60	P	34.1	Very low	24	Very low	116 Å²	116	173.6 Å²	173.6	75%	0.753	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-97.5	149.8	-163.9	36.8	-31.1	0	0	0	115.1
61	K	24.8	Very low	23.9	Very low	212 Å²	212	173.2 Å²	173.2	92%	0.922	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-95.9	124.3	175.6	-74.5	179.5	176.9	174.6	0	112.5
62	K	21.8	Very low	24.1	Very low	212 Å²	212	176.3 Å²	176.3	92%	0.922	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-57	136.9	177.6	-65.1	169.7	174.7	173	0	113.3
63	R	25.1	Very low	24	Very low	253 Å²	253	173 Å²	173	96%	0.955	85%	0.851	S	S	*	*			trans	-124.6	136.9	160.9	-79.9	-179.7	96.2	170.8	4.5	111.5
64	K	23.8	Very low	24	Very low	211 Å²	211	172.1 Å²	172.1	92%	0.917	86%	0.856	S	S	*	*			trans	-77.5	146.5	-163.4	-81.2	170.4	167.3	174.4	0	114.7
65	K	21.4	Very low	24.3	Very low	207 Å²	207	174.7 Å²	174.7	90%	0.9	85%	0.854	S	S	*	*			trans	-45.6	136.2	168.8	-72.7	168	167.7	174.9	0	114.3
66	R	24.3	Very low	24.4	Very low	255 Å²	255	176.7 Å²	176.7	96%	0.962	86%	0.856	S	S	*	*			trans	-119.6	128.4	155.2	-78.3	179.2	93.1	160.9	3.7	108.9
67	K	22.7	Very low	24.8	Very low	209 Å²	209	174.9 Å²	174.9	91%	0.909	85%	0.854	S	S	*	*			trans	-81.6	139.8	-173.5	-84.9	175.4	166.5	-179.7	0	112.3
68	N	21.2	Very low	25.2	Very low	142 Å²	142	179.3 Å²	179.3	76%	0.759	86%	0.864	S	S	*	*			trans	-11.2	143.1	150.3	-87.7	1.2	0	0	0	118.9
69	K	24.8	Very low	25.4	Very low	213 Å²	213	173 Å²	173	93%	0.926	84%	0.841	S	S	*	*			trans	-147.9	132.4	132.2	-107.4	177.7	-178.7	-175.7	0	110.7
70	E	22.8	Very low	26.1	Very low	164 Å²	164	168.3 Å²	168.3	77%	0.766	83%	0.826	S	S	*	*			trans	-80.6	151.1	-171.3	-65.7	156.7	137.6	0	0	112.5
71	A	25.1	Very low	26.2	Very low	105 Å²	105	167.1 Å²	167.1	87%	0.868	82%	0.821	S	S	*	*			trans	-136	107.5	154.3	0	0	0	0	0	107.6
72	R	23.6	Very low	26.7	Very low	239 Å²	239	161.1 Å²	161.1	90%	0.902	81%	0.806	S	S	*	*			trans	-77.9	123.2	175.2	-90.4	172.3	167	166.2	-4.3	109.1
73	S	24.2	Very low	27.3	Very low	108 Å²	108	158.2 Å²	158.2	76%	0.755	79%	0.793	S	S	*	*			trans	-115.2	125.6	162.4	57.7	0	0	0	0	109.5
74	V	23.9	Very low	27.6	Very low	138 Å²	138	153.6 Å²	153.6	84%	0.836	78%	0.78	S	S	*	*			trans	-72.7	121.1	-179.6	176.3	0	0	0	0	109.1
75	I	28.3	Very low	28.2	Very low	153 Å²	153	148.9 Å²	148.9	79%	0.785	76%	0.763	S	S	*	*			trans	-139.1	118.4	161.3	-54.9	179.7	0	0	0	109.1
76	D	26	Very low	28.9	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	75%	0.751	S	S	*	*			trans	-1.9	138.3	167.7	-60.4	-39	0	0	0	122.4	E78	D76-E78 PolarHBondContact O-N 3.35Å
77	A	31.4	Very low	29.5	Very low	91 Å²	91	139.2 Å²	139.2	75%	0.752	73%	0.734	S	S	*	*	S	Bend	trans	-86.9	97.6	-174.2	0	0	0	0	0	111.7
78	E	29.1	Very low	30.1	Very low	196 Å²	196	139.1 Å²	139.1	92%	0.916	73%	0.727	S	S	*	*			trans	-144.6	9.9	160.6	-115.6	176.6	-164.6	0	0	114.9	D76	D76-E78 PolarHBondContact O-N 3.35Å
79	S	31.1	Very low	31.2	Very low	68 Å²	68	136.3 Å²	136.3	48%	0.476	72%	0.715	S	S	.	*			trans	-107.9	17	-177.1	94.4	0	0	0	0	115.5	S81	S79-S81 VanDerWaalsContact C-N 3.34Å; S79-S81 PolarHBondContact O-N 3.05Å
80	T	37.7	Very low	31.9	Very low	95 Å²	95	130.2 Å²	130.2	58%	0.583	69%	0.689	S	S	*	*	H	α-helix	trans	-75.2	-18.8	-166.8	-30.7	0	0	0	0	114
81	S	36.5	Very low	32.7	Very low	91 Å²	91	128.8 Å²	128.8	64%	0.636	68%	0.682	S	S	*	*	H	α-helix	trans	-76.1	-44	-177.4	-168.8	0	0	0	0	112.8	S79 K83 K84	S79-S81 VanDerWaalsContact C-N 3.34Å; S79-S81 PolarHBondContact O-N 3.05Å; S81-K83 PolarHBondContact O-N 3.1Å; S81-K84 PolarHBondContact O-N 3.4Å
82	S	36	Very low	33.3	Very low	86 Å²	86	131.9 Å²	131.9	60%	0.601	68%	0.676	S	S	*	*	H	α-helix	trans	-70.5	-30.3	-176.4	-46.6	0	0	0	0	113.5	L86	S82-L86 PolarHBondContact O-N 3.35Å
83	K	34.1	Very low	33.8	Very low	150 Å²	150	127.4 Å²	127.4	65%	0.652	66%	0.664	S	S	*	*	H	α-helix	trans	-70.7	-31.9	178.1	-77.1	179.8	177.3	170.7	0	113.1	S81 K87	S81-K83 PolarHBondContact O-N 3.1Å; K83-K87 PolarHBondContact O-N 3.01Å
84	K	32.3	Very low	34.2	Very low	157 Å²	157	125.8 Å²	125.8	68%	0.683	64%	0.643	S	S	*	*	H	α-helix	trans	-69.8	-36.8	179.1	-85.6	-176.7	176	178.1	0	112.6	S81 K87 R88	S81-K84 PolarHBondContact O-N 3.4Å; K84-K87 PolarHBondContact O-N 2.76Å; K84-R88 PolarHBondContact O-N 3.35Å
85	I	36.7	Very low	34.8	Very low	112 Å²	112	125.1 Å²	125.1	57%	0.574	64%	0.64	S	S	*	*	H	α-helix	trans	-68.8	-44.9	179.2	-65.2	169.6	0	0	0	110.5	K87 R88 V89	I85-K87 VanDerWaalsContact C-N 3.31Å; I85-K87 PolarHBondContact O-N 3.09Å; I85-R88 PolarHBondContact O-N 2.51Å; I85-V89 WeakPolarHBondContact O-CG2 3.34Å; I85-V89 PolarHBondContact O-N 3.46Å; I85-V89 VanDerWaalsContact O-N 3.08Å
86	L	35.9	Very low	35.3	Very low	123 Å²	123	124 Å²	124	64%	0.644	64%	0.635	S	S	*	*	H	α-helix	trans	-58.4	-41.4	175.3	-96.8	149.7	0	0	0	112.4	S82 R88 F90	S82-L86 PolarHBondContact O-N 3.35Å; L86-R88 PolarHBondContact O-N 2.71Å; L86-F90 VanDerWaalsContact O-CB 3.31Å; L86-F90 WeakPolarHBondContact O-CB 3.45Å; L86-F90 PolarHBondContact O-N 2.65Å
87	K	36.3	Very low	36.1	Very low	136 Å²	136	126 Å²	126	59%	0.591	64%	0.64	S	S	*	*	H	α-helix	trans	-66.7	-35	178.7	-155.9	-179.7	-177.6	-169.7	0	112.9	K83 K84 I85 F90 E91	K83-K87 PolarHBondContact O-N 3.01Å; K84-K87 PolarHBondContact O-N 2.76Å; I85-K87 VanDerWaalsContact C-N 3.31Å; I85-K87 PolarHBondContact O-N 3.09Å; K87-F90 WeakPolarHBondContact O-CB 3.43Å; K87-F90 PolarHBondContact O-N 2.94Å; K87-E91 PolarHBondContact O-N 3.09Å
88	R	36.1	Very low	36.7	Very low	206 Å²	206	130.5 Å²	130.5	78%	0.777	65%	0.645	S	S	*	*	H	α-helix	trans	-74	-37.9	178.9	-113.9	-179	-177	157.3	-0.2	113.3	K84 I85 L86 F92	K84-R88 PolarHBondContact O-N 3.35Å; I85-R88 PolarHBondContact O-N 2.51Å; L86-R88 PolarHBondContact O-N 2.71Å; R88-F92 PolarHBondContact O-N 3.49Å
89	V	43.6	Very low	37.3	Very low	83 Å²	83	124.2 Å²	124.2	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-65.4	-36.9	171.4	177.5	0	0	0	0	109.6	I85 F92 F93	I85-V89 WeakPolarHBondContact O-CG2 3.34Å; I85-V89 PolarHBondContact O-N 3.46Å; I85-V89 VanDerWaalsContact O-N 3.08Å; V89-F92 PolarHBondContact O-N 3.5Å; V89-F93 HydrophobicContact CG1-CD2 4.32Å; V89-F93 HydrophobicContact CG1-CE2 4.18Å; V89-F93 WeakPolarHBondContact O-CD2 2.75Å
90	F	38.6	Very low	37.8	Very low	85 Å²	85	125.4 Å²	125.4	37%	0.373	63%	0.627	S	S	.	*	H	α-helix	trans	-62.2	-50.3	177.1	-170.6	-97.3	0	0	0	112.6	L86 K87 F92 F94 I110	L86-F90 VanDerWaalsContact O-CB 3.31Å; L86-F90 WeakPolarHBondContact O-CB 3.45Å; L86-F90 PolarHBondContact O-N 2.65Å; K87-F90 WeakPolarHBondContact O-CB 3.43Å; K87-F90 PolarHBondContact O-N 2.94Å; F90-F92 VanDerWaalsContact C-N 3.26Å; F90-F92 PolarHBondContact O-N 3.28Å; F90-F94 HydrophobicContact CD2-CE2 4.03Å; F90-F94 AromaticContact CE2-CE2 3.99Å; F90-F94 HydrophobicContact CE2-CE2 3.99Å; F90-F94 HydrophobicContact CE2-CZ 4.47Å; F90-F94 HydrophobicContact CG-CE2 4.48Å; F90-F94 HydrophobicContact CZ-CE2 4.4Å; F90-F94 WeakPolarHBondContact O-CD2 3.36Å; F90-F94 WeakPolarHBondContact O-CE2 3.33Å; F90-I110 HydrophobicContact CE2-CG2 4.45Å
91	E	39.8	Very low	38.4	Very low	135 Å²	135	125 Å²	125	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-66.8	-22.3	-179	-82.4	168.8	-175.5	0	0	114.4	K87	K87-E91 PolarHBondContact O-N 3.09Å
92	F	39.1	Very low	39.2	Very low	169 Å²	169	125.2 Å²	125.2	74%	0.741	63%	0.627	S	S	*	*	H	α-helix	trans	-76.7	-20.3	-175.5	-170.7	-101.6	0	0	0	114.3	R88 V89 F90	R88-F92 PolarHBondContact O-N 3.49Å; V89-F92 PolarHBondContact O-N 3.5Å; F90-F92 VanDerWaalsContact C-N 3.26Å; F90-F92 PolarHBondContact O-N 3.28Å
93	F	33.5	Very low	40.1	Very low	145 Å²	145	123 Å²	123	64%	0.636	61%	0.609	S	S	*	*	S	Bend	trans	-102.2	-4.4	-171.7	-80.7	-76.7	0	0	0	115.9	V89	V89-F93 HydrophobicContact CG1-CD2 4.32Å; V89-F93 HydrophobicContact CG1-CE2 4.18Å; V89-F93 WeakPolarHBondContact O-CD2 2.75Å
94	F	32.8	Very low	41.4	Very low	75 Å²	75	119.9 Å²	119.9	33%	0.329	61%	0.611	S	S	.	*			trans	-120.6	106.7	-171.8	-59.9	-84.9	0	0	0	113.5	F90	F90-F94 HydrophobicContact CD2-CE2 4.03Å; F90-F94 AromaticContact CE2-CE2 3.99Å; F90-F94 HydrophobicContact CE2-CE2 3.99Å; F90-F94 HydrophobicContact CE2-CZ 4.47Å; F90-F94 HydrophobicContact CG-CE2 4.48Å; F90-F94 HydrophobicContact CZ-CE2 4.4Å; F90-F94 WeakPolarHBondContact O-CD2 3.36Å; F90-F94 WeakPolarHBondContact O-CE2 3.33Å
95	T	35.6	Very low	43.3	Very low	124 Å²	124	114.4 Å²	114.4	76%	0.761	59%	0.593	S	S	*	*			trans	-127.6	113.7	157.3	52	0	0	0	0	106.8
96	D	39	Very low	45.5	Very low	128 Å²	128	109.6 Å²	109.6	68%	0.684	57%	0.568	S	S	*	*			trans	150.9	128.4	150.7	-74.7	-17.5	0	0	0	112.2	E98 T99	D96-E98 VanDerWaalsContact C-N 3.34Å; D96-E98 PolarHBondContact O-N 3.26Å; D96-T99 PolarHBondContact O-N 3.37Å; D96-T99 PolarHBondContact O-OG1 3.06Å
97	E	42.4	Very low	47.8	Very low	192 Å²	192	108 Å²	108	90%	0.897	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-65.4	-22.2	-166.1	-69.7	-165.9	145.1	0	0	115.8	T99 C100	E97-T99 PolarHBondContact O-N 2.95Å; E97-C100 PolarHBondContact O-N 2.99Å
98	E	44.7	Very low	50.4	Low	185 Å²	185	105.2 Å²	105.2	86%	0.864	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15.7	178	-75.9	-170.3	155	0	0	113.4	D96 C100	D96-E98 VanDerWaalsContact C-N 3.34Å; D96-E98 PolarHBondContact O-N 3.26Å; E98-C100 PolarHBondContact O-N 3.34Å
99	T	40.8	Very low	53.1	Low	63 Å²	63	95.5 Å²	95.5	39%	0.387	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-72.1	-27.2	178.7	59.2	0	0	0	0	113.1	D96 E97 A101 L102 D103	D96-T99 PolarHBondContact O-N 3.37Å; D96-T99 PolarHBondContact O-OG1 3.06Å; E97-T99 PolarHBondContact O-N 2.95Å; T99-A101 VanDerWaalsContact C-N 3.34Å; T99-A101 PolarHBondContact O-N 3.19Å; T99-L102 PolarHBondContact O-N 2.88Å; T99-D103 WeakPolarHBondContact O-CB 3.34Å; T99-D103 PolarHBondContact O-N 3.27Å; T99-D103 VanDerWaalsContact O-N 3.09Å
100	C	43	Very low	55.4	Low	93 Å²	93	93.1 Å²	93.1	63%	0.628	49%	0.494	S	S	*	.	H	α-helix	trans	-65.8	-30.2	-164.8	-148.8	0	0	0	0	114.2	E97 E98	E97-C100 PolarHBondContact O-N 2.99Å; E98-C100 PolarHBondContact O-N 3.34Å
101	A	50.1	Low	57.9	Low	87 Å²	87	94.6 Å²	94.6	72%	0.719	50%	0.501	S	S	*	.	H	α-helix	trans	-79.7	-33.1	179.3	0	0	0	0	0	113.5	T99 D103	T99-A101 VanDerWaalsContact C-N 3.34Å; T99-A101 PolarHBondContact O-N 3.19Å; A101-D103 VanDerWaalsContact C-N 3.34Å
102	L	52.5	Low	60.5	Low	95 Å²	95	88.9 Å²	88.9	50%	0.497	48%	0.475	S	S	.	.	H	α-helix	trans	-69.3	-37.7	172.8	-80.9	158.8	0	0	0	110.5	T99 A104 S105 L106 S123	T99-L102 PolarHBondContact O-N 2.88Å; L102-A104 PolarHBondContact O-N 3.08Å; L102-S105 PolarHBondContact O-N 2.72Å; L102-S105 PolarHBondContact O-OG 2.94Å; L102-L106 PolarHBondContact O-N 3Å; L102-S123 WeakPolarHBondContact CD2-OG 3.44Å
103	D	55.4	Low	63	Low	41 Å²	41	83.5 Å²	83.5	22%	0.219	46%	0.458	C	S	.	.	H	α-helix	trans	-64.3	-40.1	-171.5	-144.4	37.6	0	0	0	113.4	T99 A101 S105 L106 H107 I110	T99-D103 WeakPolarHBondContact O-CB 3.34Å; T99-D103 PolarHBondContact O-N 3.27Å; T99-D103 VanDerWaalsContact O-N 3.09Å; A101-D103 VanDerWaalsContact C-N 3.34Å; D103-S105 PolarHBondContact O-N 2.91Å; D103-L106 PolarHBondContact O-N 2.71Å; D103-H107 PolarHBondContact O-N 2.88Å; D103-I110 WeakPolarHBondContact OD1-CD1 3.44Å
104	A	61.6	Low	66	Low	84 Å²	84	77 Å²	77	69%	0.694	43%	0.43	S	S	*	.	H	α-helix	trans	-62.1	-29.8	179.2	0	0	0	0	0	113	L102	L102-A104 PolarHBondContact O-N 3.08Å
105	S	71.1	Confident	68.9	Low	42 Å²	42	75.2 Å²	75.2	29%	0.294	43%	0.426	S	S	.	.	H	α-helix	trans	-84.6	-22	-178.6	74.4	0	0	0	0	114	L102 D103	L102-S105 PolarHBondContact O-N 2.72Å; L102-S105 PolarHBondContact O-OG 2.94Å; D103-S105 PolarHBondContact O-N 2.91Å
106	L	83.3	Confident	71.7	Confident	10 Å²	10	73.2 Å²	73.2	5%	0.052	41%	0.411	C	S	.	.	H	α-helix	trans	-110.9	8	-174.5	-68.2	173.2	0	0	0	113.3	L102 D103 E108 W109 I110 L119 F128	L102-L106 PolarHBondContact O-N 3Å; D103-L106 PolarHBondContact O-N 2.71Å; L106-E108 PolarHBondContact O-N 2.74Å; L106-E108 VanDerWaalsContact O-N 3.07Å; L106-W109 WeakPolarHBondContact O-CB 3.32Å; L106-W109 PolarHBondContact O-N 2.96Å; L106-I110 PolarHBondContact O-N 3.46Å; L106-L119 HydrophobicContact CD1-CB 4.4Å; L106-F128 HydrophobicContact CD2-CD1 4.47Å
107	H	85.4	Confident	74.4	Confident	90 Å²	90	69 Å²	69	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-50	-40.4	-174.5	-164.3	67.5	0	0	0	113.5	D103 W109 I110 H111	D103-H107 PolarHBondContact O-N 2.88Å; H107-W109 VanDerWaalsContact C-N 3.3Å; H107-W109 PolarHBondContact O-N 3.29Å; H107-I110 PolarHBondContact O-N 3.33Å; H107-H111 AromaticContact CD2-CD2 3.79Å; H107-H111 AromaticContact CD2-NE2 3.37Å; H107-H111 PolarHBondContact CD2-NE2 3.48Å; H107-H111 AromaticContact CE1-NE2 3.34Å; H107-H111 PolarHBondContact CE1-NE2 3.46Å; H107-H111 VanDerWaalsContact CE1-NE2 3.34Å; H107-H111 AromaticContact ND1-NE2 3.98Å; H107-H111 AromaticContact NE2-CD2 3.79Å; H107-H111 AromaticContact NE2-CE1 3.89Å; H107-H111 AromaticContact NE2-NE2 2.89Å; H107-H111 PolarHBondContact NE2-NE2 3.3Å; H107-H111 PolarHBondContact O-CD2 2.96Å; H107-H111 PolarHBondContact O-N 2.8Å
108	E	90.4	Very high	77	Confident	78 Å²	78	59.9 Å²	59.9	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-62.7	-33.3	177.7	-71.2	-178.4	-132.8	0	0	113.6	L106 L112 H129 P130 Q135	L106-E108 PolarHBondContact O-N 2.74Å; L106-E108 VanDerWaalsContact O-N 3.07Å; E108-L112 WeakPolarHBondContact O-CG 3.26Å; E108-H129 IonicContact OE1-CE1 3.56Å; E108-H129 PolarHBondContact OE1-CE1 3.02Å; E108-H129 IonicContact OE1-CG 2.76Å; E108-H129 IonicContact OE1-ND1 3.54Å; E108-H129 PolarHBondContact OE1-ND1 3.34Å; E108-H129 IonicContact OE2-ND1 3.5Å; E108-P130 HydrophobicContact CB-CG 3.94Å; E108-Q135 PolarHBondContact OE2-NE2 2.88Å
109	W	93.5	Very high	79.5	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-74.7	-34.6	177.8	-70	104.7	0	0	0	112.8	L106 H107 H111 L112 V114 L119 L122 F127 F128 P130 L138 I164	L106-W109 WeakPolarHBondContact O-CB 3.32Å; L106-W109 PolarHBondContact O-N 2.96Å; H107-W109 VanDerWaalsContact C-N 3.3Å; H107-W109 PolarHBondContact O-N 3.29Å; W109-H111 VanDerWaalsContact C-N 3.28Å; W109-H111 PolarHBondContact O-N 3.11Å; W109-L112 HydrophobicContact CE3-CD1 4.36Å; W109-L112 WeakPolarHBondContact O-CB 2.95Å; W109-L112 PolarHBondContact O-N 2.84Å; W109-V114 HydrophobicContact CE3-CG2 4.09Å; W109-L119 HydrophobicContact CB-CD2 3.46Å; W109-L119 VanDerWaalsContact CB-CD2 3.46Å; W109-L119 HydrophobicContact CG-CD2 4.38Å; W109-L122 HydrophobicContact CD2-CD1 3.82Å; W109-L122 HydrophobicContact CE3-CD1 3.84Å; W109-L122 HydrophobicContact CG-CD1 4.32Å; W109-L122 HydrophobicContact CH2-CD1 4.23Å; W109-L122 HydrophobicContact CH2-CD2 4.41Å; W109-L122 HydrophobicContact CZ2-CD1 4.25Å; W109-L122 HydrophobicContact CZ2-CD2 4.41Å; W109-L122 HydrophobicContact CZ3-CD1 4.04Å; W109-F127 HydrophobicContact CZ2-CB 4.49Å; W109-F127 PolarHBondContact NE1-O 2.95Å; W109-F128 VanDerWaalsContact CD1-O 3.28Å; W109-F128 PolarHBondContact NE1-O 2.88Å; W109-P130 HydrophobicContact CD2-CB 3.93Å; W109-P130 HydrophobicContact CD2-CG 4.21Å; W109-P130 HydrophobicContact CE3-CB 3.86Å; W109-P130 HydrophobicContact CE3-CG 4.46Å; W109-P130 HydrophobicContact CH2-CB 3.77Å; W109-P130 VanDerWaalsContact CZ2-CA 3.47Å; W109-P130 HydrophobicContact CZ2-CB 3.8Å; W109-P130 HydrophobicContact CZ3-CB 3.79Å; W109-L138 HydrophobicContact CE3-CD1 4.2Å; W109-L138 HydrophobicContact CZ3-CD1 3.71Å; W109-I164 HydrophobicContact CH2-CD1 4.21Å; W109-I164 HydrophobicContact CZ3-CD1 3.68Å
110	I	90.3	Very high	82.1	Confident	34 Å²	34	56.1 Å²	56.1	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-40.4	-179.4	-62.5	170.2	0	0	0	110.2	F90 D103 L106 H107 L112 C113 L119	F90-I110 HydrophobicContact CE2-CG2 4.45Å; D103-I110 WeakPolarHBondContact OD1-CD1 3.44Å; L106-I110 PolarHBondContact O-N 3.46Å; H107-I110 PolarHBondContact O-N 3.33Å; I110-L112 PolarHBondContact O-N 3.1Å; I110-L112 VanDerWaalsContact O-N 3.11Å; I110-C113 PolarHBondContact O-N 3.14Å; I110-L119 HydrophobicContact CG1-CD1 3.9Å
111	H	91.1	Very high	84.6	Confident	115 Å²	115	51.7 Å²	51.7	53%	0.532	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.7	175.4	-70.3	-65.4	0	0	0	114.2	H107 W109	H107-H111 AromaticContact CD2-CD2 3.79Å; H107-H111 AromaticContact CD2-NE2 3.37Å; H107-H111 PolarHBondContact CD2-NE2 3.48Å; H107-H111 AromaticContact CE1-NE2 3.34Å; H107-H111 PolarHBondContact CE1-NE2 3.46Å; H107-H111 VanDerWaalsContact CE1-NE2 3.34Å; H107-H111 AromaticContact ND1-NE2 3.98Å; H107-H111 AromaticContact NE2-CD2 3.79Å; H107-H111 AromaticContact NE2-CE1 3.89Å; H107-H111 AromaticContact NE2-NE2 2.89Å; H107-H111 PolarHBondContact NE2-NE2 3.3Å; H107-H111 PolarHBondContact O-CD2 2.96Å; H107-H111 PolarHBondContact O-N 2.8Å; W109-H111 VanDerWaalsContact C-N 3.28Å; W109-H111 PolarHBondContact O-N 3.11Å
112	L	94.5	Very high	86.7	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.079	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	14.1	178.7	-54.9	179.2	0	0	0	113.2	E108 W109 I110 V114 P130 Q135 L138 P139	E108-L112 WeakPolarHBondContact O-CG 3.26Å; W109-L112 HydrophobicContact CE3-CD1 4.36Å; W109-L112 WeakPolarHBondContact O-CB 2.95Å; W109-L112 PolarHBondContact O-N 2.84Å; I110-L112 PolarHBondContact O-N 3.1Å; I110-L112 VanDerWaalsContact O-N 3.11Å; L112-V114 VanDerWaalsContact C-N 3.26Å; L112-V114 HydrophobicContact CB-CG2 4.24Å; L112-V114 PolarHBondContact O-N 3.35Å; L112-P130 HydrophobicContact CD1-CB 3.7Å; L112-P130 HydrophobicContact CD1-CG 3.67Å; L112-Q135 HydrophobicContact CD1-CG 4.14Å; L112-L138 HydrophobicContact CB-CB 4.15Å; L112-L138 HydrophobicContact CB-CD1 4.42Å; L112-L138 HydrophobicContact CD1-CD1 3.98Å; L112-P139 HydrophobicContact CD2-CG 3.7Å
113	C	93.2	Very high	88.7	Confident	56 Å²	56	44.1 Å²	44.1	38%	0.378	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	27.3	179.3	-52.7	0	0	0	0	114	I110 P115 I142	I110-C113 PolarHBondContact O-N 3.14Å; C113-P115 WeakPolarHBondContact O-CD 3.48Å; C113-I142 HydrophobicContact CB-CG2 4.14Å; C113-I142 WeakPolarHBondContact O-CG2 3.44Å
114	V	95.2	Very high	90.5	Very high	8 Å²	8	45.9 Å²	45.9	5%	0.048	25%	0.249	C	C	.	.			trans	-77.1	126.1	179.2	-179.4	0	0	0	0	110.3	W109 L112 I118 L119 L122 L138 I142 I164	W109-V114 HydrophobicContact CE3-CG2 4.09Å; L112-V114 VanDerWaalsContact C-N 3.26Å; L112-V114 HydrophobicContact CB-CG2 4.24Å; L112-V114 PolarHBondContact O-N 3.35Å; V114-I118 HydrophobicContact CG1-CB 3.74Å; V114-I118 HydrophobicContact CG1-CG2 3.66Å; V114-L119 HydrophobicContact CB-CD2 3.98Å; V114-L119 HydrophobicContact CB-CG 4.35Å; V114-L119 HydrophobicContact CG1-CD2 3.91Å; V114-L119 HydrophobicContact CG1-CG 4.08Å; V114-L122 HydrophobicContact CG1-CD1 4.29Å; V114-L138 HydrophobicContact CG2-CD1 4.33Å; V114-I142 HydrophobicContact CG2-CD1 4.24Å; V114-I164 HydrophobicContact CG1-CG2 4.13Å; V114-I164 HydrophobicContact CG2-CG2 4.06Å
115	P	94.4	Very high	91.9	Very high	39 Å²	39	44.1 Å²	44.1	25%	0.253	23%	0.227	S	C	.	.			trans	-65.4	151.3	178.7	-23.9	34	0	0	0	114.9	C113 I118 L119 A168 L171	C113-P115 WeakPolarHBondContact O-CD 3.48Å; P115-I118 HydrophobicContact CG-CD1 4.48Å; P115-I118 WeakPolarHBondContact O-CA 3.42Å; P115-I118 WeakPolarHBondContact O-CB 3.47Å; P115-I118 PolarHBondContact O-N 2.88Å; P115-L119 PolarHBondContact O-N 3.38Å; P115-A168 HydrophobicContact CG-CB 3.73Å; P115-L171 HydrophobicContact CB-CD1 4.39Å
116	D	94.8	Very high	92.8	Very high	82 Å²	82	49.6 Å²	49.6	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-53.3	-42.5	-176.7	-62.9	-25.1	0	0	0	115.8	I118 L119 R120	D116-I118 PolarHBondContact O-N 3.36Å; D116-L119 PolarHBondContact O-N 2.86Å; D116-L119 VanDerWaalsContact O-N 3.15Å; D116-R120 WeakPolarHBondContact O-CG 3.01Å; D116-R120 PolarHBondContact O-N 3.29Å
117	P	95.7	Very high	93.1	Very high	39 Å²	39	51.9 Å²	51.9	25%	0.253	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-33.8	177.3	-25.3	35.8	0	0	0	112.7	A121 L171 T206	P117-A121 PolarHBondContact O-N 3.02Å; P117-L171 HydrophobicContact CB-CD1 4.32Å; P117-L171 HydrophobicContact CG-CD1 4.29Å; P117-T206 HydrophobicContact CB-CG2 4.03Å
118	I	96.4	Very high	93.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-77.4	-40.9	177.7	-54.2	-176.4	0	0	0	109.9	V114 P115 D116 R120 A121 L122 I164 V167 A168 L171 I202	V114-I118 HydrophobicContact CG1-CB 3.74Å; V114-I118 HydrophobicContact CG1-CG2 3.66Å; P115-I118 HydrophobicContact CG-CD1 4.48Å; P115-I118 WeakPolarHBondContact O-CA 3.42Å; P115-I118 WeakPolarHBondContact O-CB 3.47Å; P115-I118 PolarHBondContact O-N 2.88Å; D116-I118 PolarHBondContact O-N 3.36Å; I118-R120 VanDerWaalsContact C-N 3.32Å; I118-R120 PolarHBondContact O-N 3.06Å; I118-A121 WeakPolarHBondContact O-CB 3.49Å; I118-A121 PolarHBondContact O-N 3.37Å; I118-A121 VanDerWaalsContact O-N 3.13Å; I118-L122 HydrophobicContact CG2-CD1 4.11Å; I118-L122 HydrophobicContact CG2-CG 4.26Å; I118-L122 WeakPolarHBondContact O-CG 3.34Å; I118-L122 PolarHBondContact O-N 3.48Å; I118-I164 HydrophobicContact CD1-CG2 4.16Å; I118-I164 HydrophobicContact CG2-CG1 4.16Å; I118-I164 HydrophobicContact CG2-CG2 4.33Å; I118-V167 HydrophobicContact CD1-CB 3.92Å; I118-V167 HydrophobicContact CD1-CG1 3.65Å; I118-V167 HydrophobicContact CG1-CG1 3.99Å; I118-A168 HydrophobicContact CD1-CB 4.1Å; I118-L171 HydrophobicContact CD1-CD1 4.37Å; I118-L171 HydrophobicContact CG1-CD1 4.21Å; I118-I202 HydrophobicContact CG2-CB 4.41Å
119	L	96.1	Very high	93.3	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-57.4	-43.9	175.4	-68.8	175.4	0	0	0	111.9	L106 W109 I110 V114 P115 D116 A121 L122 S123	L106-L119 HydrophobicContact CD1-CB 4.4Å; W109-L119 HydrophobicContact CB-CD2 3.46Å; W109-L119 VanDerWaalsContact CB-CD2 3.46Å; W109-L119 HydrophobicContact CG-CD2 4.38Å; I110-L119 HydrophobicContact CG1-CD1 3.9Å; V114-L119 HydrophobicContact CB-CD2 3.98Å; V114-L119 HydrophobicContact CB-CG 4.35Å; V114-L119 HydrophobicContact CG1-CD2 3.91Å; V114-L119 HydrophobicContact CG1-CG 4.08Å; P115-L119 PolarHBondContact O-N 3.38Å; D116-L119 PolarHBondContact O-N 2.86Å; D116-L119 VanDerWaalsContact O-N 3.15Å; L119-A121 PolarHBondContact O-N 2.86Å; L119-L122 PolarHBondContact O-N 3.16Å; L119-S123 PolarHBondContact O-N 3.01Å
120	R	95.4	Very high	93.4	Very high	155 Å²	155	53.9 Å²	53.9	59%	0.585	26%	0.264	S	S	*	.	H	α-helix	trans	-59.7	-45	174.5	-67.8	177.5	-169	-175.5	2.9	111.6	D116 I118 L122 S123 D124 Y205	D116-R120 WeakPolarHBondContact O-CG 3.01Å; D116-R120 PolarHBondContact O-N 3.29Å; I118-R120 VanDerWaalsContact C-N 3.32Å; I118-R120 PolarHBondContact O-N 3.06Å; R120-L122 PolarHBondContact O-N 3.4Å; R120-S123 WeakPolarHBondContact O-CB 3.33Å; R120-S123 PolarHBondContact O-N 3.39Å; R120-D124 PolarHBondContact O-N 3.01Å; R120-D124 VanDerWaalsContact O-N 3.16Å; R120-Y205 HydrophobicContact CB-CD2 3.74Å; R120-Y205 HydrophobicContact CB-CE2 3.77Å; R120-Y205 HydrophobicContact CB-CG 4.38Å
121	A	96	Very high	93.4	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-38	176.6	0	0	0	0	0	113	P117 I118 L119 S123 D124 M125 A201 Y205	P117-A121 PolarHBondContact O-N 3.02Å; I118-A121 WeakPolarHBondContact O-CB 3.49Å; I118-A121 PolarHBondContact O-N 3.37Å; I118-A121 VanDerWaalsContact O-N 3.13Å; L119-A121 PolarHBondContact O-N 2.86Å; A121-S123 VanDerWaalsContact C-N 3.32Å; A121-S123 PolarHBondContact O-N 3.01Å; A121-D124 WeakPolarHBondContact O-CB 3.4Å; A121-D124 PolarHBondContact O-N 3.32Å; A121-M125 VanDerWaalsContact O-CG 3.27Å; A121-M125 WeakPolarHBondContact O-CG 3.28Å; A121-M125 PolarHBondContact O-N 3.44Å; A121-A201 WeakPolarHBondContact CB-O 3.48Å; A121-Y205 HydrophobicContact CB-CD2 4.02Å; A121-Y205 HydrophobicContact CB-CE2 4.32Å
122	L	95	Very high	93.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-37.2	175.5	-70.1	171	0	0	0	111.7	W109 V114 I118 L119 R120 M125 K126 F127 L160 I164 I202	W109-L122 HydrophobicContact CD2-CD1 3.82Å; W109-L122 HydrophobicContact CE3-CD1 3.84Å; W109-L122 HydrophobicContact CG-CD1 4.32Å; W109-L122 HydrophobicContact CH2-CD1 4.23Å; W109-L122 HydrophobicContact CH2-CD2 4.41Å; W109-L122 HydrophobicContact CZ2-CD1 4.25Å; W109-L122 HydrophobicContact CZ2-CD2 4.41Å; W109-L122 HydrophobicContact CZ3-CD1 4.04Å; V114-L122 HydrophobicContact CG1-CD1 4.29Å; I118-L122 HydrophobicContact CG2-CD1 4.11Å; I118-L122 HydrophobicContact CG2-CG 4.26Å; I118-L122 WeakPolarHBondContact O-CG 3.34Å; I118-L122 PolarHBondContact O-N 3.48Å; L119-L122 PolarHBondContact O-N 3.16Å; R120-L122 PolarHBondContact O-N 3.4Å; L122-M125 CarbonylContact O-C 3.58Å; L122-M125 PolarHBondContact O-N 2.83Å; L122-K126 PolarHBondContact O-N 3.47Å; L122-K126 VanDerWaalsContact O-N 3.11Å; L122-F127 HydrophobicContact CD2-CB 4.21Å; L122-F127 HydrophobicContact CD2-CD2 4.11Å; L122-F127 PolarHBondContact O-N 2.88Å; L122-L160 HydrophobicContact CD2-CD1 4.01Å; L122-I164 HydrophobicContact CD1-CD1 4.31Å; L122-I202 HydrophobicContact CD2-CG2 4.38Å
123	S	93.5	Very high	93.4	Very high	22 Å²	22	52.2 Å²	52.2	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-48.9	172.7	-164.6	0	0	0	0	112	L102 L119 R120 A121 M125 K126	L102-S123 WeakPolarHBondContact CD2-OG 3.44Å; L119-S123 PolarHBondContact O-N 3.01Å; R120-S123 WeakPolarHBondContact O-CB 3.33Å; R120-S123 PolarHBondContact O-N 3.39Å; A121-S123 VanDerWaalsContact C-N 3.32Å; A121-S123 PolarHBondContact O-N 3.01Å; S123-M125 VanDerWaalsContact C-N 3.26Å; S123-M125 PolarHBondContact O-N 3.29Å; S123-K126 WeakPolarHBondContact O-CA 3.25Å; S123-K126 PolarHBondContact O-N 3.47Å
124	D	93.6	Very high	93.6	Very high	79 Å²	79	49.9 Å²	49.9	42%	0.422	25%	0.249	S	C	.	.	H	α-helix	trans	-59.2	-38.7	176.6	-78.2	-4.4	0	0	0	112.5	R120 A121 K126 K204 Y205	R120-D124 PolarHBondContact O-N 3.01Å; R120-D124 VanDerWaalsContact O-N 3.16Å; A121-D124 WeakPolarHBondContact O-CB 3.4Å; A121-D124 PolarHBondContact O-N 3.32Å; D124-K126 PolarHBondContact O-N 3.02Å; D124-K204 IonicContact OD2-NZ 3.07Å; D124-K204 PolarHBondContact OD2-NZ 3.23Å; D124-Y205 PolarHBondContact OD2-OH 2.85Å
125	M	91.3	Very high	93.6	Very high	47 Å²	47	53.3 Å²	53.3	23%	0.232	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.7	176.2	-66.9	179.5	77.1	0	0	113	A121 L122 S123 F127 A201 I202	A121-M125 VanDerWaalsContact O-CG 3.27Å; A121-M125 WeakPolarHBondContact O-CG 3.28Å; A121-M125 PolarHBondContact O-N 3.44Å; L122-M125 CarbonylContact O-C 3.58Å; L122-M125 PolarHBondContact O-N 2.83Å; S123-M125 VanDerWaalsContact C-N 3.26Å; S123-M125 PolarHBondContact O-N 3.29Å; M125-F127 VanDerWaalsContact C-N 3.26Å; M125-F127 HydrophobicContact CB-CD2 4Å; M125-F127 HydrophobicContact CB-CE2 4.27Å; M125-F127 HydrophobicContact CB-CG 4.17Å; M125-F127 HydrophobicContact CE-CD2 4.13Å; M125-F127 HydrophobicContact CE-CE2 3.5Å; M125-F127 VanDerWaalsContact CE-CE2 3.5Å; M125-F127 HydrophobicContact CE-CZ 4.11Å; M125-F127 WeakPolarHBondContact O-CD1 3.47Å; M125-F127 PolarHBondContact O-N 3.27Å; M125-F127 HydrophobicContact SD-CD2 4.46Å; M125-F127 HydrophobicContact SD-CE2 4.38Å; M125-A201 HydrophobicContact CE-CB 3.88Å; M125-A201 HydrophobicContact CG-CB 4.31Å; M125-A201 HydrophobicContact SD-CB 3.57Å; M125-A201 VanDerWaalsContact SD-CB 3.57Å; M125-I202 HydrophobicContact SD-CG2 3.93Å
126	K	90.4	Very high	93.6	Very high	157 Å²	157	53 Å²	53	68%	0.683	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	33.8	-176.6	-53	179.3	-179.4	-178.9	0	112.8	L122 S123 D124 F128	L122-K126 PolarHBondContact O-N 3.47Å; L122-K126 VanDerWaalsContact O-N 3.11Å; S123-K126 WeakPolarHBondContact O-CA 3.25Å; S123-K126 PolarHBondContact O-N 3.47Å; D124-K126 PolarHBondContact O-N 3.02Å; K126-F128 HydrophobicContact CB-CE2 3.91Å; K126-F128 HydrophobicContact CB-CZ 4.16Å; K126-F128 HydrophobicContact CG-CZ 4.48Å; K126-F128 PolarHBondContact O-N 3.33Å
127	F	89.9	Confident	93.7	Very high	57 Å²	57	49.1 Å²	49.1	25%	0.25	24%	0.244	C	C	.	.			trans	-96.3	78.5	176.5	-69.2	-13.1	0	0	0	110.1	W109 L122 M125 L160	W109-F127 HydrophobicContact CZ2-CB 4.49Å; W109-F127 PolarHBondContact NE1-O 2.95Å; L122-F127 HydrophobicContact CD2-CB 4.21Å; L122-F127 HydrophobicContact CD2-CD2 4.11Å; L122-F127 PolarHBondContact O-N 2.88Å; M125-F127 VanDerWaalsContact C-N 3.26Å; M125-F127 HydrophobicContact CB-CD2 4Å; M125-F127 HydrophobicContact CB-CE2 4.27Å; M125-F127 HydrophobicContact CB-CG 4.17Å; M125-F127 HydrophobicContact CE-CD2 4.13Å; M125-F127 HydrophobicContact CE-CE2 3.5Å; M125-F127 VanDerWaalsContact CE-CE2 3.5Å; M125-F127 HydrophobicContact CE-CZ 4.11Å; M125-F127 WeakPolarHBondContact O-CD1 3.47Å; M125-F127 PolarHBondContact O-N 3.27Å; M125-F127 HydrophobicContact SD-CD2 4.46Å; M125-F127 HydrophobicContact SD-CE2 4.38Å; F127-L160 HydrophobicContact CD2-CD1 3.54Å; F127-L160 HydrophobicContact CE2-CD1 3.67Å
128	F	88.7	Confident	93.7	Very high	80 Å²	80	47.2 Å²	47.2	35%	0.351	23%	0.232	S	C	.	.			trans	-76.1	-27.3	-175	-56.8	-65.9	0	0	0	114.1	L106 W109 K126	L106-F128 HydrophobicContact CD2-CD1 4.47Å; W109-F128 VanDerWaalsContact CD1-O 3.28Å; W109-F128 PolarHBondContact NE1-O 2.88Å; K126-F128 HydrophobicContact CB-CE2 3.91Å; K126-F128 HydrophobicContact CB-CZ 4.16Å; K126-F128 HydrophobicContact CG-CZ 4.48Å; K126-F128 PolarHBondContact O-N 3.33Å
129	H	91.2	Very high	93.7	Very high	122 Å²	122	48.5 Å²	48.5	57%	0.565	24%	0.241	S	C	*	.	S	Bend	trans	-125.7	132.2	-177.2	-57	-77.7	0	0	0	111.5	E108	E108-H129 IonicContact OE1-CE1 3.56Å; E108-H129 PolarHBondContact OE1-CE1 3.02Å; E108-H129 IonicContact OE1-CG 2.76Å; E108-H129 IonicContact OE1-ND1 3.54Å; E108-H129 PolarHBondContact OE1-ND1 3.34Å; E108-H129 IonicContact OE2-ND1 3.5Å
130	P	93.7	Very high	93.6	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.065	24%	0.243	C	C	.	.			trans	-71.3	144.8	173.2	28.8	-32.4	0	0	0	111.3	E108 W109 L112 Q134 Q135	E108-P130 HydrophobicContact CB-CG 3.94Å; W109-P130 HydrophobicContact CD2-CB 3.93Å; W109-P130 HydrophobicContact CD2-CG 4.21Å; W109-P130 HydrophobicContact CE3-CB 3.86Å; W109-P130 HydrophobicContact CE3-CG 4.46Å; W109-P130 HydrophobicContact CH2-CB 3.77Å; W109-P130 VanDerWaalsContact CZ2-CA 3.47Å; W109-P130 HydrophobicContact CZ2-CB 3.8Å; W109-P130 HydrophobicContact CZ3-CB 3.79Å; L112-P130 HydrophobicContact CD1-CB 3.7Å; L112-P130 HydrophobicContact CD1-CG 3.67Å; P130-Q134 VanDerWaalsContact CA-OE1 3.29Å; P130-Q134 HydrophobicContact CB-CB 4.11Å; P130-Q135 HydrophobicContact CB-CG 3.94Å; P130-Q135 HydrophobicContact CG-CG 3.73Å
131	T	92	Very high	93.7	Very high	41 Å²	41	41.3 Å²	41.3	25%	0.252	22%	0.215	S	C	.	.			trans	-76.9	161.9	174.8	68.1	0	0	0	0	111.3	I133 Q134 Q135 S156	T131-I133 VanDerWaalsContact C-N 3.27Å; T131-I133 PolarHBondContact O-N 3.42Å; T131-I133 VanDerWaalsContact O-N 3.17Å; T131-I133 WeakPolarHBondContact OG1-CG2 3.35Å; T131-Q134 WeakPolarHBondContact O-CA 3.37Å; T131-Q134 WeakPolarHBondContact O-CB 3.33Å; T131-Q134 PolarHBondContact O-N 3.36Å; T131-Q134 VanDerWaalsContact OG1-CG 3.31Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.43Å; T131-Q134 PolarHBondContact OG1-NE2 3.32Å; T131-Q134 PolarHBondContact OG1-OE1 3.46Å; T131-Q135 PolarHBondContact O-N 2.89Å; T131-S156 WeakPolarHBondContact CB-O 3.2Å; T131-S156 WeakPolarHBondContact CG2-O 3.13Å; T131-S156 PolarHBondContact OG1-O 3.48Å
132	P	92.6	Very high	93.7	Very high	86 Å²	86	43.3 Å²	43.3	56%	0.558	23%	0.225	S	C	*	.	H	α-helix	trans	-54.4	-38.6	-179.4	-30.6	37.4	0	0	0	114.5	Q134 Q135 A136 L347	P132-Q134 VanDerWaalsContact C-N 3.33Å; P132-Q134 PolarHBondContact O-N 3.39Å; P132-Q135 PolarHBondContact O-N 3.45Å; P132-A136 VanDerWaalsContact O-CB 3.31Å; P132-A136 WeakPolarHBondContact O-CB 3.41Å; P132-A136 PolarHBondContact O-N 3.34Å; P132-L347 HydrophobicContact CB-CD1 3.97Å
133	I	93.2	Very high	93.6	Very high	2 Å²	2	51 Å²	51	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-32.8	176.6	-169.4	61.8	0	0	0	112.1	T131 C137 A152 S156 K158 A161 F301 V345 L347	T131-I133 VanDerWaalsContact C-N 3.27Å; T131-I133 PolarHBondContact O-N 3.42Å; T131-I133 VanDerWaalsContact O-N 3.17Å; T131-I133 WeakPolarHBondContact OG1-CG2 3.35Å; I133-C137 WeakPolarHBondContact O-CB 3.4Å; I133-C137 PolarHBondContact O-N 3.22Å; I133-C137 VanDerWaalsContact O-N 3.15Å; I133-C137 PolarHBondContact O-SG 2.96Å; I133-A152 HydrophobicContact CB-CB 4.14Å; I133-A152 HydrophobicContact CD1-CB 4.1Å; I133-A152 HydrophobicContact CG1-CB 4.01Å; I133-S156 WeakPolarHBondContact CG2-O 3.36Å; I133-K158 HydrophobicContact CG1-CG 4.45Å; I133-K158 HydrophobicContact CG2-CG 4.48Å; I133-A161 HydrophobicContact CG1-CB 4.48Å; I133-F301 HydrophobicContact CD1-CE1 4.3Å; I133-F301 HydrophobicContact CG1-CE1 4.08Å; I133-V345 HydrophobicContact CD1-CB 4.32Å; I133-V345 HydrophobicContact CD1-CG1 3.63Å; I133-L347 HydrophobicContact CB-CD1 3.98Å; I133-L347 HydrophobicContact CD1-CD1 3.99Å
134	Q	95.6	Very high	93.6	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-70.8	-46.5	175.4	-66	160.5	1.7	0	0	110.2	P130 T131 P132 A136 C137 L138 G157 A161	P130-Q134 VanDerWaalsContact CA-OE1 3.29Å; P130-Q134 HydrophobicContact CB-CB 4.11Å; T131-Q134 WeakPolarHBondContact O-CA 3.37Å; T131-Q134 WeakPolarHBondContact O-CB 3.33Å; T131-Q134 PolarHBondContact O-N 3.36Å; T131-Q134 VanDerWaalsContact OG1-CG 3.31Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.43Å; T131-Q134 PolarHBondContact OG1-NE2 3.32Å; T131-Q134 PolarHBondContact OG1-OE1 3.46Å; P132-Q134 VanDerWaalsContact C-N 3.33Å; P132-Q134 PolarHBondContact O-N 3.39Å; Q134-A136 VanDerWaalsContact C-N 3.28Å; Q134-A136 PolarHBondContact O-N 3.31Å; Q134-C137 PolarHBondContact O-N 2.98Å; Q134-L138 HydrophobicContact CB-CD1 3.93Å; Q134-L138 HydrophobicContact CB-CG 4.39Å; Q134-L138 VanDerWaalsContact O-CB 3.25Å; Q134-L138 WeakPolarHBondContact O-CB 3.09Å; Q134-L138 WeakPolarHBondContact O-CG 3.2Å; Q134-L138 PolarHBondContact O-N 2.86Å; Q134-G157 PolarHBondContact NE2-O 3.03Å; Q134-A161 HydrophobicContact CG-CB 4.03Å
135	Q	95.6	Very high	93.5	Very high	81 Å²	81	49.3 Å²	49.3	38%	0.379	25%	0.25	S	S	.	.	H	α-helix	trans	-57.5	-41.3	175.4	-68.8	174.5	-23.2	0	0	112.1	E108 L112 P130 T131 P132 P139	E108-Q135 PolarHBondContact OE2-NE2 2.88Å; L112-Q135 HydrophobicContact CD1-CG 4.14Å; P130-Q135 HydrophobicContact CB-CG 3.94Å; P130-Q135 HydrophobicContact CG-CG 3.73Å; T131-Q135 PolarHBondContact O-N 2.89Å; P132-Q135 PolarHBondContact O-N 3.45Å; Q135-P139 VanDerWaalsContact O-CD 3.28Å; Q135-P139 WeakPolarHBondContact O-CD 3.47Å
136	A	95	Very high	93.7	Very high	32 Å²	32	48.6 Å²	48.6	26%	0.264	25%	0.247	S	C	.	.	H	α-helix	trans	-72.8	-32.8	-178.2	0	0	0	0	0	114	P132 Q134 Q343 V345	P132-A136 VanDerWaalsContact O-CB 3.31Å; P132-A136 WeakPolarHBondContact O-CB 3.41Å; P132-A136 PolarHBondContact O-N 3.34Å; Q134-A136 VanDerWaalsContact C-N 3.28Å; Q134-A136 PolarHBondContact O-N 3.31Å; A136-Q343 PolarHBondContact O-NE2 3.17Å; A136-Q343 PolarHBondContact O-OE1 2.99Å; A136-V345 HydrophobicContact CB-CG1 3.68Å; A136-V345 HydrophobicContact CB-CG2 4.35Å
137	C	96.3	Very high	94	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-97.3	-36.4	-173.8	-63.8	0	0	0	0	113.9	I133 Q134 A141 I148	I133-C137 WeakPolarHBondContact O-CB 3.4Å; I133-C137 PolarHBondContact O-N 3.22Å; I133-C137 VanDerWaalsContact O-N 3.15Å; I133-C137 PolarHBondContact O-SG 2.96Å; Q134-C137 PolarHBondContact O-N 2.98Å; C137-A141 WeakPolarHBondContact O-CB 3.19Å; C137-A141 PolarHBondContact O-N 3.39Å; C137-I148 HydrophobicContact CB-CG2 4.25Å
138	L	97	Very high	94.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-46.3	-166.1	-70.5	176.3	0	0	0	114.3	W109 L112 V114 Q134 S140 A141 I142 I164 P165	W109-L138 HydrophobicContact CE3-CD1 4.2Å; W109-L138 HydrophobicContact CZ3-CD1 3.71Å; L112-L138 HydrophobicContact CB-CB 4.15Å; L112-L138 HydrophobicContact CB-CD1 4.42Å; L112-L138 HydrophobicContact CD1-CD1 3.98Å; V114-L138 HydrophobicContact CG2-CD1 4.33Å; Q134-L138 HydrophobicContact CB-CD1 3.93Å; Q134-L138 HydrophobicContact CB-CG 4.39Å; Q134-L138 VanDerWaalsContact O-CB 3.25Å; Q134-L138 WeakPolarHBondContact O-CB 3.09Å; Q134-L138 WeakPolarHBondContact O-CG 3.2Å; Q134-L138 PolarHBondContact O-N 2.86Å; L138-S140 PolarHBondContact O-N 3.08Å; L138-A141 PolarHBondContact O-N 3.48Å; L138-I142 HydrophobicContact CB-CD1 4.15Å; L138-I142 HydrophobicContact CD2-CD1 4.16Å; L138-I142 WeakPolarHBondContact O-CB 3.33Å; L138-I142 VanDerWaalsContact O-CG1 3.3Å; L138-I142 WeakPolarHBondContact O-CG1 3.33Å; L138-I142 PolarHBondContact O-N 3.38Å; L138-I164 HydrophobicContact CD1-CD1 4.24Å; L138-I164 HydrophobicContact CD2-CB 3.85Å; L138-I164 HydrophobicContact CD2-CD1 4.49Å; L138-I164 HydrophobicContact CD2-CG2 3.99Å; L138-P165 HydrophobicContact CD2-CG 3.71Å
139	P	95.3	Very high	94.6	Very high	27 Å²	27	34.9 Å²	34.9	18%	0.175	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-47.1	-179.1	-24.5	34.9	0	0	0	112.2	L112 Q135 A141 R143	L112-P139 HydrophobicContact CD2-CG 3.7Å; Q135-P139 VanDerWaalsContact O-CD 3.28Å; Q135-P139 WeakPolarHBondContact O-CD 3.47Å; P139-A141 PolarHBondContact O-N 3.48Å; P139-R143 VanDerWaalsContact O-CB 3.29Å; P139-R143 WeakPolarHBondContact O-CB 3.37Å; P139-R143 PolarHBondContact O-N 2.93Å
140	S	95	Very high	94.7	Very high	16 Å²	16	29 Å²	29	11%	0.112	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-37.9	178.1	-63.2	0	0	0	0	113.4	L138 D144 G145 M146 Q343	L138-S140 PolarHBondContact O-N 3.08Å; S140-D144 CarbonylContact O-C 3.55Å; S140-D144 WeakPolarHBondContact O-CB 3.38Å; S140-G145 PolarHBondContact O-N 3.15Å; S140-M146 PolarHBondContact O-N 3.33Å; S140-M146 WeakPolarHBondContact OG-CE 3.36Å; S140-Q343 PolarHBondContact OG-OE1 3.15Å
141	A	96.6	Very high	94.5	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.017	16%	0.157	C	C	.	.	H	α-helix	trans	-75.7	-40.5	-179.4	0	0	0	0	0	111.7	C137 L138 P139 G145 I148 P165 Q297 L299	C137-A141 WeakPolarHBondContact O-CB 3.19Å; C137-A141 PolarHBondContact O-N 3.39Å; L138-A141 PolarHBondContact O-N 3.48Å; P139-A141 PolarHBondContact O-N 3.48Å; A141-G145 WeakPolarHBondContact O-CA 3.39Å; A141-I148 HydrophobicContact CB-CD1 4.34Å; A141-I148 HydrophobicContact CB-CG1 3.98Å; A141-P165 HydrophobicContact CB-CB 3.72Å; A141-P165 HydrophobicContact CB-CG 3.49Å; A141-P165 VanDerWaalsContact CB-CG 3.49Å; A141-Q297 PolarHBondContact O-NE2 3.19Å; A141-L299 HydrophobicContact CB-CD2 4.35Å
142	I	95.9	Very high	94.3	Very high	42 Å²	42	26.7 Å²	26.7	22%	0.215	15%	0.146	C	C	.	.	H	α-helix	trans	-83.7	-59.9	-175.4	-61.1	167.9	0	0	0	111.2	C113 V114 L138 I164 P165 A168	C113-I142 HydrophobicContact CB-CG2 4.14Å; C113-I142 WeakPolarHBondContact O-CG2 3.44Å; V114-I142 HydrophobicContact CG2-CD1 4.24Å; L138-I142 HydrophobicContact CB-CD1 4.15Å; L138-I142 HydrophobicContact CD2-CD1 4.16Å; L138-I142 WeakPolarHBondContact O-CB 3.33Å; L138-I142 VanDerWaalsContact O-CG1 3.3Å; L138-I142 WeakPolarHBondContact O-CG1 3.33Å; L138-I142 PolarHBondContact O-N 3.38Å; I142-I164 HydrophobicContact CD1-CG2 3.95Å; I142-P165 HydrophobicContact CG1-CB 4.17Å; I142-P165 HydrophobicContact CG1-CG 4.13Å; I142-A168 HydrophobicContact CG1-CB 4.47Å; I142-A168 HydrophobicContact CG2-CB 4.3Å
143	R	93.6	Very high	93.8	Very high	161 Å²	161	25.1 Å²	25.1	61%	0.608	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-46.1	-173.2	-178	-169.5	66.6	-149.6	-7.9	111.3	P139	P139-R143 VanDerWaalsContact O-CB 3.29Å; P139-R143 WeakPolarHBondContact O-CB 3.37Å; P139-R143 PolarHBondContact O-N 2.93Å
144	D	92.8	Very high	93.1	Very high	38 Å²	38	25.8 Å²	25.8	20%	0.203	14%	0.135	C	C	.	.	S	Bend	trans	-92.7	-12.1	-170.6	-57.8	-33	0	0	0	112.5	S140 M146 R341	S140-D144 CarbonylContact O-C 3.55Å; S140-D144 WeakPolarHBondContact O-CB 3.38Å; D144-M146 HydrophobicContact CB-CE 4.14Å; D144-M146 HydrophobicContact CB-CG 3.78Å; D144-M146 HydrophobicContact CB-SD 4.39Å; D144-M146 PolarHBondContact O-N 2.81Å; D144-R341 PolarHBondContact O-NH1 3.02Å; D144-R341 VanDerWaalsContact O-NH1 3.08Å; D144-R341 PolarHBondContact O-NH2 3.25Å
145	G	92.8	Very high	92.2	Very high	28 Å²	28	27 Å²	27	29%	0.289	15%	0.15	S	C	.	.			trans	61.6	27	179.4	0	0	0	0	0	113.5	S140 A141 R339	S140-G145 PolarHBondContact O-N 3.15Å; A141-G145 WeakPolarHBondContact O-CA 3.39Å; G145-R339 PolarHBondContact O-NH2 3.38Å
146	M	94.7	Very high	91.6	Very high	33 Å²	33	24.2 Å²	24.2	16%	0.163	14%	0.139	C	C	.	.			trans	-77	150.8	-175.7	-60.7	-159.1	-77	0	0	112.1	S140 D144 Q297 R341	S140-M146 PolarHBondContact O-N 3.33Å; S140-M146 WeakPolarHBondContact OG-CE 3.36Å; D144-M146 HydrophobicContact CB-CE 4.14Å; D144-M146 HydrophobicContact CB-CG 3.78Å; D144-M146 HydrophobicContact CB-SD 4.39Å; D144-M146 PolarHBondContact O-N 2.81Å; M146-Q297 PolarHBondContact O-NE2 2.94Å; M146-R341 HydrophobicContact CG-CG 3.86Å; M146-R341 HydrophobicContact SD-CG 3.8Å
147	D	96.3	Very high	91.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.9	167.2	-66.4	-16	0	0	0	109.9	Q297 T298 L338 R339 R341 R342 Q343	D147-Q297 WeakPolarHBondContact OD1-CA 3.24Å; D147-T298 CarbonylContact C-O 3.6Å; D147-T298 VanDerWaalsContact CA-O 3.24Å; D147-T298 WeakPolarHBondContact CA-O 3.49Å; D147-T298 WeakPolarHBondContact CB-O 3.45Å; D147-T298 PolarHBondContact OD1-N 2.92Å; D147-L338 HydrophobicContact CB-CD2 4.27Å; D147-R339 IonicContact OD1-CZ 2.7Å; D147-R339 VanDerWaalsContact OD1-CZ 3.32Å; D147-R339 IonicContact OD1-NE 3.14Å; D147-R339 PolarHBondContact OD1-NE 2.83Å; D147-R339 VanDerWaalsContact OD1-NE 3.13Å; D147-R339 IonicContact OD1-NH2 3.13Å; D147-R339 PolarHBondContact OD1-NH2 2.81Å; D147-R339 WeakPolarHBondContact OD2-CB 3.49Å; D147-R339 WeakPolarHBondContact OD2-CG 3.35Å; D147-R339 PolarHBondContact OD2-N 3.5Å; D147-R339 IonicContact OD2-NE 3.99Å; D147-R339 PolarHBondContact OD2-NE 3.45Å; D147-R339 VanDerWaalsContact OD2-NE 3.14Å; D147-R341 PolarHBondContact N-O 2.93Å; D147-R342 HydrophobicContact CB-CB 3.95Å; D147-R342 CarbonylContact O-C 3.55Å; D147-R342 VanDerWaalsContact O-CA 3.22Å; D147-R342 WeakPolarHBondContact O-CA 3.48Å; D147-Q343 PolarHBondContact O-N 3.39Å
148	I	96.8	Very high	91	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.7	-179.1	-54.4	-62.2	0	0	0	108.9	C137 A141 T298 L299 A300 F301 Q343	C137-I148 HydrophobicContact CB-CG2 4.25Å; A141-I148 HydrophobicContact CB-CD1 4.34Å; A141-I148 HydrophobicContact CB-CG1 3.98Å; I148-T298 PolarHBondContact N-O 3.32Å; I148-L299 HydrophobicContact CB-CD2 3.56Å; I148-L299 HydrophobicContact CG1-CD2 3.37Å; I148-L299 CarbonylContact O-C 3.59Å; I148-L299 WeakPolarHBondContact O-CA 3.35Å; I148-A300 PolarHBondContact O-N 3.44Å; I148-F301 HydrophobicContact CG2-CE1 4.49Å; I148-F301 HydrophobicContact CG2-CE2 4.35Å; I148-F301 HydrophobicContact CG2-CZ 3.89Å; I148-Q343 HydrophobicContact CD1-CB 3.8Å
149	L	94.6	Very high	90.8	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	103.9	162.3	174.8	66.1	0	0	0	107.7	A300 L305 I329 L338 Q343 L344 V345	L149-A300 CarbonylContact C-O 3.57Å; L149-A300 WeakPolarHBondContact CA-O 3.37Å; L149-A300 HydrophobicContact CD1-CB 3.78Å; L149-L305 HydrophobicContact CD1-CD1 3.84Å; L149-L305 HydrophobicContact CD1-CD2 4.43Å; L149-L305 HydrophobicContact CG-CD1 3.93Å; L149-I329 HydrophobicContact CD2-CG2 4.09Å; L149-L338 HydrophobicContact CB-CD1 4.15Å; L149-Q343 PolarHBondContact N-O 3.21Å; L149-L344 HydrophobicContact CB-CD2 3.84Å; L149-L344 HydrophobicContact CD2-CD2 3.67Å; L149-L344 HydrophobicContact CG-CD2 4.06Å; L149-V345 PolarHBondContact O-N 3.28Å
150	G	92.9	Very high	90.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.6	-170.6	0	0	0	0	0	113.3	A300 F301 S302 V345	G150-A300 PolarHBondContact N-O 2.91Å; G150-F301 CarbonylContact O-C 3.51Å; G150-F301 VanDerWaalsContact O-CA 3.25Å; G150-F301 WeakPolarHBondContact O-CA 3.27Å; G150-S302 PolarHBondContact O-N 3Å; G150-V345 CarbonylContact C-O 3.56Å; G150-V345 VanDerWaalsContact CA-O 3.31Å; G150-V345 WeakPolarHBondContact CA-O 3.46Å
151	A	89.9	Confident	90.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.7	170.7	0	0	0	0	0	109.6	S302 L305 V345 D346 L347 T348	A151-S302 WeakPolarHBondContact CA-O 3.26Å; A151-L305 HydrophobicContact CB-CB 3.89Å; A151-L305 HydrophobicContact CB-CD1 3.63Å; A151-L305 HydrophobicContact CB-CG 4.04Å; A151-V345 PolarHBondContact N-O 2.76Å; A151-D346 HydrophobicContact CB-CB 4.18Å; A151-D346 WeakPolarHBondContact CB-OD1 3.31Å; A151-L347 PolarHBondContact O-N 3.19Å; A151-T348 HydrophobicContact CB-CG2 3.64Å
152	A	87.8	Confident	90.9	Very high	2 Å²	2	23.7 Å²	23.7	2%	0.017	13%	0.133	C	C	.	.			trans	-157.2	155.5	168.8	0	0	0	0	0	109.9	I133 S156 K158 S302 A303 L347	I133-A152 HydrophobicContact CB-CB 4.14Å; I133-A152 HydrophobicContact CD1-CB 4.1Å; I133-A152 HydrophobicContact CG1-CB 4.01Å; A152-S156 VanDerWaalsContact CB-OG 3.26Å; A152-S156 WeakPolarHBondContact CB-OG 3.48Å; A152-K158 HydrophobicContact CB-CD 4.22Å; A152-K158 HydrophobicContact CB-CG 4.28Å; A152-K158 PolarHBondContact O-NZ 2.7Å; A152-S302 PolarHBondContact N-O 2.58Å; A152-A303 VanDerWaalsContact O-CA 3.28Å; A152-A303 WeakPolarHBondContact O-CA 3.4Å; A152-L347 HydrophobicContact CB-CB 4.37Å
153	E	81.9	Confident	90.9	Very high	53 Å²	53	21.8 Å²	21.8	25%	0.248	12%	0.124	C	C	.	.			trans	-57.8	164.9	179.2	63.6	-178	-160.1	0	0	113.5	S156 K158 A354	E153-S156 VanDerWaalsContact O-CB 3.32Å; E153-S156 WeakPolarHBondContact O-CB 3.2Å; E153-S156 PolarHBondContact O-N 3.34Å; E153-S156 PolarHBondContact O-OG 2.8Å; E153-K158 PolarHBondContact O-NZ 3.03Å; E153-A354 WeakPolarHBondContact OE2-CA 3.43Å; E153-A354 PolarHBondContact OE2-N 3.4Å
154	T	78.3	Confident	91.1	Very high	16 Å²	16	14.1 Å²	14.1	10%	0.098	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	137.3	175.5	50.4	0	0	0	0	111	S156 A303 G471	T154-S156 VanDerWaalsContact C-N 3.3Å; T154-A303 HydrophobicContact CG2-CB 4.36Å; T154-G471 WeakPolarHBondContact OG1-CA 3.14Å; T154-G471 PolarHBondContact OG1-O 3.03Å
155	G	77.4	Confident	91.4	Very high	32 Å²	32	12.4 Å²	12.4	33%	0.33	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	0.9	-178.1	0	0	0	0	0	114.9	G157	G155-G157 PolarHBondContact O-N 3.33Å
156	S	82.6	Confident	91.6	Very high	21 Å²	21	11.2 Å²	11.2	15%	0.147	7%	0.073	C	C	.	.	S	Bend	trans	-70.5	-2.8	175.5	55.8	0	0	0	0	114.8	T131 I133 A152 E153 T154 K158	T131-S156 WeakPolarHBondContact CB-O 3.2Å; T131-S156 WeakPolarHBondContact CG2-O 3.13Å; T131-S156 PolarHBondContact OG1-O 3.48Å; I133-S156 WeakPolarHBondContact CG2-O 3.36Å; A152-S156 VanDerWaalsContact CB-OG 3.26Å; A152-S156 WeakPolarHBondContact CB-OG 3.48Å; E153-S156 VanDerWaalsContact O-CB 3.32Å; E153-S156 WeakPolarHBondContact O-CB 3.2Å; E153-S156 PolarHBondContact O-N 3.34Å; E153-S156 PolarHBondContact O-OG 2.8Å; T154-S156 VanDerWaalsContact C-N 3.3Å; S156-K158 WeakPolarHBondContact OG-CG 3.37Å
157	G	87.9	Confident	91.7	Very high	22 Å²	22	9.7 Å²	9.7	23%	0.227	7%	0.066	C	C	.	.	S	Bend	trans	91.3	17.3	178.7	0	0	0	0	0	115.6	Q134 G155 T159 L160 A161	Q134-G157 PolarHBondContact NE2-O 3.03Å; G155-G157 PolarHBondContact O-N 3.33Å; G157-T159 PolarHBondContact O-N 2.81Å; G157-L160 PolarHBondContact O-N 2.87Å; G157-A161 PolarHBondContact O-N 2.9Å
158	K	90.2	Very high	91.8	Very high	20 Å²	20	10.1 Å²	10.1	9%	0.087	7%	0.069	C	C	.	.	H	α-helix	trans	-51.6	-37.6	179.3	-60.1	-167.6	-68	-90.4	0	114.4	I133 A152 E153 S156 L160 A161 F162 F301	I133-K158 HydrophobicContact CG1-CG 4.45Å; I133-K158 HydrophobicContact CG2-CG 4.48Å; A152-K158 HydrophobicContact CB-CD 4.22Å; A152-K158 HydrophobicContact CB-CG 4.28Å; A152-K158 PolarHBondContact O-NZ 2.7Å; E153-K158 PolarHBondContact O-NZ 3.03Å; S156-K158 WeakPolarHBondContact OG-CG 3.37Å; K158-L160 VanDerWaalsContact C-N 3.28Å; K158-L160 PolarHBondContact O-N 3.22Å; K158-A161 WeakPolarHBondContact O-CA 3.48Å; K158-A161 VanDerWaalsContact O-CB 3.32Å; K158-A161 WeakPolarHBondContact O-CB 3.26Å; K158-A161 PolarHBondContact O-N 3.49Å; K158-F162 WeakPolarHBondContact O-CD1 3.25Å; K158-F162 PolarHBondContact O-N 3.03Å; K158-F162 VanDerWaalsContact O-N 3.15Å; K158-F301 HydrophobicContact CB-CD1 4.12Å; K158-F301 HydrophobicContact CD-CB 4.17Å; K158-F301 HydrophobicContact CD-CD1 3.98Å; K158-F301 HydrophobicContact CG-CD1 4.13Å
159	T	93.5	Very high	91.7	Very high	17 Å²	17	10.9 Å²	10.9	10%	0.104	8%	0.078	C	C	.	.	H	α-helix	trans	-54.6	-43.9	-179.5	-49.4	0	0	0	0	112.4	G157 F162 A163 I195 H198	G157-T159 PolarHBondContact O-N 2.81Å; T159-F162 VanDerWaalsContact CA-CE1 3.49Å; T159-F162 HydrophobicContact CG2-CE2 4.41Å; T159-F162 HydrophobicContact CG2-CZ 3.96Å; T159-F162 WeakPolarHBondContact O-CD2 3.31Å; T159-A163 WeakPolarHBondContact O-CB 3.46Å; T159-A163 PolarHBondContact O-N 2.9Å; T159-I195 HydrophobicContact CG2-CG1 4.2Å; T159-H198 HydrophobicContact CG2-CB 3.83Å
160	L	95	Very high	91.6	Very high	6 Å²	6	11.7 Å²	11.7	3%	0.031	8%	0.082	C	C	.	.	H	α-helix	trans	-77	-29	176.4	-67	-177.5	0	0	0	112.6	L122 F127 G157 K158 F162 A163 I164 I202	L122-L160 HydrophobicContact CD2-CD1 4.01Å; F127-L160 HydrophobicContact CD2-CD1 3.54Å; F127-L160 HydrophobicContact CE2-CD1 3.67Å; G157-L160 PolarHBondContact O-N 2.87Å; K158-L160 VanDerWaalsContact C-N 3.28Å; K158-L160 PolarHBondContact O-N 3.22Å; L160-F162 PolarHBondContact O-N 3.07Å; L160-A163 PolarHBondContact O-N 3.01Å; L160-I164 HydrophobicContact CB-CD1 4.01Å; L160-I164 HydrophobicContact CB-CG1 4.37Å; L160-I164 WeakPolarHBondContact O-CB 3.4Å; L160-I164 WeakPolarHBondContact O-CG1 3.12Å; L160-I164 PolarHBondContact O-N 3.26Å; L160-I202 HydrophobicContact CD2-CD1 4.36Å; L160-I202 HydrophobicContact CD2-CG2 3.58Å
161	A	96.1	Very high	91.7	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-60.8	-33.1	177.3	0	0	0	0	0	112.4	I133 Q134 G157 K158 P165 F301	I133-A161 HydrophobicContact CG1-CB 4.48Å; Q134-A161 HydrophobicContact CG-CB 4.03Å; G157-A161 PolarHBondContact O-N 2.9Å; K158-A161 WeakPolarHBondContact O-CA 3.48Å; K158-A161 VanDerWaalsContact O-CB 3.32Å; K158-A161 WeakPolarHBondContact O-CB 3.26Å; K158-A161 PolarHBondContact O-N 3.49Å; A161-P165 VanDerWaalsContact O-CD 3.25Å; A161-P165 WeakPolarHBondContact O-CD 3.49Å; A161-P165 WeakPolarHBondContact O-CG 3.41Å; A161-F301 HydrophobicContact CB-CE1 4.07Å; A161-F301 HydrophobicContact CB-CZ 4Å
162	F	97.1	Very high	91.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-95	-30.5	171	66.3	-113.3	0	0	0	114.4	K158 T159 L160 P165 V166 V184 I195 V261 D263 L299 F301	K158-F162 WeakPolarHBondContact O-CD1 3.25Å; K158-F162 PolarHBondContact O-N 3.03Å; K158-F162 VanDerWaalsContact O-N 3.15Å; T159-F162 VanDerWaalsContact CA-CE1 3.49Å; T159-F162 HydrophobicContact CG2-CE2 4.41Å; T159-F162 HydrophobicContact CG2-CZ 3.96Å; T159-F162 WeakPolarHBondContact O-CD2 3.31Å; L160-F162 PolarHBondContact O-N 3.07Å; F162-P165 WeakPolarHBondContact O-CD 3.37Å; F162-V166 VanDerWaalsContact O-CG2 3.31Å; F162-V166 WeakPolarHBondContact O-CG2 3.12Å; F162-V184 HydrophobicContact CE2-CG1 4.12Å; F162-V184 HydrophobicContact CZ-CG1 4.45Å; F162-I195 HydrophobicContact CE2-CG2 3.94Å; F162-I195 HydrophobicContact CZ-CD1 3.94Å; F162-I195 HydrophobicContact CZ-CG1 4.08Å; F162-I195 HydrophobicContact CZ-CG2 4.07Å; F162-V261 HydrophobicContact CB-CG1 3.76Å; F162-V261 HydrophobicContact CB-CG2 4.25Å; F162-V261 HydrophobicContact CD1-CG1 3.87Å; F162-V261 HydrophobicContact CD2-CB 4.31Å; F162-V261 HydrophobicContact CD2-CG1 3.4Å; F162-V261 HydrophobicContact CD2-CG2 4.12Å; F162-V261 HydrophobicContact CE1-CG1 4.22Å; F162-V261 HydrophobicContact CE2-CG1 3.84Å; F162-V261 HydrophobicContact CG-CG1 3.42Å; F162-V261 VanDerWaalsContact CG-CG1 3.42Å; F162-V261 HydrophobicContact CG-CG2 4.47Å; F162-V261 HydrophobicContact CZ-CG1 4.21Å; F162-D263 HydrophobicContact CE1-CB 3.93Å; F162-D263 HydrophobicContact CZ-CB 4.36Å; F162-L299 HydrophobicContact CB-CB 4.23Å; F162-L299 HydrophobicContact CB-CD1 4.17Å; F162-F301 HydrophobicContact CB-CD2 3.96Å; F162-F301 HydrophobicContact CB-CE2 3.61Å; F162-F301 HydrophobicContact CB-CZ 4.45Å; F162-F301 AromaticContact CD1-CD2 3.93Å; F162-F301 HydrophobicContact CD1-CD2 3.93Å; F162-F301 HydrophobicContact CD1-CE2 4.33Å; F162-F301 HydrophobicContact CD1-CG 4.45Å; F162-F301 HydrophobicContact CG-CD2 4.44Å; F162-F301 HydrophobicContact CG-CE2 4.5Å
163	A	97.6	Very high	91.6	Very high	3 Å²	3	19.5 Å²	19.5	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-74.2	-37.8	-173.7	0	0	0	0	0	112.3	T159 L160 V166 V167 V199 I202	T159-A163 WeakPolarHBondContact O-CB 3.46Å; T159-A163 PolarHBondContact O-N 2.9Å; L160-A163 PolarHBondContact O-N 3.01Å; A163-V166 PolarHBondContact O-N 3.02Å; A163-V167 WeakPolarHBondContact O-CG2 3.44Å; A163-V167 PolarHBondContact O-N 2.95Å; A163-V199 HydrophobicContact CB-CG2 3.86Å; A163-I202 HydrophobicContact CB-CD1 3.64Å
164	I	98	Very high	91.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-48.9	-179.7	-66.2	170.6	0	0	0	111.2	W109 V114 I118 L122 L138 I142 L160 V166 V167 A168 I202	W109-I164 HydrophobicContact CH2-CD1 4.21Å; W109-I164 HydrophobicContact CZ3-CD1 3.68Å; V114-I164 HydrophobicContact CG1-CG2 4.13Å; V114-I164 HydrophobicContact CG2-CG2 4.06Å; I118-I164 HydrophobicContact CD1-CG2 4.16Å; I118-I164 HydrophobicContact CG2-CG1 4.16Å; I118-I164 HydrophobicContact CG2-CG2 4.33Å; L122-I164 HydrophobicContact CD1-CD1 4.31Å; L138-I164 HydrophobicContact CD1-CD1 4.24Å; L138-I164 HydrophobicContact CD2-CB 3.85Å; L138-I164 HydrophobicContact CD2-CD1 4.49Å; L138-I164 HydrophobicContact CD2-CG2 3.99Å; I142-I164 HydrophobicContact CD1-CG2 3.95Å; L160-I164 HydrophobicContact CB-CD1 4.01Å; L160-I164 HydrophobicContact CB-CG1 4.37Å; L160-I164 WeakPolarHBondContact O-CB 3.4Å; L160-I164 WeakPolarHBondContact O-CG1 3.12Å; L160-I164 PolarHBondContact O-N 3.26Å; I164-V166 VanDerWaalsContact C-N 3.27Å; I164-V166 PolarHBondContact O-N 3.3Å; I164-V167 PolarHBondContact O-N 3.49Å; I164-A168 VanDerWaalsContact O-CB 3.23Å; I164-A168 WeakPolarHBondContact O-CB 3.49Å; I164-A168 PolarHBondContact O-N 3.45Å; I164-I202 HydrophobicContact CG1-CD1 4.13Å
165	P	97.6	Very high	91.2	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-37.9	176.9	-26.4	35.4	0	0	0	113.7	L138 A141 I142 A161 F162 G169 L299	L138-P165 HydrophobicContact CD2-CG 3.71Å; A141-P165 HydrophobicContact CB-CB 3.72Å; A141-P165 HydrophobicContact CB-CG 3.49Å; A141-P165 VanDerWaalsContact CB-CG 3.49Å; I142-P165 HydrophobicContact CG1-CB 4.17Å; I142-P165 HydrophobicContact CG1-CG 4.13Å; A161-P165 VanDerWaalsContact O-CD 3.25Å; A161-P165 WeakPolarHBondContact O-CD 3.49Å; A161-P165 WeakPolarHBondContact O-CG 3.41Å; F162-P165 WeakPolarHBondContact O-CD 3.37Å; P165-G169 PolarHBondContact O-N 3.3Å; P165-L299 HydrophobicContact CB-CD1 4.1Å; P165-L299 HydrophobicContact CG-CD1 4.48Å
166	V	97.5	Very high	90.9	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-52.5	176.2	175.2	0	0	0	0	110.7	F162 A163 I164 G169 L170 A182 I232 Y259 V261 L299	F162-V166 VanDerWaalsContact O-CG2 3.31Å; F162-V166 WeakPolarHBondContact O-CG2 3.12Å; A163-V166 PolarHBondContact O-N 3.02Å; I164-V166 VanDerWaalsContact C-N 3.27Å; I164-V166 PolarHBondContact O-N 3.3Å; V166-G169 PolarHBondContact O-N 2.98Å; V166-L170 HydrophobicContact CG1-CD1 4.5Å; V166-L170 WeakPolarHBondContact O-CG 3.4Å; V166-L170 PolarHBondContact O-N 2.97Å; V166-A182 HydrophobicContact CG1-CB 3.47Å; V166-A182 VanDerWaalsContact CG1-CB 3.47Å; V166-I232 HydrophobicContact CG1-CD1 3.95Å; V166-I232 HydrophobicContact CG1-CG1 4.37Å; V166-Y259 HydrophobicContact CG1-CG 4.38Å; V166-Y259 HydrophobicContact CG2-CD1 4.38Å; V166-Y259 HydrophobicContact CG2-CG 4.26Å; V166-V261 HydrophobicContact CG2-CG2 3.66Å; V166-L299 HydrophobicContact CG2-CD1 4.24Å
167	V	97.6	Very high	90.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-43.2	-178.5	175.5	0	0	0	0	111.2	I118 A163 I164 G169 L170 L171 V199 I202 I208 I232	I118-V167 HydrophobicContact CD1-CB 3.92Å; I118-V167 HydrophobicContact CD1-CG1 3.65Å; I118-V167 HydrophobicContact CG1-CG1 3.99Å; A163-V167 WeakPolarHBondContact O-CG2 3.44Å; A163-V167 PolarHBondContact O-N 2.95Å; I164-V167 PolarHBondContact O-N 3.49Å; V167-G169 VanDerWaalsContact C-N 3.34Å; V167-G169 PolarHBondContact O-N 3.35Å; V167-L170 PolarHBondContact O-N 3.48Å; V167-L171 HydrophobicContact CG1-CD1 4.26Å; V167-L171 WeakPolarHBondContact O-CG 3.45Å; V167-L171 PolarHBondContact O-N 2.83Å; V167-V199 HydrophobicContact CG2-CG1 4.31Å; V167-I202 HydrophobicContact CB-CD1 4.44Å; V167-I202 HydrophobicContact CG2-CD1 3.87Å; V167-I202 HydrophobicContact CG2-CG1 4.19Å; V167-I208 HydrophobicContact CG1-CD1 3.8Å; V167-I232 HydrophobicContact CG2-CD1 4.14Å
168	A	96.6	Very high	90.2	Very high	10 Å²	10	44 Å²	44	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-43.4	176.6	0	0	0	0	0	111.7	P115 I118 I142 I164 L170 L171 G172	P115-A168 HydrophobicContact CG-CB 3.73Å; I118-A168 HydrophobicContact CD1-CB 4.1Å; I142-A168 HydrophobicContact CG1-CB 4.47Å; I142-A168 HydrophobicContact CG2-CB 4.3Å; I164-A168 VanDerWaalsContact O-CB 3.23Å; I164-A168 WeakPolarHBondContact O-CB 3.49Å; I164-A168 PolarHBondContact O-N 3.45Å; A168-L170 VanDerWaalsContact C-N 3.34Å; A168-L170 PolarHBondContact O-N 3.44Å; A168-L171 PolarHBondContact O-N 3.19Å; A168-G172 PolarHBondContact O-N 3.35Å
169	G	94.8	Very high	90	Very high	18 Å²	18	43.9 Å²	43.9	19%	0.186	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-33.7	177	0	0	0	0	0	114.1	P165 V166 V167 Y259	P165-G169 PolarHBondContact O-N 3.3Å; V166-G169 PolarHBondContact O-N 2.98Å; V167-G169 VanDerWaalsContact C-N 3.34Å; V167-G169 PolarHBondContact O-N 3.35Å; G169-Y259 WeakPolarHBondContact CA-OH 3.42Å
170	L	94.2	Very high	90	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.105	25%	0.249	C	C	.	.	H	α-helix	trans	-72.2	-36.5	172.5	-65.6	-177.1	0	0	0	112.6	V166 V167 A168 G172 A173 I208 D231 I232 R258 Y259	V166-L170 HydrophobicContact CG1-CD1 4.5Å; V166-L170 WeakPolarHBondContact O-CG 3.4Å; V166-L170 PolarHBondContact O-N 2.97Å; V167-L170 PolarHBondContact O-N 3.48Å; A168-L170 VanDerWaalsContact C-N 3.34Å; A168-L170 PolarHBondContact O-N 3.44Å; L170-G172 VanDerWaalsContact C-N 3.34Å; L170-A173 WeakPolarHBondContact O-CB 3.48Å; L170-A173 PolarHBondContact O-N 2.91Å; L170-I208 HydrophobicContact CB-CD1 3.85Å; L170-I208 HydrophobicContact CB-CG1 4.43Å; L170-I208 HydrophobicContact CD1-CD1 4.31Å; L170-I208 HydrophobicContact CD1-CG2 4.02Å; L170-D231 HydrophobicContact CD1-CB 4.25Å; L170-I232 HydrophobicContact CD1-CD1 3.86Å; L170-I232 HydrophobicContact CD1-CG1 3.57Å; L170-R258 VanDerWaalsContact CD2-NH2 3.32Å; L170-Y259 HydrophobicContact CD2-CD2 4.21Å; L170-Y259 HydrophobicContact CD2-CE2 4.02Å
171	L	93.5	Very high	90	Very high	67 Å²	67	43.2 Å²	43.2	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-65.9	-35.5	175.9	-73.6	170.6	0	0	0	112.7	P115 P117 I118 V167 A168 A173 T206 I208	P115-L171 HydrophobicContact CB-CD1 4.39Å; P117-L171 HydrophobicContact CB-CD1 4.32Å; P117-L171 HydrophobicContact CG-CD1 4.29Å; I118-L171 HydrophobicContact CD1-CD1 4.37Å; I118-L171 HydrophobicContact CG1-CD1 4.21Å; V167-L171 HydrophobicContact CG1-CD1 4.26Å; V167-L171 WeakPolarHBondContact O-CG 3.45Å; V167-L171 PolarHBondContact O-N 2.83Å; A168-L171 PolarHBondContact O-N 3.19Å; L171-A173 PolarHBondContact O-N 2.93Å; L171-T206 HydrophobicContact CD1-CG2 4.01Å; L171-T206 HydrophobicContact CD2-CG2 3.74Å; L171-T206 HydrophobicContact CG-CG2 4.27Å; L171-I208 HydrophobicContact CD2-CD1 4.36Å; L171-I208 HydrophobicContact CG-CD1 4.22Å
172	G	89.8	Confident	90	Very high	67 Å²	67	43.2 Å²	43.2	69%	0.691	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-1.6	176	0	0	0	0	0	114.7	A168 L170	A168-G172 PolarHBondContact O-N 3.35Å; L170-G172 VanDerWaalsContact C-N 3.34Å
173	A	86.9	Confident	90	Very high	32 Å²	32	43.2 Å²	43.2	26%	0.264	25%	0.249	S	C	.	.			trans	-80.7	125.3	-177.7	0	0	0	0	0	111.2	L170 L171 R258	L170-A173 WeakPolarHBondContact O-CB 3.48Å; L170-A173 PolarHBondContact O-N 2.91Å; L171-A173 PolarHBondContact O-N 2.93Å; A173-R258 VanDerWaalsContact CB-NH1 3.27Å; A173-R258 VanDerWaalsContact CB-NH2 3.28Å
174	T	76.7	Confident	90.1	Very high	141 Å²	141	43.2 Å²	43.2	87%	0.865	25%	0.249	S	C	*	.			trans	-80.3	-29.4	175.5	50.1	0	0	0	0	112.7
175	E	75.5	Confident	90	Very high	153 Å²	153	43.2 Å²	43.2	72%	0.715	25%	0.249	S	C	*	.	S	Bend	trans	-101.2	132.7	-175.5	-67.6	177.3	-174	0	0	111.8	Y177	E175-Y177 PolarHBondContact O-N 3.36Å
176	K	70.5	Confident	89.8	Confident	188 Å²	188	43.1 Å²	43.1	82%	0.817	25%	0.249	S	C	*	.			trans	-79.5	115.9	172.7	-164.8	175.6	-176.7	-178.5	0	109.3
177	Y	73.8	Confident	89.3	Confident	61 Å²	61	43.8 Å²	43.8	24%	0.239	25%	0.253	C	S	.	.			trans	-77.1	141.6	-178.5	-142.6	-111.6	0	0	0	111.5	E175 G179 S181 N256 S292	E175-Y177 PolarHBondContact O-N 3.36Å; Y177-G179 PolarHBondContact O-N 3.46Å; Y177-S181 VanDerWaalsContact CB-OG 3.25Å; Y177-S181 WeakPolarHBondContact CB-OG 3.49Å; Y177-N256 HydrophobicContact CE1-CB 4.01Å; Y177-N256 VanDerWaalsContact CE1-O 3.29Å; Y177-N256 WeakPolarHBondContact CE1-O 3.25Å; Y177-N256 VanDerWaalsContact CZ-O 3.29Å; Y177-N256 WeakPolarHBondContact OH-CB 3.29Å; Y177-N256 PolarHBondContact OH-O 2.87Å; Y177-S292 PolarHBondContact OH-OG 3.24Å
178	N	82	Confident	88.7	Confident	115 Å²	115	44.3 Å²	44.3	62%	0.615	26%	0.256	S	S	*	.	S	Bend	trans	-82.6	101.4	173.2	-168.9	15	0	0	0	109.9	N253	N178-N253 WeakPolarHBondContact O-CB 3.39Å; N178-N253 PolarHBondContact O-ND2 2.88Å
179	G	86.6	Confident	88.2	Confident	18 Å²	18	47.6 Å²	47.6	19%	0.186	27%	0.266	C	S	.	.	S	Bend	trans	102.6	-172.5	-176.1	0	0	0	0	0	113.1	Y177 S181	Y177-G179 PolarHBondContact O-N 3.46Å; G179-S181 PolarHBondContact O-N 3.26Å
180	P	93.5	Very high	87.8	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.026	26%	0.26	C	S	.	.			trans	-64.3	129.8	-177.3	26.6	-34.5	0	0	0	111.3	I233 L251 I254 V257	P180-I233 HydrophobicContact CB-CD1 3.65Å; P180-I233 HydrophobicContact CB-CG1 3.9Å; P180-I233 HydrophobicContact CG-CD1 3.72Å; P180-L251 HydrophobicContact CG-CD2 4.42Å; P180-I254 HydrophobicContact CB-CD1 4.25Å; P180-I254 HydrophobicContact CG-CD1 3.48Å; P180-I254 VanDerWaalsContact CG-CD1 3.48Å; P180-V257 WeakPolarHBondContact O-CG1 3.22Å
181	S	93.7	Very high	87.5	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.028	26%	0.256	C	S	.	.	S	Bend	trans	-87	-23.2	174.7	-74.4	0	0	0	0	112.7	Y177 G179 D231 R258 Y259	Y177-S181 VanDerWaalsContact CB-OG 3.25Å; Y177-S181 WeakPolarHBondContact CB-OG 3.49Å; G179-S181 PolarHBondContact O-N 3.26Å; S181-D231 PolarHBondContact N-O 2.77Å; S181-R258 PolarHBondContact O-N 3Å; S181-Y259 PolarHBondContact O-N 3.18Å
182	A	96.4	Very high	87.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.4	-179.6	0	0	0	0	0	112.3	V166 D231 I232 I233 Y259	V166-A182 HydrophobicContact CG1-CB 3.47Å; V166-A182 VanDerWaalsContact CG1-CB 3.47Å; A182-D231 PolarHBondContact N-O 3.47Å; A182-I232 HydrophobicContact CB-CB 4.44Å; A182-I232 HydrophobicContact CB-CG1 4.11Å; A182-I232 HydrophobicContact CB-CG2 4.21Å; A182-I232 WeakPolarHBondContact O-CA 3.48Å; A182-I233 PolarHBondContact O-N 3.13Å; A182-Y259 CarbonylContact C-O 3.58Å; A182-Y259 VanDerWaalsContact CA-O 3.32Å; A182-Y259 WeakPolarHBondContact CA-O 3.47Å; A182-Y259 HydrophobicContact CB-CD2 4.36Å
183	L	97.6	Very high	87.5	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.6	175.2	175.6	59.2	0	0	0	110	L185 I233 A235 I240 I254 V257 Y259 L260 V261 L284	L183-L185 HydrophobicContact CD1-CD2 3.93Å; L183-L185 HydrophobicContact CD1-CG 4.47Å; L183-L185 HydrophobicContact CD2-CD1 4.43Å; L183-L185 HydrophobicContact CD2-CD2 4.11Å; L183-L185 HydrophobicContact CD2-CG 4.23Å; L183-L185 HydrophobicContact CG-CD2 4.06Å; L183-L185 HydrophobicContact CG-CG 4.1Å; L183-I233 CarbonylContact C-O 3.59Å; L183-I233 WeakPolarHBondContact CA-O 3.28Å; L183-I233 HydrophobicContact CD1-CB 4.21Å; L183-I233 HydrophobicContact CD1-CG2 3.97Å; L183-A235 HydrophobicContact CD1-CB 4.47Å; L183-I240 HydrophobicContact CD1-CD1 3.33Å; L183-I240 HydrophobicContact CD2-CD1 4Å; L183-I240 HydrophobicContact CG-CD1 4.32Å; L183-I254 HydrophobicContact CD2-CD1 4.35Å; L183-I254 HydrophobicContact CD2-CG1 4.41Å; L183-V257 HydrophobicContact CB-CG1 4.24Å; L183-Y259 PolarHBondContact N-O 3.31Å; L183-L260 HydrophobicContact CB-CD1 4.24Å; L183-L260 HydrophobicContact CD2-CD1 4.07Å; L183-L260 HydrophobicContact CG-CD1 4.14Å; L183-L260 CarbonylContact O-C 3.59Å; L183-L260 WeakPolarHBondContact O-CA 3.18Å; L183-V261 PolarHBondContact O-N 3.41Å; L183-L284 HydrophobicContact CD2-CD1 4.01Å
184	V	98.2	Very high	87.5	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.2	172.8	-174.5	0	0	0	0	109.3	F162 I195 I232 I233 I234 A235 V261	F162-V184 HydrophobicContact CE2-CG1 4.12Å; F162-V184 HydrophobicContact CZ-CG1 4.45Å; V184-I195 HydrophobicContact CG1-CD1 4.21Å; V184-I195 HydrophobicContact CG1-CG2 4.12Å; V184-I232 HydrophobicContact CG2-CG2 4.28Å; V184-I233 PolarHBondContact N-O 3.1Å; V184-I234 HydrophobicContact CB-CB 4.38Å; V184-I234 HydrophobicContact CB-CG1 3.95Å; V184-I234 HydrophobicContact CB-CG2 4.32Å; V184-I234 HydrophobicContact CG1-CG2 4.46Å; V184-I234 HydrophobicContact CG2-CG1 4.07Å; V184-I234 CarbonylContact O-C 3.57Å; V184-I234 WeakPolarHBondContact O-CA 3.45Å; V184-A235 PolarHBondContact O-N 3.39Å; V184-V261 CarbonylContact C-O 3.58Å; V184-V261 WeakPolarHBondContact CA-O 3.38Å; V184-V261 HydrophobicContact CB-CB 4.15Å; V184-V261 HydrophobicContact CG1-CB 3.92Å; V184-V261 HydrophobicContact CG1-CG1 3.84Å; V184-V261 HydrophobicContact CG2-CB 3.94Å; V184-V261 HydrophobicContact CG2-CG2 4.13Å
185	L	96.7	Very high	88.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.5	177	-62	178.3	0	0	0	110.8	L183 A235 I240 L260 V261 I262 D263 L277 M280	L183-L185 HydrophobicContact CD1-CD2 3.93Å; L183-L185 HydrophobicContact CD1-CG 4.47Å; L183-L185 HydrophobicContact CD2-CD1 4.43Å; L183-L185 HydrophobicContact CD2-CD2 4.11Å; L183-L185 HydrophobicContact CD2-CG 4.23Å; L183-L185 HydrophobicContact CG-CD2 4.06Å; L183-L185 HydrophobicContact CG-CG 4.1Å; L185-A235 WeakPolarHBondContact CA-O 3.45Å; L185-A235 HydrophobicContact CD2-CB 4.38Å; L185-I240 HydrophobicContact CD2-CG2 3.95Å; L185-L260 HydrophobicContact CD1-CD1 4.28Å; L185-V261 PolarHBondContact N-O 3.13Å; L185-I262 HydrophobicContact CB-CG1 4.43Å; L185-D263 PolarHBondContact O-N 3.11Å; L185-L277 HydrophobicContact CD1-CD1 3.84Å; L185-M280 HydrophobicContact CD1-CG 4.47Å
186	T	93	Very high	89.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.			trans	-148.5	146.6	-178.9	158.5	0	0	0	0	110	T188 L191 A192 I195 I234 A235 T236 P237	T186-T188 VanDerWaalsContact C-N 3.33Å; T186-T188 PolarHBondContact O-N 3.5Å; T186-L191 VanDerWaalsContact OG1-CB 3.31Å; T186-L191 WeakPolarHBondContact OG1-CB 3.49Å; T186-L191 WeakPolarHBondContact OG1-CD2 3.26Å; T186-L191 WeakPolarHBondContact OG1-CG 3.35Å; T186-A192 HydrophobicContact CG2-CB 3.54Å; T186-I195 HydrophobicContact CG2-CD1 4.17Å; T186-I234 HydrophobicContact CG2-CG2 4.44Å; T186-A235 PolarHBondContact N-O 3.25Å; T186-A235 VanDerWaalsContact N-O 3.12Å; T186-T236 WeakPolarHBondContact O-CA 3.37Å; T186-P237 WeakPolarHBondContact O-CD 3.48Å
187	P	87.5	Confident	90.4	Very high	17 Å²	17	26.8 Å²	26.8	11%	0.11	13%	0.132	C	C	.	.	S	Bend	trans	-68.2	-27.8	-175.3	25.5	-35.5	0	0	0	114	D263 E264 M268 F274	P187-D263 VanDerWaalsContact CD-O 3.27Å; P187-D263 WeakPolarHBondContact CD-O 3.35Å; P187-E264 HydrophobicContact CG-CB 3.81Å; P187-M268 HydrophobicContact CB-CG 3.75Å; P187-M268 HydrophobicContact CB-SD 4.46Å; P187-M268 HydrophobicContact CG-CG 4.27Å; P187-F274 HydrophobicContact CB-CE2 3.88Å; P187-F274 HydrophobicContact CB-CZ 3.74Å; P187-F274 WeakPolarHBondContact O-CZ 3.48Å
188	T	85	Confident	91.3	Very high	11 Å²	11	24.8 Å²	24.8	7%	0.067	13%	0.125	C	C	.	.			trans	-122.1	149.3	-172.6	71.6	0	0	0	0	113.7	T186 E190 L191 A192 R444	T186-T188 VanDerWaalsContact C-N 3.33Å; T186-T188 PolarHBondContact O-N 3.5Å; T188-E190 VanDerWaalsContact C-N 3.27Å; T188-E190 PolarHBondContact O-N 2.97Å; T188-L191 PolarHBondContact O-N 2.97Å; T188-L191 VanDerWaalsContact OG1-CB 3.24Å; T188-L191 WeakPolarHBondContact OG1-CB 3.32Å; T188-L191 PolarHBondContact OG1-N 3.03Å; T188-A192 PolarHBondContact O-N 3.16Å; T188-R444 HydrophobicContact CG2-CB 3.71Å; T188-R444 WeakPolarHBondContact CG2-O 3.43Å; T188-R444 PolarHBondContact OG1-O 3.17Å
189	R	86.9	Confident	92.1	Very high	79 Å²	79	19.4 Å²	19.4	30%	0.298	10%	0.096	S	C	.	.	H	α-helix	trans	-66	-34.9	-179.9	-55.3	174.3	179.4	170.9	-0.2	110.9	L193 V214 G215 T236 Q418	R189-L193 PolarHBondContact O-N 3.09Å; R189-L193 VanDerWaalsContact O-N 3.12Å; R189-V214 HydrophobicContact CB-CB 4.03Å; R189-V214 HydrophobicContact CB-CG1 4.17Å; R189-V214 HydrophobicContact CB-CG2 4.49Å; R189-V214 HydrophobicContact CG-CB 3.97Å; R189-V214 HydrophobicContact CG-CG1 4.42Å; R189-G215 VanDerWaalsContact CD-O 3.22Å; R189-G215 WeakPolarHBondContact CD-O 3.39Å; R189-G215 VanDerWaalsContact CZ-O 3.25Å; R189-G215 VanDerWaalsContact NE-C 3.34Å; R189-G215 PolarHBondContact NE-O 2.87Å; R189-G215 VanDerWaalsContact NE-O 3.11Å; R189-G215 PolarHBondContact NH1-O 3.37Å; R189-T236 HydrophobicContact CG-CG2 4.05Å; R189-Q418 VanDerWaalsContact CD-CD 3.5Å
190	E	85.2	Confident	92.6	Very high	9 Å²	9	21.8 Å²	21.8	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-71	-42.7	177.9	-63.5	73	-161.7	0	0	112	T188 A192 L193 Q194 Q418 R421 F422 L446	T188-E190 VanDerWaalsContact C-N 3.27Å; T188-E190 PolarHBondContact O-N 2.97Å; E190-A192 VanDerWaalsContact C-N 3.31Å; E190-A192 PolarHBondContact O-N 3.15Å; E190-L193 PolarHBondContact O-N 3.46Å; E190-Q194 PolarHBondContact O-N 3.39Å; E190-Q418 PolarHBondContact OE1-NE2 3.45Å; E190-R421 IonicContact OE1-CZ 3.98Å; E190-R421 IonicContact OE1-NE 2.7Å; E190-R421 PolarHBondContact OE1-NE 3.1Å; E190-R421 IonicContact OE1-NH2 3.93Å; E190-R421 PolarHBondContact OE1-NH2 3.37Å; E190-R421 IonicContact OE2-NH2 2.65Å; E190-R421 PolarHBondContact OE2-NH2 3.06Å; E190-F422 HydrophobicContact CG-CD1 4.48Å; E190-F422 HydrophobicContact CG-CE1 4.09Å; E190-L446 HydrophobicContact CB-CD2 3.42Å; E190-L446 VanDerWaalsContact CB-CD2 3.42Å; E190-L446 HydrophobicContact CG-CD2 3.7Å
191	L	88	Confident	92.7	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-63.9	-38.5	173.7	-179.8	53.2	0	0	0	111.1	T186 T188 L193 Q194 I195 E264 G445	T186-L191 VanDerWaalsContact OG1-CB 3.31Å; T186-L191 WeakPolarHBondContact OG1-CB 3.49Å; T186-L191 WeakPolarHBondContact OG1-CD2 3.26Å; T186-L191 WeakPolarHBondContact OG1-CG 3.35Å; T188-L191 PolarHBondContact O-N 2.97Å; T188-L191 VanDerWaalsContact OG1-CB 3.24Å; T188-L191 WeakPolarHBondContact OG1-CB 3.32Å; T188-L191 PolarHBondContact OG1-N 3.03Å; L191-L193 VanDerWaalsContact C-N 3.34Å; L191-L193 PolarHBondContact O-N 3.24Å; L191-Q194 PolarHBondContact O-N 2.76Å; L191-I195 HydrophobicContact CD1-CD1 4Å; L191-I195 HydrophobicContact CD1-CG1 3.98Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 HydrophobicContact CG-CG1 4.33Å; L191-I195 VanDerWaalsContact O-CG1 3.26Å; L191-I195 WeakPolarHBondContact O-CG1 3.39Å; L191-I195 PolarHBondContact O-N 2.93Å; L191-E264 HydrophobicContact CD2-CG 4.01Å; L191-G445 WeakPolarHBondContact CB-O 3.32Å; L191-G445 WeakPolarHBondContact CD1-O 3.45Å
192	A	92.3	Very high	92.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.1	-43.6	174.2	0	0	0	0	0	112.5	T186 T188 E190 K196 L212 V214 I234	T186-A192 HydrophobicContact CG2-CB 3.54Å; T188-A192 PolarHBondContact O-N 3.16Å; E190-A192 VanDerWaalsContact C-N 3.31Å; E190-A192 PolarHBondContact O-N 3.15Å; A192-K196 WeakPolarHBondContact O-CB 3.46Å; A192-K196 PolarHBondContact O-N 3.23Å; A192-L212 HydrophobicContact CB-CD1 3.57Å; A192-V214 HydrophobicContact CB-CG1 3.65Å; A192-I234 HydrophobicContact CB-CG2 4Å; A192-I234 WeakPolarHBondContact O-CG2 3.41Å
193	L	90.7	Very high	92.9	Very high	49 Å²	49	23.2 Å²	23.2	26%	0.257	12%	0.12	S	C	.	.	H	α-helix	trans	-64.2	-42.5	176.3	-179.4	61.9	0	0	0	111.8	R189 E190 L191 K196 Q197 L212 F422	R189-L193 PolarHBondContact O-N 3.09Å; R189-L193 VanDerWaalsContact O-N 3.12Å; E190-L193 PolarHBondContact O-N 3.46Å; L191-L193 VanDerWaalsContact C-N 3.34Å; L191-L193 PolarHBondContact O-N 3.24Å; L193-K196 WeakPolarHBondContact O-CB 3.12Å; L193-K196 PolarHBondContact O-N 2.74Å; L193-Q197 WeakPolarHBondContact O-CG 3.35Å; L193-Q197 PolarHBondContact O-N 3.3Å; L193-L212 HydrophobicContact CB-CD2 4.36Å; L193-L212 HydrophobicContact CD1-CD2 3.87Å; L193-F422 HydrophobicContact CD2-CD1 3.93Å; L193-F422 HydrophobicContact CD2-CE1 3.71Å; L193-F422 HydrophobicContact CD2-CE2 4.36Å; L193-F422 HydrophobicContact CD2-CG 4.35Å; L193-F422 HydrophobicContact CD2-CZ 3.95Å
194	Q	87.8	Confident	92.9	Very high	21 Å²	21	29.2 Å²	29.2	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-47.2	177.7	-177.7	-147.8	-34.5	0	0	111.9	E190 L191 K196 Q197 H198 G445 D447	E190-Q194 PolarHBondContact O-N 3.39Å; L191-Q194 PolarHBondContact O-N 2.76Å; Q194-K196 PolarHBondContact O-N 3.16Å; Q194-Q197 WeakPolarHBondContact O-CB 3.43Å; Q194-Q197 PolarHBondContact O-N 3.09Å; Q194-Q197 VanDerWaalsContact O-N 3.1Å; Q194-H198 PolarHBondContact O-N 2.93Å; Q194-G445 PolarHBondContact OE1-O 3.36Å; Q194-D447 HydrophobicContact CG-CB 3.93Å; Q194-D447 PolarHBondContact NE2-OD2 2.93Å; Q194-D447 VanDerWaalsContact NE2-OD2 3.13Å
195	I	94.2	Very high	92.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-43.4	174.8	-66.3	168.7	0	0	0	108.9	T159 F162 V184 T186 L191 Q197 H198 V199 I234 D263	T159-I195 HydrophobicContact CG2-CG1 4.2Å; F162-I195 HydrophobicContact CE2-CG2 3.94Å; F162-I195 HydrophobicContact CZ-CD1 3.94Å; F162-I195 HydrophobicContact CZ-CG1 4.08Å; F162-I195 HydrophobicContact CZ-CG2 4.07Å; V184-I195 HydrophobicContact CG1-CD1 4.21Å; V184-I195 HydrophobicContact CG1-CG2 4.12Å; T186-I195 HydrophobicContact CG2-CD1 4.17Å; L191-I195 HydrophobicContact CD1-CD1 4Å; L191-I195 HydrophobicContact CD1-CG1 3.98Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 HydrophobicContact CG-CG1 4.33Å; L191-I195 VanDerWaalsContact O-CG1 3.26Å; L191-I195 WeakPolarHBondContact O-CG1 3.39Å; L191-I195 PolarHBondContact O-N 2.93Å; I195-Q197 VanDerWaalsContact C-N 3.32Å; I195-Q197 PolarHBondContact O-N 3.16Å; I195-H198 PolarHBondContact O-N 3.35Å; I195-V199 HydrophobicContact CG2-CG2 3.79Å; I195-V199 WeakPolarHBondContact O-CB 3.28Å; I195-V199 WeakPolarHBondContact O-CG2 3.49Å; I195-V199 PolarHBondContact O-N 3.12Å; I195-I234 HydrophobicContact CB-CD1 4.47Å; I195-I234 HydrophobicContact CB-CG2 4.16Å; I195-I234 HydrophobicContact CG2-CD1 3.83Å; I195-I234 HydrophobicContact CG2-CG1 4.18Å; I195-I234 HydrophobicContact CG2-CG2 4.12Å; I195-D263 HydrophobicContact CD1-CB 4.4Å
196	K	95.9	Very high	92.7	Very high	50 Å²	50	34.9 Å²	34.9	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-57.3	-44.4	176	169.1	165.9	174.7	165.9	0	112.2	A192 L193 Q194 T200 I210 L212 I234	A192-K196 WeakPolarHBondContact O-CB 3.46Å; A192-K196 PolarHBondContact O-N 3.23Å; L193-K196 WeakPolarHBondContact O-CB 3.12Å; L193-K196 PolarHBondContact O-N 2.74Å; Q194-K196 PolarHBondContact O-N 3.16Å; K196-T200 VanDerWaalsContact O-CB 3.22Å; K196-T200 WeakPolarHBondContact O-CB 3.46Å; K196-T200 PolarHBondContact O-N 2.82Å; K196-T200 PolarHBondContact O-OG1 2.81Å; K196-I210 HydrophobicContact CG-CG2 4.2Å; K196-L212 HydrophobicContact CD-CB 3.66Å; K196-L212 HydrophobicContact CD-CD2 4.28Å; K196-L212 HydrophobicContact CD-CG 4.45Å; K196-I234 HydrophobicContact CB-CD1 3.74Å
197	Q	93.4	Very high	92.8	Very high	115 Å²	115	42.6 Å²	42.6	54%	0.537	21%	0.211	S	C	.	.	H	α-helix	trans	-61.1	-45.2	177.6	-69.4	170.8	-10	0	0	111.5	L193 Q194 I195 T200 A201	L193-Q197 WeakPolarHBondContact O-CG 3.35Å; L193-Q197 PolarHBondContact O-N 3.3Å; Q194-Q197 WeakPolarHBondContact O-CB 3.43Å; Q194-Q197 PolarHBondContact O-N 3.09Å; Q194-Q197 VanDerWaalsContact O-N 3.1Å; I195-Q197 VanDerWaalsContact C-N 3.32Å; I195-Q197 PolarHBondContact O-N 3.16Å; Q197-T200 PolarHBondContact O-N 2.91Å; Q197-A201 WeakPolarHBondContact O-CB 3.19Å; Q197-A201 PolarHBondContact O-N 2.88Å
198	H	93.4	Very high	93.1	Very high	19 Å²	19	43 Å²	43	9%	0.088	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-46.3	178.9	-77.1	-159.2	0	0	0	112.3	T159 Q194 I195 T200 A201 I202 D447	T159-H198 HydrophobicContact CG2-CB 3.83Å; Q194-H198 PolarHBondContact O-N 2.93Å; I195-H198 PolarHBondContact O-N 3.35Å; H198-T200 VanDerWaalsContact C-N 3.32Å; H198-T200 PolarHBondContact O-N 2.87Å; H198-A201 PolarHBondContact O-N 3Å; H198-I202 PolarHBondContact O-N 2.86Å; H198-D447 IonicContact CE1-OD2 3.08Å
199	V	97.5	Very high	93.6	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-40.3	178	-178.3	0	0	0	0	110.4	A163 V167 I195 A201 I202 A203 I210 I232 I234	A163-V199 HydrophobicContact CB-CG2 3.86Å; V167-V199 HydrophobicContact CG2-CG1 4.31Å; I195-V199 HydrophobicContact CG2-CG2 3.79Å; I195-V199 WeakPolarHBondContact O-CB 3.28Å; I195-V199 WeakPolarHBondContact O-CG2 3.49Å; I195-V199 PolarHBondContact O-N 3.12Å; V199-A201 PolarHBondContact O-N 2.87Å; V199-I202 VanDerWaalsContact O-CG1 3.29Å; V199-I202 WeakPolarHBondContact O-CG1 3.42Å; V199-I202 PolarHBondContact O-N 2.95Å; V199-A203 WeakPolarHBondContact O-CB 3.36Å; V199-A203 PolarHBondContact O-N 3.37Å; V199-I210 HydrophobicContact CB-CD1 4.24Å; V199-I210 HydrophobicContact CG1-CD1 3.67Å; V199-I210 HydrophobicContact CG1-CG1 4.01Å; V199-I232 HydrophobicContact CG1-CD1 3.81Å; V199-I234 HydrophobicContact CB-CD1 4.29Å; V199-I234 HydrophobicContact CG2-CD1 4.14Å
200	T	97.6	Very high	94.1	Very high	67 Å²	67	45 Å²	45	41%	0.411	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-39.7	176.4	-54.4	0	0	0	0	111.4	K196 Q197 H198 A203 K204 I210	K196-T200 VanDerWaalsContact O-CB 3.22Å; K196-T200 WeakPolarHBondContact O-CB 3.46Å; K196-T200 PolarHBondContact O-N 2.82Å; K196-T200 PolarHBondContact O-OG1 2.81Å; Q197-T200 PolarHBondContact O-N 2.91Å; H198-T200 VanDerWaalsContact C-N 3.32Å; H198-T200 PolarHBondContact O-N 2.87Å; T200-A203 PolarHBondContact O-N 2.72Å; T200-K204 PolarHBondContact O-N 2.95Å; T200-I210 VanDerWaalsContact CA-CD1 3.43Å
201	A	96.3	Very high	94.7	Very high	33 Å²	33	44.7 Å²	44.7	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-46.2	178.2	0	0	0	0	0	111.6	A121 M125 Q197 H198 V199 A203 K204	A121-A201 WeakPolarHBondContact CB-O 3.48Å; M125-A201 HydrophobicContact CE-CB 3.88Å; M125-A201 HydrophobicContact CG-CB 4.31Å; M125-A201 HydrophobicContact SD-CB 3.57Å; M125-A201 VanDerWaalsContact SD-CB 3.57Å; Q197-A201 WeakPolarHBondContact O-CB 3.19Å; Q197-A201 PolarHBondContact O-N 2.88Å; H198-A201 PolarHBondContact O-N 3Å; V199-A201 PolarHBondContact O-N 2.87Å; A201-A203 VanDerWaalsContact C-N 3.31Å; A201-A203 PolarHBondContact O-N 2.92Å; A201-K204 WeakPolarHBondContact O-CB 2.84Å; A201-K204 PolarHBondContact O-N 2.81Å
202	I	96.7	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-72.4	-23.7	178.3	67	170.4	0	0	0	113.5	I118 L122 M125 L160 A163 I164 V167 H198 V199 K204	I118-I202 HydrophobicContact CG2-CB 4.41Å; L122-I202 HydrophobicContact CD2-CG2 4.38Å; M125-I202 HydrophobicContact SD-CG2 3.93Å; L160-I202 HydrophobicContact CD2-CD1 4.36Å; L160-I202 HydrophobicContact CD2-CG2 3.58Å; A163-I202 HydrophobicContact CB-CD1 3.64Å; I164-I202 HydrophobicContact CG1-CD1 4.13Å; V167-I202 HydrophobicContact CB-CD1 4.44Å; V167-I202 HydrophobicContact CG2-CD1 3.87Å; V167-I202 HydrophobicContact CG2-CG1 4.19Å; H198-I202 PolarHBondContact O-N 2.86Å; V199-I202 VanDerWaalsContact O-CG1 3.29Å; V199-I202 WeakPolarHBondContact O-CG1 3.42Å; V199-I202 PolarHBondContact O-N 2.95Å; I202-K204 VanDerWaalsContact C-N 3.31Å
203	A	97	Very high	95.3	Very high	6 Å²	6	45.3 Å²	45.3	5%	0.05	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	3.6	176.3	0	0	0	0	0	113.3	V199 T200 A201 Y205 T206 I210	V199-A203 WeakPolarHBondContact O-CB 3.36Å; V199-A203 PolarHBondContact O-N 3.37Å; T200-A203 PolarHBondContact O-N 2.72Å; A201-A203 VanDerWaalsContact C-N 3.31Å; A201-A203 PolarHBondContact O-N 2.92Å; A203-Y205 PolarHBondContact O-N 3.49Å; A203-Y205 VanDerWaalsContact O-N 3.11Å; A203-T206 WeakPolarHBondContact O-CB 3.26Å; A203-T206 PolarHBondContact O-N 3.09Å; A203-T206 PolarHBondContact O-OG1 3.34Å; A203-I210 HydrophobicContact CB-CD1 4.05Å
204	K	97	Very high	95.4	Very high	128 Å²	128	43 Å²	43	56%	0.557	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-37.6	-174.4	178.9	-175.4	173.7	-166.7	0	113.9	D124 T200 A201 I202 T206	D124-K204 IonicContact OD2-NZ 3.07Å; D124-K204 PolarHBondContact OD2-NZ 3.23Å; T200-K204 PolarHBondContact O-N 2.95Å; A201-K204 WeakPolarHBondContact O-CB 2.84Å; A201-K204 PolarHBondContact O-N 2.81Å; I202-K204 VanDerWaalsContact C-N 3.31Å; K204-T206 VanDerWaalsContact C-N 3.32Å
205	Y	96.9	Very high	95.5	Very high	99 Å²	99	42.4 Å²	42.4	39%	0.388	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	27.7	-178.7	-63.1	-74.7	0	0	0	113	R120 A121 D124 A203	R120-Y205 HydrophobicContact CB-CD2 3.74Å; R120-Y205 HydrophobicContact CB-CE2 3.77Å; R120-Y205 HydrophobicContact CB-CG 4.38Å; A121-Y205 HydrophobicContact CB-CD2 4.02Å; A121-Y205 HydrophobicContact CB-CE2 4.32Å; D124-Y205 PolarHBondContact OD2-OH 2.85Å; A203-Y205 PolarHBondContact O-N 3.49Å; A203-Y205 VanDerWaalsContact O-N 3.11Å
206	T	95.3	Very high	95.1	Very high	22 Å²	22	44.2 Å²	44.2	14%	0.135	23%	0.232	C	C	.	.	S	Bend	trans	-135.8	165.2	-177.4	80.1	0	0	0	0	110	P117 L171 A203 K204 I208	P117-T206 HydrophobicContact CB-CG2 4.03Å; L171-T206 HydrophobicContact CD1-CG2 4.01Å; L171-T206 HydrophobicContact CD2-CG2 3.74Å; L171-T206 HydrophobicContact CG-CG2 4.27Å; A203-T206 WeakPolarHBondContact O-CB 3.26Å; A203-T206 PolarHBondContact O-N 3.09Å; A203-T206 PolarHBondContact O-OG1 3.34Å; K204-T206 VanDerWaalsContact C-N 3.32Å; T206-I208 VanDerWaalsContact C-N 3.29Å; T206-I208 HydrophobicContact CG2-CD1 4.43Å; T206-I208 WeakPolarHBondContact OG1-CB 2.84Å; T206-I208 PolarHBondContact OG1-N 3.32Å
207	N	93.3	Very high	94.6	Very high	163 Å²	163	44.3 Å²	44.3	87%	0.872	23%	0.234	S	C	*	.			trans	-91.8	12.4	174.7	-66.1	-28.7	0	0	0	113.3	K209	N207-K209 PolarHBondContact O-N 3.02Å
208	I	95.6	Very high	94.4	Very high	26 Å²	26	42 Å²	42	13%	0.133	23%	0.23	C	C	.	.			trans	-72	123.8	-175.4	-64.8	166.9	0	0	0	109.8	V167 L170 L171 T206 D231 I232	V167-I208 HydrophobicContact CG1-CD1 3.8Å; L170-I208 HydrophobicContact CB-CD1 3.85Å; L170-I208 HydrophobicContact CB-CG1 4.43Å; L170-I208 HydrophobicContact CD1-CD1 4.31Å; L170-I208 HydrophobicContact CD1-CG2 4.02Å; L171-I208 HydrophobicContact CD2-CD1 4.36Å; L171-I208 HydrophobicContact CG-CD1 4.22Å; T206-I208 VanDerWaalsContact C-N 3.29Å; T206-I208 HydrophobicContact CG2-CD1 4.43Å; T206-I208 WeakPolarHBondContact OG1-CB 2.84Å; T206-I208 PolarHBondContact OG1-N 3.32Å; I208-D231 HydrophobicContact CG2-CB 4.12Å; I208-I232 HydrophobicContact CG2-CD1 3.68Å; I208-I232 HydrophobicContact CG2-CG1 3.84Å
209	K	95.5	Very high	94.2	Very high	107 Å²	107	43.4 Å²	43.4	47%	0.465	24%	0.24	S	C	.	.			trans	-94.5	135.2	179.9	-64.7	176	-175.1	172.3	0	111	N207 K228 P230 D231 I232	N207-K209 PolarHBondContact O-N 3.02Å; K209-K228 WeakPolarHBondContact CD-O 3.42Å; K209-K228 PolarHBondContact NZ-O 3.42Å; K209-K228 VanDerWaalsContact NZ-O 3.15Å; K209-P230 CarbonylContact O-C 3.47Å; K209-D231 PolarHBondContact N-OD2 3.4Å; K209-D231 PolarHBondContact O-N 2.83Å; K209-I232 PolarHBondContact O-N 3.35Å; K209-I232 VanDerWaalsContact O-N 3.08Å
210	I	97.6	Very high	93.9	Very high	25 Å²	25	49.3 Å²	49.3	13%	0.128	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.8	-174.3	-57.6	149.5	0	0	0	111.2	K196 V199 T200 A203 I232 I234	K196-I210 HydrophobicContact CG-CG2 4.2Å; V199-I210 HydrophobicContact CB-CD1 4.24Å; V199-I210 HydrophobicContact CG1-CD1 3.67Å; V199-I210 HydrophobicContact CG1-CG1 4.01Å; T200-I210 VanDerWaalsContact CA-CD1 3.43Å; A203-I210 HydrophobicContact CB-CD1 4.05Å; I210-I232 CarbonylContact C-O 3.55Å; I210-I232 WeakPolarHBondContact CA-O 3.43Å; I210-I232 HydrophobicContact CG1-CB 4.28Å; I210-I232 HydrophobicContact CG1-CD1 4.41Å; I210-I234 HydrophobicContact CG2-CD1 3.68Å; I210-I234 HydrophobicContact CG2-CG1 4.45Å
211	G	96.5	Very high	93.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	151	175.7	0	0	0	0	0	113.3	L225 I232 I234	G211-L225 VanDerWaalsContact CA-CD2 3.45Å; G211-I232 PolarHBondContact N-O 3.03Å; G211-I234 PolarHBondContact O-N 2.73Å
212	L	96.7	Very high	93.5	Very high	18 Å²	18	52.4 Å²	52.4	9%	0.094	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	122.9	173.8	178.7	67.7	0	0	0	109.3	A192 L193 K196 V214 I234	A192-L212 HydrophobicContact CB-CD1 3.57Å; L193-L212 HydrophobicContact CB-CD2 4.36Å; L193-L212 HydrophobicContact CD1-CD2 3.87Å; K196-L212 HydrophobicContact CD-CB 3.66Å; K196-L212 HydrophobicContact CD-CD2 4.28Å; K196-L212 HydrophobicContact CD-CG 4.45Å; L212-V214 HydrophobicContact CD1-CG1 3.78Å; L212-V214 HydrophobicContact CD2-CG2 4.42Å; L212-V214 HydrophobicContact CG-CG1 4.09Å; L212-V214 HydrophobicContact CG-CG2 4.35Å; L212-I234 CarbonylContact C-O 3.57Å; L212-I234 WeakPolarHBondContact CA-O 3.31Å; L212-I234 HydrophobicContact CD1-CB 4.45Å; L212-I234 HydrophobicContact CD1-CG2 4.36Å
213	L	96.4	Very high	93.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	104.7	177.4	-57.1	178.9	0	0	0	111.2	Q222 L226 I233 I234 A235 T236 R239 I240 L243 L251	L213-Q222 HydrophobicContact CD2-CB 3.93Å; L213-Q222 HydrophobicContact CD2-CG 4.38Å; L213-L226 HydrophobicContact CD1-CD1 4.47Å; L213-L226 HydrophobicContact CD1-CD2 4.23Å; L213-L226 HydrophobicContact CD2-CD1 4.15Å; L213-L226 HydrophobicContact CD2-CD2 4.19Å; L213-L226 HydrophobicContact CD2-CG 4.12Å; L213-I233 HydrophobicContact CD1-CD1 4.43Å; L213-I233 HydrophobicContact CD1-CG2 3.64Å; L213-I233 HydrophobicContact CG-CG2 3.97Å; L213-I234 PolarHBondContact N-O 2.82Å; L213-A235 HydrophobicContact CB-CB 3.9Å; L213-A235 WeakPolarHBondContact O-CA 3.4Å; L213-A235 WeakPolarHBondContact O-CB 3.34Å; L213-T236 PolarHBondContact O-N 2.95Å; L213-T236 VanDerWaalsContact O-N 3.15Å; L213-R239 HydrophobicContact CB-CG 4.16Å; L213-I240 HydrophobicContact CD1-CB 4.45Å; L213-I240 HydrophobicContact CD1-CD1 4.46Å; L213-I240 HydrophobicContact CD1-CG1 4.23Å; L213-L243 HydrophobicContact CD1-CD1 3.97Å; L213-L243 HydrophobicContact CD2-CD1 4.05Å; L213-L243 HydrophobicContact CG-CD1 4.46Å; L213-L251 HydrophobicContact CD1-CD1 4.41Å
214	V	93.6	Very high	93	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.316	C	S	.	.			trans	-137.2	150.3	-177.5	-64	0	0	0	0	112	R189 A192 L212 L217 Q222 T236	R189-V214 HydrophobicContact CB-CB 4.03Å; R189-V214 HydrophobicContact CB-CG1 4.17Å; R189-V214 HydrophobicContact CB-CG2 4.49Å; R189-V214 HydrophobicContact CG-CB 3.97Å; R189-V214 HydrophobicContact CG-CG1 4.42Å; A192-V214 HydrophobicContact CB-CG1 3.65Å; L212-V214 HydrophobicContact CD1-CG1 3.78Å; L212-V214 HydrophobicContact CD2-CG2 4.42Å; L212-V214 HydrophobicContact CG-CG1 4.09Å; L212-V214 HydrophobicContact CG-CG2 4.35Å; V214-L217 HydrophobicContact CG2-CD1 3.46Å; V214-L217 VanDerWaalsContact CG2-CD1 3.46Å; V214-L217 HydrophobicContact CG2-CG 4.02Å; V214-Q222 VanDerWaalsContact N-OE1 3.13Å; V214-Q222 PolarHBondContact O-NE2 2.99Å; V214-T236 HydrophobicContact CG1-CG2 4.13Å
215	G	89	Confident	92.9	Very high	8 Å²	8	60.2 Å²	60.2	8%	0.082	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	164.1	174.3	0	0	0	0	0	113.3	R189 L217	R189-G215 VanDerWaalsContact CD-O 3.22Å; R189-G215 WeakPolarHBondContact CD-O 3.39Å; R189-G215 VanDerWaalsContact CZ-O 3.25Å; R189-G215 VanDerWaalsContact NE-C 3.34Å; R189-G215 PolarHBondContact NE-O 2.87Å; R189-G215 VanDerWaalsContact NE-O 3.11Å; R189-G215 PolarHBondContact NH1-O 3.37Å; G215-L217 PolarHBondContact O-N 2.93Å
216	G	85.5	Confident	92.7	Very high	39 Å²	39	55.6 Å²	55.6	40%	0.402	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	4.4	178	0	0	0	0	0	115.4
217	L	87	Confident	92.6	Very high	51 Å²	51	61.4 Å²	61.4	27%	0.267	31%	0.306	S	S	.	.	S	Bend	trans	-113	152.2	170.4	-60.3	-177.7	0	0	0	109.7	V214 G215 V219 Q222 Q418	V214-L217 HydrophobicContact CG2-CD1 3.46Å; V214-L217 VanDerWaalsContact CG2-CD1 3.46Å; V214-L217 HydrophobicContact CG2-CG 4.02Å; G215-L217 PolarHBondContact O-N 2.93Å; L217-V219 PolarHBondContact O-N 2.97Å; L217-Q222 PolarHBondContact O-NE2 2.89Å; L217-Q418 HydrophobicContact CD2-CB 4.32Å; L217-Q418 HydrophobicContact CD2-CG 4.17Å; L217-Q418 HydrophobicContact CG-CG 4.49Å
218	S	88.7	Confident	92.7	Very high	66 Å²	66	61 Å²	61	46%	0.462	30%	0.297	S	S	.	.			trans	-52.3	125.8	177.9	167.6	0	0	0	0	111.6	K221 Q222	S218-K221 PolarHBondContact O-N 3.36Å; S218-K221 PolarHBondContact OG-N 2.92Å; S218-Q222 PolarHBondContact O-N 3.32Å
219	V	89.6	Confident	92.6	Very high	50 Å²	50	65.1 Å²	65.1	30%	0.303	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-47.7	177.9	-178.9	0	0	0	0	110.4	L217 K221 Q222 E223 L243	L217-V219 PolarHBondContact O-N 2.97Å; V219-K221 PolarHBondContact O-N 2.94Å; V219-K221 VanDerWaalsContact O-N 3.16Å; V219-Q222 CarbonylContact O-C 3.55Å; V219-Q222 WeakPolarHBondContact O-CA 3.44Å; V219-Q222 WeakPolarHBondContact O-CB 2.95Å; V219-Q222 PolarHBondContact O-N 3.48Å; V219-E223 HydrophobicContact CG1-CG 4.32Å; V219-E223 PolarHBondContact O-N 3.45Å; V219-L243 HydrophobicContact CG1-CD2 4.16Å
220	Q	91.3	Very high	92.6	Very high	126 Å²	126	60.4 Å²	60.4	59%	0.589	30%	0.295	S	S	*	.	H	α-helix	trans	-54.9	-37.7	177.2	-62.9	168.6	-2.2	0	0	112.8	Q222 R224	Q220-Q222 VanDerWaalsContact C-N 3.34Å; Q220-R224 WeakPolarHBondContact O-CB 3.43Å; Q220-R224 VanDerWaalsContact O-CG 3.26Å; Q220-R224 WeakPolarHBondContact O-CG 3.45Å; Q220-R224 PolarHBondContact O-N 3.17Å
221	K	90.7	Very high	92.5	Very high	157 Å²	157	61 Å²	61	68%	0.683	30%	0.299	S	S	*	.	H	α-helix	trans	-67.3	-36.2	175.7	-171.2	177.7	-179.5	178.6	0	111.8	S218 V219 L225	S218-K221 PolarHBondContact O-N 3.36Å; S218-K221 PolarHBondContact OG-N 2.92Å; V219-K221 PolarHBondContact O-N 2.94Å; V219-K221 VanDerWaalsContact O-N 3.16Å; K221-L225 PolarHBondContact O-N 3.03Å; K221-L225 VanDerWaalsContact O-N 3.12Å
222	Q	93.1	Very high	92.6	Very high	8 Å²	8	61 Å²	61	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-73.1	-39.9	177.4	-66.7	-179	62.5	0	0	111.6	L213 V214 L217 S218 V219 Q220 R224 L225 L226	L213-Q222 HydrophobicContact CD2-CB 3.93Å; L213-Q222 HydrophobicContact CD2-CG 4.38Å; V214-Q222 VanDerWaalsContact N-OE1 3.13Å; V214-Q222 PolarHBondContact O-NE2 2.99Å; L217-Q222 PolarHBondContact O-NE2 2.89Å; S218-Q222 PolarHBondContact O-N 3.32Å; V219-Q222 CarbonylContact O-C 3.55Å; V219-Q222 WeakPolarHBondContact O-CA 3.44Å; V219-Q222 WeakPolarHBondContact O-CB 2.95Å; V219-Q222 PolarHBondContact O-N 3.48Å; Q220-Q222 VanDerWaalsContact C-N 3.34Å; Q222-R224 PolarHBondContact O-N 3Å; Q222-L225 CarbonylContact O-C 3.48Å; Q222-L225 WeakPolarHBondContact O-CA 3.31Å; Q222-L225 VanDerWaalsContact O-CB 3.32Å; Q222-L225 WeakPolarHBondContact O-CB 3.27Å; Q222-L225 PolarHBondContact O-N 3.22Å; Q222-L226 WeakPolarHBondContact O-CG 3.46Å; Q222-L226 PolarHBondContact O-N 2.97Å
223	E	91.9	Very high	92.6	Very high	78 Å²	78	60.2 Å²	60.2	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-44.9	171.8	-69.3	171.4	176.1	0	0	111.7	V219 L225 L226 K227	V219-E223 HydrophobicContact CG1-CG 4.32Å; V219-E223 PolarHBondContact O-N 3.45Å; E223-L225 PolarHBondContact O-N 3.36Å; E223-L226 WeakPolarHBondContact O-CB 3.42Å; E223-L226 PolarHBondContact O-N 3.25Å; E223-L226 VanDerWaalsContact O-N 3.08Å; E223-K227 WeakPolarHBondContact O-CG 3.49Å; E223-K227 PolarHBondContact O-N 3.41Å
224	R	92.6	Very high	92.7	Very high	174 Å²	174	60.2 Å²	60.2	66%	0.657	30%	0.295	S	S	*	.	H	α-helix	trans	-60.5	-32.9	173.2	-72.2	174.3	-170.2	174.5	4.4	112.5	Q220 Q222	Q220-R224 WeakPolarHBondContact O-CB 3.43Å; Q220-R224 VanDerWaalsContact O-CG 3.26Å; Q220-R224 WeakPolarHBondContact O-CG 3.45Å; Q220-R224 PolarHBondContact O-N 3.17Å; Q222-R224 PolarHBondContact O-N 3Å
225	L	93.3	Very high	92.9	Very high	47 Å²	47	60.2 Å²	60.2	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-41.7	173.5	179	150.4	0	0	0	111	G211 K221 Q222 E223 K227 K228 P230	G211-L225 VanDerWaalsContact CA-CD2 3.45Å; K221-L225 PolarHBondContact O-N 3.03Å; K221-L225 VanDerWaalsContact O-N 3.12Å; Q222-L225 CarbonylContact O-C 3.48Å; Q222-L225 WeakPolarHBondContact O-CA 3.31Å; Q222-L225 VanDerWaalsContact O-CB 3.32Å; Q222-L225 WeakPolarHBondContact O-CB 3.27Å; Q222-L225 PolarHBondContact O-N 3.22Å; E223-L225 PolarHBondContact O-N 3.36Å; L225-K227 VanDerWaalsContact C-N 3.31Å; L225-K227 PolarHBondContact O-N 3.27Å; L225-K228 WeakPolarHBondContact O-CB 3.26Å; L225-K228 PolarHBondContact O-N 2.97Å; L225-K228 VanDerWaalsContact O-N 3.08Å; L225-P230 HydrophobicContact CD2-CG 4.33Å
226	L	94.5	Very high	93	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-34.7	177.6	-71.6	173.7	0	0	0	112.3	L213 Q222 E223 K228 Q229 P230 I233 L243 Q250 L251	L213-L226 HydrophobicContact CD1-CD1 4.47Å; L213-L226 HydrophobicContact CD1-CD2 4.23Å; L213-L226 HydrophobicContact CD2-CD1 4.15Å; L213-L226 HydrophobicContact CD2-CD2 4.19Å; L213-L226 HydrophobicContact CD2-CG 4.12Å; Q222-L226 WeakPolarHBondContact O-CG 3.46Å; Q222-L226 PolarHBondContact O-N 2.97Å; E223-L226 WeakPolarHBondContact O-CB 3.42Å; E223-L226 PolarHBondContact O-N 3.25Å; E223-L226 VanDerWaalsContact O-N 3.08Å; L226-K228 PolarHBondContact O-N 3.41Å; L226-K228 VanDerWaalsContact O-N 3.1Å; L226-Q229 WeakPolarHBondContact O-CA 3.39Å; L226-Q229 PolarHBondContact O-N 3.4Å; L226-P230 HydrophobicContact CD2-CG 4.16Å; L226-I233 HydrophobicContact CD2-CD1 3.86Å; L226-L243 HydrophobicContact CD1-CD1 4.31Å; L226-Q250 HydrophobicContact CB-CB 3.92Å; L226-Q250 HydrophobicContact CB-CG 4.14Å; L226-L251 HydrophobicContact CD1-CD1 4.25Å; L226-L251 HydrophobicContact CD1-CD2 4.45Å; L226-L251 HydrophobicContact CD1-CG 4.23Å; L226-L251 HydrophobicContact CD2-CD2 3.99Å
227	K	93.3	Very high	93.4	Very high	144 Å²	144	58.6 Å²	58.6	63%	0.626	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.9	172	-72.3	-178.7	-178.5	-172	0	113.6	E223 L225 Q229	E223-K227 WeakPolarHBondContact O-CG 3.49Å; E223-K227 PolarHBondContact O-N 3.41Å; L225-K227 VanDerWaalsContact C-N 3.31Å; L225-K227 PolarHBondContact O-N 3.27Å; K227-Q229 PolarHBondContact O-N 3.32Å
228	K	93.6	Very high	93.6	Very high	154 Å²	154	57.1 Å²	57.1	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-0.5	173.7	-60.8	-173.9	175.7	-171.5	0	113.7	K209 L225 L226	K209-K228 WeakPolarHBondContact CD-O 3.42Å; K209-K228 PolarHBondContact NZ-O 3.42Å; K209-K228 VanDerWaalsContact NZ-O 3.15Å; L225-K228 WeakPolarHBondContact O-CB 3.26Å; L225-K228 PolarHBondContact O-N 2.97Å; L225-K228 VanDerWaalsContact O-N 3.08Å; L226-K228 PolarHBondContact O-N 3.41Å; L226-K228 VanDerWaalsContact O-N 3.1Å
229	Q	93.8	Very high	93.8	Very high	113 Å²	113	56.4 Å²	56.4	53%	0.528	26%	0.26	S	S	.	.			trans	53.4	69.5	-179.4	-63.6	178.4	-17.8	0	0	112.1	L226 K227	L226-Q229 WeakPolarHBondContact O-CA 3.39Å; L226-Q229 PolarHBondContact O-N 3.4Å; K227-Q229 PolarHBondContact O-N 3.32Å
230	P	95.6	Very high	94.1	Very high	7 Å²	7	54 Å²	54	5%	0.045	25%	0.245	C	C	.	.			trans	-66.1	136.4	173.7	28.9	-33.5	0	0	0	111.3	K209 L225 L226 I233	K209-P230 CarbonylContact O-C 3.47Å; L225-P230 HydrophobicContact CD2-CG 4.33Å; L226-P230 HydrophobicContact CD2-CG 4.16Å; P230-I233 HydrophobicContact CG-CD1 4.5Å; P230-I233 HydrophobicContact CG-CG1 4.07Å
231	D	95.8	Very high	94.2	Very high	39 Å²	39	49.7 Å²	49.7	21%	0.209	22%	0.224	C	C	.	.	S	Bend	trans	-75.6	-35	175.5	-53.5	-75.9	0	0	0	111.7	L170 S181 A182 I208 K209	L170-D231 HydrophobicContact CD1-CB 4.25Å; S181-D231 PolarHBondContact N-O 2.77Å; A182-D231 PolarHBondContact N-O 3.47Å; I208-D231 HydrophobicContact CG2-CB 4.12Å; K209-D231 PolarHBondContact N-OD2 3.4Å; K209-D231 PolarHBondContact O-N 2.83Å
232	I	97.9	Very high	94.3	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126	177.3	-52.1	-179.7	0	0	0	109.1	V166 V167 L170 A182 V184 V199 I208 K209 I210 G211 I234	V166-I232 HydrophobicContact CG1-CD1 3.95Å; V166-I232 HydrophobicContact CG1-CG1 4.37Å; V167-I232 HydrophobicContact CG2-CD1 4.14Å; L170-I232 HydrophobicContact CD1-CD1 3.86Å; L170-I232 HydrophobicContact CD1-CG1 3.57Å; A182-I232 HydrophobicContact CB-CB 4.44Å; A182-I232 HydrophobicContact CB-CG1 4.11Å; A182-I232 HydrophobicContact CB-CG2 4.21Å; A182-I232 WeakPolarHBondContact O-CA 3.48Å; V184-I232 HydrophobicContact CG2-CG2 4.28Å; V199-I232 HydrophobicContact CG1-CD1 3.81Å; I208-I232 HydrophobicContact CG2-CD1 3.68Å; I208-I232 HydrophobicContact CG2-CG1 3.84Å; K209-I232 PolarHBondContact O-N 3.35Å; K209-I232 VanDerWaalsContact O-N 3.08Å; I210-I232 CarbonylContact C-O 3.55Å; I210-I232 WeakPolarHBondContact CA-O 3.43Å; I210-I232 HydrophobicContact CG1-CB 4.28Å; I210-I232 HydrophobicContact CG1-CD1 4.41Å; G211-I232 PolarHBondContact N-O 3.03Å; I232-I234 HydrophobicContact CG2-CG1 4.32Å
233	I	98.1	Very high	94.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128	170.3	-66.9	179.1	0	0	0	109.1	P180 A182 L183 V184 L213 L226 P230 A235 I240 L251 I254	P180-I233 HydrophobicContact CB-CD1 3.65Å; P180-I233 HydrophobicContact CB-CG1 3.9Å; P180-I233 HydrophobicContact CG-CD1 3.72Å; A182-I233 PolarHBondContact O-N 3.13Å; L183-I233 CarbonylContact C-O 3.59Å; L183-I233 WeakPolarHBondContact CA-O 3.28Å; L183-I233 HydrophobicContact CD1-CB 4.21Å; L183-I233 HydrophobicContact CD1-CG2 3.97Å; V184-I233 PolarHBondContact N-O 3.1Å; L213-I233 HydrophobicContact CD1-CD1 4.43Å; L213-I233 HydrophobicContact CD1-CG2 3.64Å; L213-I233 HydrophobicContact CG-CG2 3.97Å; L226-I233 HydrophobicContact CD2-CD1 3.86Å; P230-I233 HydrophobicContact CG-CD1 4.5Å; P230-I233 HydrophobicContact CG-CG1 4.07Å; I233-A235 HydrophobicContact CG2-CB 4.17Å; I233-I240 HydrophobicContact CG2-CD1 4.13Å; I233-L251 HydrophobicContact CD1-CD2 3.39Å; I233-I254 HydrophobicContact CD1-CD1 4.42Å
234	I	98.3	Very high	94.4	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.9	170.5	-58.6	158.9	0	0	0	107.5	V184 T186 A192 I195 K196 V199 I210 G211 L212 L213 I232	V184-I234 HydrophobicContact CB-CB 4.38Å; V184-I234 HydrophobicContact CB-CG1 3.95Å; V184-I234 HydrophobicContact CB-CG2 4.32Å; V184-I234 HydrophobicContact CG1-CG2 4.46Å; V184-I234 HydrophobicContact CG2-CG1 4.07Å; V184-I234 CarbonylContact O-C 3.57Å; V184-I234 WeakPolarHBondContact O-CA 3.45Å; T186-I234 HydrophobicContact CG2-CG2 4.44Å; A192-I234 HydrophobicContact CB-CG2 4Å; A192-I234 WeakPolarHBondContact O-CG2 3.41Å; I195-I234 HydrophobicContact CB-CD1 4.47Å; I195-I234 HydrophobicContact CB-CG2 4.16Å; I195-I234 HydrophobicContact CG2-CD1 3.83Å; I195-I234 HydrophobicContact CG2-CG1 4.18Å; I195-I234 HydrophobicContact CG2-CG2 4.12Å; K196-I234 HydrophobicContact CB-CD1 3.74Å; V199-I234 HydrophobicContact CB-CD1 4.29Å; V199-I234 HydrophobicContact CG2-CD1 4.14Å; I210-I234 HydrophobicContact CG2-CD1 3.68Å; I210-I234 HydrophobicContact CG2-CG1 4.45Å; G211-I234 PolarHBondContact O-N 2.73Å; L212-I234 CarbonylContact C-O 3.57Å; L212-I234 WeakPolarHBondContact CA-O 3.31Å; L212-I234 HydrophobicContact CD1-CB 4.45Å; L212-I234 HydrophobicContact CD1-CG2 4.36Å; L213-I234 PolarHBondContact N-O 2.82Å; I232-I234 HydrophobicContact CG2-CG1 4.32Å
235	A	96.6	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.8	-169.7	0	0	0	0	0	114.8	L183 V184 L185 T186 L213 I233 I240	L183-A235 HydrophobicContact CD1-CB 4.47Å; V184-A235 PolarHBondContact O-N 3.39Å; L185-A235 WeakPolarHBondContact CA-O 3.45Å; L185-A235 HydrophobicContact CD2-CB 4.38Å; T186-A235 PolarHBondContact N-O 3.25Å; T186-A235 VanDerWaalsContact N-O 3.12Å; L213-A235 HydrophobicContact CB-CB 3.9Å; L213-A235 WeakPolarHBondContact O-CA 3.4Å; L213-A235 WeakPolarHBondContact O-CB 3.34Å; I233-A235 HydrophobicContact CG2-CB 4.17Å; A235-I240 HydrophobicContact CB-CB 3.78Å; A235-I240 HydrophobicContact CB-CD1 4.14Å; A235-I240 HydrophobicContact CB-CG2 3.87Å
236	T	92.8	Very high	94.2	Very high	12 Å²	12	43.5 Å²	43.5	7%	0.074	21%	0.213	C	C	.	.			trans	-87.8	136.7	160.8	52.2	0	0	0	0	109.9	T186 R189 L213 V214 G238 R239 I240	T186-T236 WeakPolarHBondContact O-CA 3.37Å; R189-T236 HydrophobicContact CG-CG2 4.05Å; L213-T236 PolarHBondContact O-N 2.95Å; L213-T236 VanDerWaalsContact O-N 3.15Å; V214-T236 HydrophobicContact CG1-CG2 4.13Å; T236-G238 PolarHBondContact O-N 3.46Å; T236-R239 PolarHBondContact O-N 3.22Å; T236-R239 VanDerWaalsContact O-N 3.16Å; T236-I240 PolarHBondContact O-N 3.35Å
237	P	92.9	Very high	94	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-48.1	-51.4	-172.6	-30.2	34	0	0	0	114.6	T186 R239 I240 W241 M268 F274 L277	T186-P237 WeakPolarHBondContact O-CD 3.48Å; P237-R239 PolarHBondContact O-N 3.41Å; P237-I240 WeakPolarHBondContact O-CG2 3.37Å; P237-I240 PolarHBondContact O-N 2.96Å; P237-W241 VanDerWaalsContact O-CB 3.3Å; P237-W241 WeakPolarHBondContact O-CB 3.49Å; P237-W241 PolarHBondContact O-N 2.87Å; P237-M268 HydrophobicContact CG-SD 4.04Å; P237-F274 HydrophobicContact CB-CD1 3.99Å; P237-F274 HydrophobicContact CG-CD1 3.9Å; P237-F274 HydrophobicContact CG-CE1 4.32Å; P237-F274 HydrophobicContact CG-CG 4.37Å; P237-L277 HydrophobicContact CB-CB 4.33Å; P237-L277 HydrophobicContact CG-CB 4.48Å; P237-L277 HydrophobicContact CG-CD1 4.11Å
238	G	91.1	Very high	93.8	Very high	21 Å²	21	40.2 Å²	40.2	22%	0.216	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-47.5	-178.2	0	0	0	0	0	113.5	T236 W241 T242	T236-G238 PolarHBondContact O-N 3.46Å; G238-W241 PolarHBondContact O-N 3Å; G238-T242 PolarHBondContact O-N 2.99Å; G238-T242 PolarHBondContact O-OG1 3.46Å
239	R	93.3	Very high	93.6	Very high	50 Å²	50	40.1 Å²	40.1	19%	0.189	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-44.3	-178.3	174.5	55.6	59.8	-162.1	-3.2	112.6	L213 T236 P237 W241 L243	L213-R239 HydrophobicContact CB-CG 4.16Å; T236-R239 PolarHBondContact O-N 3.22Å; T236-R239 VanDerWaalsContact O-N 3.16Å; P237-R239 PolarHBondContact O-N 3.41Å; R239-W241 VanDerWaalsContact C-N 3.33Å; R239-L243 HydrophobicContact CG-CD1 4.42Å; R239-L243 WeakPolarHBondContact O-CG 3.33Å; R239-L243 PolarHBondContact O-N 3.48Å
240	I	95.2	Very high	93.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70	-36.4	-179.9	-173.9	170.6	0	0	0	110.8	L183 L185 L213 I233 A235 T236 P237 L243 V244 L251 I254 M280	L183-I240 HydrophobicContact CD1-CD1 3.33Å; L183-I240 HydrophobicContact CD2-CD1 4Å; L183-I240 HydrophobicContact CG-CD1 4.32Å; L185-I240 HydrophobicContact CD2-CG2 3.95Å; L213-I240 HydrophobicContact CD1-CB 4.45Å; L213-I240 HydrophobicContact CD1-CD1 4.46Å; L213-I240 HydrophobicContact CD1-CG1 4.23Å; I233-I240 HydrophobicContact CG2-CD1 4.13Å; A235-I240 HydrophobicContact CB-CB 3.78Å; A235-I240 HydrophobicContact CB-CD1 4.14Å; A235-I240 HydrophobicContact CB-CG2 3.87Å; T236-I240 PolarHBondContact O-N 3.35Å; P237-I240 WeakPolarHBondContact O-CG2 3.37Å; P237-I240 PolarHBondContact O-N 2.96Å; I240-L243 PolarHBondContact O-N 2.92Å; I240-V244 HydrophobicContact CG1-CG2 4.34Å; I240-V244 WeakPolarHBondContact O-CG2 3.37Å; I240-V244 PolarHBondContact O-N 3.17Å; I240-L251 HydrophobicContact CG1-CD1 4.47Å; I240-I254 HydrophobicContact CD1-CD1 4.35Å; I240-I254 HydrophobicContact CD1-CG1 4.49Å; I240-M280 HydrophobicContact CB-CE 4.15Å; I240-M280 HydrophobicContact CD1-CE 4.38Å; I240-M280 HydrophobicContact CG1-CE 3.85Å; I240-M280 HydrophobicContact CG2-CE 3.61Å
241	W	94.6	Very high	93.3	Very high	36 Å²	36	37 Å²	37	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-47.9	176.7	-175.9	-105.9	0	0	0	111.7	P237 G238 R239 L243 V244 E245 E276 N279 M280 F283	P237-W241 VanDerWaalsContact O-CB 3.3Å; P237-W241 WeakPolarHBondContact O-CB 3.49Å; P237-W241 PolarHBondContact O-N 2.87Å; G238-W241 PolarHBondContact O-N 3Å; R239-W241 VanDerWaalsContact C-N 3.33Å; W241-L243 VanDerWaalsContact C-N 3.29Å; W241-L243 PolarHBondContact O-N 3.48Å; W241-V244 PolarHBondContact O-N 3.07Å; W241-E245 PolarHBondContact NE1-OE2 3.09Å; W241-E245 WeakPolarHBondContact O-CB 3.38Å; W241-E245 PolarHBondContact O-N 2.98Å; W241-E276 HydrophobicContact CB-CB 4.01Å; W241-E276 HydrophobicContact CG-CB 4.04Å; W241-E276 HydrophobicContact CG-CG 4.49Å; W241-N279 HydrophobicContact CD2-CB 4.25Å; W241-N279 HydrophobicContact CE3-CB 4.48Å; W241-N279 HydrophobicContact CH2-CB 3.94Å; W241-N279 HydrophobicContact CZ2-CB 3.68Å; W241-N279 HydrophobicContact CZ3-CB 4.35Å; W241-M280 HydrophobicContact CB-CE 4.08Å; W241-M280 HydrophobicContact CE3-CB 3.93Å; W241-M280 HydrophobicContact CE3-CE 3.69Å; W241-M280 HydrophobicContact CE3-SD 3.86Å; W241-M280 HydrophobicContact CZ3-CB 4.4Å; W241-M280 HydrophobicContact CZ3-SD 4.21Å; W241-F283 HydrophobicContact CH2-CB 4.12Å; W241-F283 HydrophobicContact CH2-CG 4.49Å; W241-F283 HydrophobicContact CZ3-CB 3.8Å; W241-F283 HydrophobicContact CZ3-CD1 4.39Å; W241-F283 HydrophobicContact CZ3-CG 4.13Å
242	T	92.9	Very high	93	Very high	54 Å²	54	39 Å²	39	33%	0.331	22%	0.221	S	C	.	.	H	α-helix	trans	-52.8	-46.9	174.8	-52.1	0	0	0	0	111.8	G238 V244 E245 D246	G238-T242 PolarHBondContact O-N 2.99Å; G238-T242 PolarHBondContact O-OG1 3.46Å; T242-V244 VanDerWaalsContact C-N 3.33Å; T242-V244 PolarHBondContact O-N 3.24Å; T242-E245 PolarHBondContact O-N 3.49Å; T242-D246 VanDerWaalsContact O-CB 3.3Å; T242-D246 WeakPolarHBondContact O-CB 3.38Å; T242-D246 PolarHBondContact O-N 2.95Å
243	L	93.1	Very high	92.5	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-33.3	-179.4	-68.5	169.2	0	0	0	113.1	L213 V219 L226 R239 I240 W241 C248 L251	L213-L243 HydrophobicContact CD1-CD1 3.97Å; L213-L243 HydrophobicContact CD2-CD1 4.05Å; L213-L243 HydrophobicContact CG-CD1 4.46Å; V219-L243 HydrophobicContact CG1-CD2 4.16Å; L226-L243 HydrophobicContact CD1-CD1 4.31Å; R239-L243 HydrophobicContact CG-CD1 4.42Å; R239-L243 WeakPolarHBondContact O-CG 3.33Å; R239-L243 PolarHBondContact O-N 3.48Å; I240-L243 PolarHBondContact O-N 2.92Å; W241-L243 VanDerWaalsContact C-N 3.29Å; W241-L243 PolarHBondContact O-N 3.48Å; L243-C248 HydrophobicContact CB-CB 4.32Å; L243-C248 WeakPolarHBondContact O-CB 3.2Å; L243-C248 PolarHBondContact O-N 3.01Å; L243-L251 HydrophobicContact CB-CD1 3.67Å; L243-L251 HydrophobicContact CD1-CD1 4.49Å
244	V	93.2	Very high	92.2	Very high	23 Å²	23	41.2 Å²	41.2	14%	0.139	23%	0.233	C	C	.	.	H	α-helix	trans	-71.7	-43.5	176.3	170.8	0	0	0	0	110.7	I240 W241 T242 G247 L251 I254 M280 F283	I240-V244 HydrophobicContact CG1-CG2 4.34Å; I240-V244 WeakPolarHBondContact O-CG2 3.37Å; I240-V244 PolarHBondContact O-N 3.17Å; W241-V244 PolarHBondContact O-N 3.07Å; T242-V244 VanDerWaalsContact C-N 3.33Å; T242-V244 PolarHBondContact O-N 3.24Å; V244-G247 PolarHBondContact O-N 3.49Å; V244-G247 VanDerWaalsContact O-N 3.09Å; V244-L251 HydrophobicContact CG2-CB 4.19Å; V244-L251 HydrophobicContact CG2-CD1 4.02Å; V244-I254 HydrophobicContact CG2-CG2 3.95Å; V244-M280 HydrophobicContact CG2-CE 4.16Å; V244-F283 HydrophobicContact CG1-CD1 4.32Å; V244-F283 HydrophobicContact CG1-CE1 3.85Å; V244-F283 HydrophobicContact CG1-CZ 4.15Å
245	E	91.5	Very high	91.7	Very high	133 Å²	133	43.3 Å²	43.3	62%	0.621	24%	0.242	S	C	*	.	H	α-helix	trans	-65.7	-39	178.5	-173.4	165.8	-142.4	0	0	112.1	W241 T242 G247	W241-E245 PolarHBondContact NE1-OE2 3.09Å; W241-E245 WeakPolarHBondContact O-CB 3.38Å; W241-E245 PolarHBondContact O-N 2.98Å; T242-E245 PolarHBondContact O-N 3.49Å; E245-G247 PolarHBondContact O-N 2.87Å; E245-G247 VanDerWaalsContact O-N 3.09Å
246	D	91.2	Very high	91.4	Very high	119 Å²	119	45.3 Å²	45.3	64%	0.636	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.9	173	-68.1	-17.2	0	0	0	113.1	T242	T242-D246 VanDerWaalsContact O-CB 3.3Å; T242-D246 WeakPolarHBondContact O-CB 3.38Å; T242-D246 PolarHBondContact O-N 2.95Å
247	G	89.4	Confident	91.3	Very high	58 Å²	58	44.7 Å²	44.7	60%	0.598	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	32.4	177.7	0	0	0	0	0	114	V244 E245 E249	V244-G247 PolarHBondContact O-N 3.49Å; V244-G247 VanDerWaalsContact O-N 3.09Å; E245-G247 PolarHBondContact O-N 2.87Å; E245-G247 VanDerWaalsContact O-N 3.09Å; G247-E249 PolarHBondContact O-N 2.78Å
248	C	89.6	Confident	91.3	Very high	20 Å²	20	47.4 Å²	47.4	14%	0.135	26%	0.259	C	S	.	.			trans	-55.1	114.2	177.1	179.8	0	0	0	0	111.4	L243 Q250 L251 S252	L243-C248 HydrophobicContact CB-CB 4.32Å; L243-C248 WeakPolarHBondContact O-CB 3.2Å; L243-C248 PolarHBondContact O-N 3.01Å; C248-Q250 VanDerWaalsContact C-N 3.25Å; C248-Q250 PolarHBondContact O-N 2.93Å; C248-Q250 VanDerWaalsContact O-N 3.17Å; C248-Q250 PolarHBondContact SG-OE1 2.95Å; C248-L251 HydrophobicContact CB-CB 4.41Å; C248-L251 HydrophobicContact CB-CD1 4.29Å; C248-L251 HydrophobicContact CB-CG 4.37Å; C248-L251 CarbonylContact O-C 3.58Å; C248-L251 WeakPolarHBondContact O-CA 3.43Å; C248-L251 PolarHBondContact O-N 3.13Å; C248-S252 PolarHBondContact O-N 3.14Å
249	E	89.4	Confident	91.5	Very high	151 Å²	151	48 Å²	48	71%	0.706	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-53.5	-40.6	-174.7	-173.5	-169.1	173.5	0	0	112.8	G247 L251 S252	G247-E249 PolarHBondContact O-N 2.78Å; E249-L251 PolarHBondContact O-N 3.05Å; E249-S252 VanDerWaalsContact O-CB 3.26Å; E249-S252 WeakPolarHBondContact O-CB 3.32Å; E249-S252 PolarHBondContact O-N 3.29Å; E249-S252 VanDerWaalsContact O-N 3.1Å; E249-S252 PolarHBondContact O-OG 3.2Å
250	Q	90.3	Very high	91.7	Very high	52 Å²	52	45.6 Å²	45.6	24%	0.243	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-68.2	-15.5	-178.8	-60.9	79.8	20.6	0	0	113.1	L226 C248	L226-Q250 HydrophobicContact CB-CB 3.92Å; L226-Q250 HydrophobicContact CB-CG 4.14Å; C248-Q250 VanDerWaalsContact C-N 3.25Å; C248-Q250 PolarHBondContact O-N 2.93Å; C248-Q250 VanDerWaalsContact O-N 3.17Å; C248-Q250 PolarHBondContact SG-OE1 2.95Å
251	L	92.4	Very high	91.8	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-106.7	4.8	176.8	-59	-179.3	0	0	0	112.8	P180 L213 L226 I233 I240 L243 V244 C248 E249 N253 I254	P180-L251 HydrophobicContact CG-CD2 4.42Å; L213-L251 HydrophobicContact CD1-CD1 4.41Å; L226-L251 HydrophobicContact CD1-CD1 4.25Å; L226-L251 HydrophobicContact CD1-CD2 4.45Å; L226-L251 HydrophobicContact CD1-CG 4.23Å; L226-L251 HydrophobicContact CD2-CD2 3.99Å; I233-L251 HydrophobicContact CD1-CD2 3.39Å; I240-L251 HydrophobicContact CG1-CD1 4.47Å; L243-L251 HydrophobicContact CB-CD1 3.67Å; L243-L251 HydrophobicContact CD1-CD1 4.49Å; V244-L251 HydrophobicContact CG2-CB 4.19Å; V244-L251 HydrophobicContact CG2-CD1 4.02Å; C248-L251 HydrophobicContact CB-CB 4.41Å; C248-L251 HydrophobicContact CB-CD1 4.29Å; C248-L251 HydrophobicContact CB-CG 4.37Å; C248-L251 CarbonylContact O-C 3.58Å; C248-L251 WeakPolarHBondContact O-CA 3.43Å; C248-L251 PolarHBondContact O-N 3.13Å; E249-L251 PolarHBondContact O-N 3.05Å; L251-N253 PolarHBondContact O-N 3.4Å; L251-N253 VanDerWaalsContact O-N 3.13Å; L251-I254 HydrophobicContact CB-CB 4.41Å; L251-I254 HydrophobicContact CD2-CD1 4.41Å; L251-I254 WeakPolarHBondContact O-CB 3.48Å; L251-I254 WeakPolarHBondContact O-CG2 3.41Å; L251-I254 PolarHBondContact O-N 2.82Å
252	S	88.4	Confident	91.9	Very high	81 Å²	81	44 Å²	44	57%	0.566	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-38.4	179	53.2	0	0	0	0	113.5	C248 E249	C248-S252 PolarHBondContact O-N 3.14Å; E249-S252 VanDerWaalsContact O-CB 3.26Å; E249-S252 WeakPolarHBondContact O-CB 3.32Å; E249-S252 PolarHBondContact O-N 3.29Å; E249-S252 VanDerWaalsContact O-N 3.1Å; E249-S252 PolarHBondContact O-OG 3.2Å
253	N	88.4	Confident	91.9	Very high	47 Å²	47	41.7 Å²	41.7	25%	0.251	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	9.5	179.2	-70.3	-29.7	0	0	0	114.6	N178 L251 K255 N256	N178-N253 WeakPolarHBondContact O-CB 3.39Å; N178-N253 PolarHBondContact O-ND2 2.88Å; L251-N253 PolarHBondContact O-N 3.4Å; L251-N253 VanDerWaalsContact O-N 3.13Å; N253-K255 PolarHBondContact O-N 2.91Å; N253-N256 PolarHBondContact O-N 2.67Å
254	I	91.3	Very high	91.6	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-56.9	-28.7	-178.4	-166.4	67.3	0	0	0	112.4	P180 L183 I233 I240 V244 L251 N256 V257 F283 L284	P180-I254 HydrophobicContact CB-CD1 4.25Å; P180-I254 HydrophobicContact CG-CD1 3.48Å; P180-I254 VanDerWaalsContact CG-CD1 3.48Å; L183-I254 HydrophobicContact CD2-CD1 4.35Å; L183-I254 HydrophobicContact CD2-CG1 4.41Å; I233-I254 HydrophobicContact CD1-CD1 4.42Å; I240-I254 HydrophobicContact CD1-CD1 4.35Å; I240-I254 HydrophobicContact CD1-CG1 4.49Å; V244-I254 HydrophobicContact CG2-CG2 3.95Å; L251-I254 HydrophobicContact CB-CB 4.41Å; L251-I254 HydrophobicContact CD2-CD1 4.41Å; L251-I254 WeakPolarHBondContact O-CB 3.48Å; L251-I254 WeakPolarHBondContact O-CG2 3.41Å; L251-I254 PolarHBondContact O-N 2.82Å; I254-N256 PolarHBondContact O-N 2.8Å; I254-V257 HydrophobicContact CD1-CG1 3.84Å; I254-V257 HydrophobicContact CG1-CG1 4.47Å; I254-V257 VanDerWaalsContact O-CG1 3.22Å; I254-V257 WeakPolarHBondContact O-CG1 3.21Å; I254-V257 WeakPolarHBondContact O-CG2 3.39Å; I254-V257 PolarHBondContact O-N 2.8Å; I254-F283 HydrophobicContact CG2-CE1 3.79Å; I254-L284 WeakPolarHBondContact O-CD2 3.4Å
255	K	88.8	Confident	91.4	Very high	44 Å²	44	41.2 Å²	41.2	19%	0.191	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-59.3	-28.6	176	-170.2	170.6	180	176	0	113.5	N253 F283 S286	N253-K255 PolarHBondContact O-N 2.91Å; K255-F283 HydrophobicContact CB-CE1 4.08Å; K255-F283 HydrophobicContact CB-CZ 4.28Å; K255-F283 HydrophobicContact CD-CE2 4.43Å; K255-F283 HydrophobicContact CD-CZ 4.31Å; K255-F283 VanDerWaalsContact CE-O 3.26Å; K255-F283 WeakPolarHBondContact CE-O 3.48Å; K255-S286 WeakPolarHBondContact CE-O 3.39Å; K255-S286 PolarHBondContact NZ-O 2.71Å
256	N	88.5	Confident	90.9	Very high	42 Å²	42	35.1 Å²	35.1	23%	0.225	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-99	17.2	-174.4	-56.2	-34.8	0	0	0	112.6	Y177 N253 I254 R258 S292	Y177-N256 HydrophobicContact CE1-CB 4.01Å; Y177-N256 VanDerWaalsContact CE1-O 3.29Å; Y177-N256 WeakPolarHBondContact CE1-O 3.25Å; Y177-N256 VanDerWaalsContact CZ-O 3.29Å; Y177-N256 WeakPolarHBondContact OH-CB 3.29Å; Y177-N256 PolarHBondContact OH-O 2.87Å; N253-N256 PolarHBondContact O-N 2.67Å; I254-N256 PolarHBondContact O-N 2.8Å; N256-R258 PolarHBondContact O-N 3.23Å; N256-S292 PolarHBondContact O-OG 3.21Å
257	V	91.8	Very high	90.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.164	C	C	.	.			trans	-53.4	138.9	174.5	-73.1	0	0	0	0	111	P180 L183 I254 R296	P180-V257 WeakPolarHBondContact O-CG1 3.22Å; L183-V257 HydrophobicContact CB-CG1 4.24Å; I254-V257 HydrophobicContact CD1-CG1 3.84Å; I254-V257 HydrophobicContact CG1-CG1 4.47Å; I254-V257 VanDerWaalsContact O-CG1 3.22Å; I254-V257 WeakPolarHBondContact O-CG1 3.21Å; I254-V257 WeakPolarHBondContact O-CG2 3.39Å; I254-V257 PolarHBondContact O-N 2.8Å; V257-R296 WeakPolarHBondContact O-CD 3.25Å; V257-R296 VanDerWaalsContact O-CG 3.3Å; V257-R296 WeakPolarHBondContact O-CG 3.38Å
258	R	92.7	Very high	90	Very high	57 Å²	57	27 Å²	27	22%	0.215	14%	0.136	C	C	.	.	S	Bend	trans	-83.9	-24.7	178.3	-65.1	-171.5	-69.9	150.3	-6.5	112.7	L170 A173 S181 N256 R296 Q297	L170-R258 VanDerWaalsContact CD2-NH2 3.32Å; A173-R258 VanDerWaalsContact CB-NH1 3.27Å; A173-R258 VanDerWaalsContact CB-NH2 3.28Å; S181-R258 PolarHBondContact O-N 3Å; N256-R258 PolarHBondContact O-N 3.23Å; R258-R296 CarbonylContact O-C 3.58Å; R258-R296 WeakPolarHBondContact O-CA 3.31Å; R258-R296 WeakPolarHBondContact O-CG 3.18Å; R258-Q297 PolarHBondContact O-N 3.03Å
259	Y	96	Very high	89.6	Confident	33 Å²	33	28.5 Å²	28.5	13%	0.129	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.8	178.5	-54.9	-87.3	0	0	0	110.8	V166 G169 L170 S181 A182 L183 Q297	V166-Y259 HydrophobicContact CG1-CG 4.38Å; V166-Y259 HydrophobicContact CG2-CD1 4.38Å; V166-Y259 HydrophobicContact CG2-CG 4.26Å; G169-Y259 WeakPolarHBondContact CA-OH 3.42Å; L170-Y259 HydrophobicContact CD2-CD2 4.21Å; L170-Y259 HydrophobicContact CD2-CE2 4.02Å; S181-Y259 PolarHBondContact O-N 3.18Å; A182-Y259 CarbonylContact C-O 3.58Å; A182-Y259 VanDerWaalsContact CA-O 3.32Å; A182-Y259 WeakPolarHBondContact CA-O 3.47Å; A182-Y259 HydrophobicContact CB-CD2 4.36Å; L183-Y259 PolarHBondContact N-O 3.31Å; Y259-Q297 WeakPolarHBondContact CA-O 3.35Å; Y259-Q297 HydrophobicContact CD1-CB 3.98Å; Y259-Q297 VanDerWaalsContact CD1-OE1 3.29Å; Y259-Q297 HydrophobicContact CE1-CB 4.23Å
260	L	96.5	Very high	88.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.6	172.1	177	61.2	0	0	0	109	L183 L185 I262 L281 L284 Q297 T298 L299	L183-L260 HydrophobicContact CB-CD1 4.24Å; L183-L260 HydrophobicContact CD2-CD1 4.07Å; L183-L260 HydrophobicContact CG-CD1 4.14Å; L183-L260 CarbonylContact O-C 3.59Å; L183-L260 WeakPolarHBondContact O-CA 3.18Å; L185-L260 HydrophobicContact CD1-CD1 4.28Å; L260-I262 HydrophobicContact CD1-CG1 4.24Å; L260-I262 HydrophobicContact CD2-CD1 4.11Å; L260-I262 HydrophobicContact CG-CD1 4.12Å; L260-I262 HydrophobicContact CG-CG1 4.12Å; L260-L281 HydrophobicContact CD2-CD2 4.09Å; L260-L284 HydrophobicContact CD1-CD1 4.08Å; L260-L284 HydrophobicContact CD2-CD1 4.13Å; L260-Q297 PolarHBondContact N-O 3.07Å; L260-T298 HydrophobicContact CB-CG2 4.41Å; L260-T298 HydrophobicContact CD2-CG2 4.32Å; L260-T298 HydrophobicContact CG-CG2 4.36Å; L260-T298 CarbonylContact O-C 3.53Å; L260-T298 VanDerWaalsContact O-CA 3.26Å; L260-T298 WeakPolarHBondContact O-CA 3.18Å; L260-L299 PolarHBondContact O-N 2.82Å
261	V	97.9	Very high	87.9	Confident	1 Å²	1	31 Å²	31	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.1	175.7	179.2	0	0	0	0	109.3	F162 V166 L183 V184 L185 L299	F162-V261 HydrophobicContact CB-CG1 3.76Å; F162-V261 HydrophobicContact CB-CG2 4.25Å; F162-V261 HydrophobicContact CD1-CG1 3.87Å; F162-V261 HydrophobicContact CD2-CB 4.31Å; F162-V261 HydrophobicContact CD2-CG1 3.4Å; F162-V261 HydrophobicContact CD2-CG2 4.12Å; F162-V261 HydrophobicContact CE1-CG1 4.22Å; F162-V261 HydrophobicContact CE2-CG1 3.84Å; F162-V261 HydrophobicContact CG-CG1 3.42Å; F162-V261 VanDerWaalsContact CG-CG1 3.42Å; F162-V261 HydrophobicContact CG-CG2 4.47Å; F162-V261 HydrophobicContact CZ-CG1 4.21Å; V166-V261 HydrophobicContact CG2-CG2 3.66Å; L183-V261 PolarHBondContact O-N 3.41Å; V184-V261 CarbonylContact C-O 3.58Å; V184-V261 WeakPolarHBondContact CA-O 3.38Å; V184-V261 HydrophobicContact CB-CB 4.15Å; V184-V261 HydrophobicContact CG1-CB 3.92Å; V184-V261 HydrophobicContact CG1-CG1 3.84Å; V184-V261 HydrophobicContact CG2-CB 3.94Å; V184-V261 HydrophobicContact CG2-CG2 4.13Å; L185-V261 PolarHBondContact N-O 3.13Å; V261-L299 CarbonylContact C-O 3.55Å; V261-L299 VanDerWaalsContact CA-O 3.24Å; V261-L299 WeakPolarHBondContact CA-O 3.27Å; V261-L299 HydrophobicContact CG2-CB 4.22Å; V261-L299 HydrophobicContact CG2-CD1 4.25Å
262	I	95.7	Very high	86.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	104.9	178	-53.1	168.2	0	0	0	109.1	L185 L260 I265 M268 L281 L299 A300 F301 L336	L185-I262 HydrophobicContact CB-CG1 4.43Å; L260-I262 HydrophobicContact CD1-CG1 4.24Å; L260-I262 HydrophobicContact CD2-CD1 4.11Å; L260-I262 HydrophobicContact CG-CD1 4.12Å; L260-I262 HydrophobicContact CG-CG1 4.12Å; I262-I265 HydrophobicContact CB-CD1 4.49Å; I262-I265 HydrophobicContact CG2-CB 4.16Å; I262-I265 HydrophobicContact CG2-CD1 3.56Å; I262-I265 HydrophobicContact CG2-CG1 4.37Å; I262-M268 HydrophobicContact CB-CE 4.41Å; I262-M268 HydrophobicContact CG2-CE 3.06Å; I262-M268 HydrophobicContact CG2-SD 4.29Å; I262-L281 HydrophobicContact CD1-CD2 3.83Å; I262-L299 PolarHBondContact N-O 3.2Å; I262-A300 CarbonylContact O-C 3.49Å; I262-A300 WeakPolarHBondContact O-CA 3.32Å; I262-F301 PolarHBondContact O-N 3.26Å; I262-L336 HydrophobicContact CD1-CD2 3.22Å; I262-L336 HydrophobicContact CD1-CG 4.48Å
263	D	93.1	Very high	85.5	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.032	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	142.4	-178.1	-165.5	20	0	0	0	111.4	F162 L185 P187 I195 M268	F162-D263 HydrophobicContact CE1-CB 3.93Å; F162-D263 HydrophobicContact CZ-CB 4.36Å; L185-D263 PolarHBondContact O-N 3.11Å; P187-D263 VanDerWaalsContact CD-O 3.27Å; P187-D263 WeakPolarHBondContact CD-O 3.35Å; I195-D263 HydrophobicContact CD1-CB 4.4Å; D263-M268 WeakPolarHBondContact O-CE 3.29Å
264	E	87.9	Confident	84.6	Confident	17 Å²	17	33.7 Å²	33.7	8%	0.079	18%	0.175	C	C	.	.	S	Bend	trans	55.1	46.8	-168.1	-58.9	-166.9	171.1	0	0	112.5	P187 L191 D266 R267 M268 F301 G445 R472	P187-E264 HydrophobicContact CG-CB 3.81Å; L191-E264 HydrophobicContact CD2-CG 4.01Å; E264-D266 VanDerWaalsContact C-N 3.29Å; E264-D266 PolarHBondContact O-N 3.04Å; E264-R267 HydrophobicContact CB-CB 4.42Å; E264-R267 HydrophobicContact CB-CG 4.41Å; E264-R267 WeakPolarHBondContact O-CB 3.38Å; E264-R267 PolarHBondContact O-N 2.87Å; E264-R267 VanDerWaalsContact O-N 3.07Å; E264-M268 PolarHBondContact O-N 3.23Å; E264-F301 WeakPolarHBondContact CA-O 3.27Å; E264-F301 PolarHBondContact N-O 3.06Å; E264-G445 WeakPolarHBondContact OE1-CA 3.36Å; E264-R472 IonicContact OE1-NH2 2.86Å
265	I	88	Confident	84.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.3	-38.3	-178	-177.8	63.8	0	0	0	113.2	I262 R267 M268 V269 L277 F301 L305 L332 L336	I262-I265 HydrophobicContact CB-CD1 4.49Å; I262-I265 HydrophobicContact CG2-CB 4.16Å; I262-I265 HydrophobicContact CG2-CD1 3.56Å; I262-I265 HydrophobicContact CG2-CG1 4.37Å; I265-R267 PolarHBondContact O-N 2.88Å; I265-R267 VanDerWaalsContact O-N 3.17Å; I265-M268 PolarHBondContact O-N 2.99Å; I265-V269 HydrophobicContact CD1-CG1 3.67Å; I265-V269 HydrophobicContact CG1-CG1 4.1Å; I265-V269 WeakPolarHBondContact O-CG2 3.22Å; I265-V269 PolarHBondContact O-N 3.38Å; I265-V269 VanDerWaalsContact O-N 3.1Å; I265-L277 HydrophobicContact CD1-CD2 4.42Å; I265-F301 PolarHBondContact N-O 3.02Å; I265-F301 VanDerWaalsContact N-O 3.11Å; I265-L305 HydrophobicContact CG2-CD2 4.47Å; I265-L332 HydrophobicContact CD1-CD2 4.38Å; I265-L332 HydrophobicContact CG1-CD2 3.64Å; I265-L332 HydrophobicContact CG2-CD1 4.5Å; I265-L336 HydrophobicContact CD1-CD2 3.87Å; I265-L336 HydrophobicContact CG1-CD1 4.48Å
266	D	81.9	Confident	83.8	Confident	6 Å²	6	42 Å²	42	3%	0.032	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-36.1	176.4	49.9	-4.8	0	0	0	111.9	E264 E270 S302 T304 H468	E264-D266 VanDerWaalsContact C-N 3.29Å; E264-D266 PolarHBondContact O-N 3.04Å; D266-E270 WeakPolarHBondContact O-CG 3.35Å; D266-S302 WeakPolarHBondContact CB-OG 3.36Å; D266-S302 PolarHBondContact OD2-OG 2.86Å; D266-T304 PolarHBondContact OD2-N 2.97Å; D266-T304 VanDerWaalsContact OD2-N 3.13Å; D266-T304 PolarHBondContact OD2-OG1 3.23Å; D266-H468 IonicContact OD2-CE1 2.73Å; D266-H468 IonicContact OD2-NE2 3.37Å
267	R	76.8	Confident	83.8	Confident	5 Å²	5	40 Å²	40	2%	0.019	20%	0.204	C	C	.	.	H	α-helix	trans	-78.3	-39.2	176.6	-66.5	-73.4	153.1	-151.3	-17.4	112.9	E264 I265 V269 E270 H468	E264-R267 HydrophobicContact CB-CB 4.42Å; E264-R267 HydrophobicContact CB-CG 4.41Å; E264-R267 WeakPolarHBondContact O-CB 3.38Å; E264-R267 PolarHBondContact O-N 2.87Å; E264-R267 VanDerWaalsContact O-N 3.07Å; I265-R267 PolarHBondContact O-N 2.88Å; I265-R267 VanDerWaalsContact O-N 3.17Å; R267-V269 VanDerWaalsContact C-N 3.25Å; R267-V269 PolarHBondContact O-N 3.3Å; R267-E270 IonicContact CZ-OE1 3.14Å; R267-E270 VanDerWaalsContact CZ-OE1 3.23Å; R267-E270 IonicContact CZ-OE2 2.82Å; R267-E270 IonicContact NH1-OE1 3.74Å; R267-E270 PolarHBondContact NH1-OE1 3.06Å; R267-E270 IonicContact NH1-OE2 3.12Å; R267-E270 PolarHBondContact NH1-OE2 3.24Å; R267-E270 IonicContact NH2-OE1 2.68Å; R267-E270 PolarHBondContact O-N 2.89Å; R267-H468 PolarHBondContact NE-CD2 3.12Å; R267-H468 PolarHBondContact NE-NE2 3Å; R267-H468 PolarHBondContact NH2-CD2 3.32Å; R267-H468 PolarHBondContact NH2-NE2 3.29Å
268	M	84	Confident	83.6	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-71.6	-23.2	-176.1	-72.6	-177.9	-70.7	0	0	113	P187 P237 I262 D263 E264 I265 F274 L277	P187-M268 HydrophobicContact CB-CG 3.75Å; P187-M268 HydrophobicContact CB-SD 4.46Å; P187-M268 HydrophobicContact CG-CG 4.27Å; P237-M268 HydrophobicContact CG-SD 4.04Å; I262-M268 HydrophobicContact CB-CE 4.41Å; I262-M268 HydrophobicContact CG2-CE 3.06Å; I262-M268 HydrophobicContact CG2-SD 4.29Å; D263-M268 WeakPolarHBondContact O-CE 3.29Å; E264-M268 PolarHBondContact O-N 3.23Å; I265-M268 PolarHBondContact O-N 2.99Å; M268-F274 HydrophobicContact CB-CD2 3.98Å; M268-F274 HydrophobicContact CB-CE2 4.34Å; M268-F274 HydrophobicContact CG-CD2 3.95Å; M268-F274 HydrophobicContact CG-CE2 3.87Å; M268-F274 HydrophobicContact CG-CZ 4.5Å; M268-L277 HydrophobicContact CB-CD2 3.59Å
269	V	82.1	Confident	83.4	Confident	50 Å²	50	44.7 Å²	44.7	30%	0.303	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-0.9	175.9	-54.7	0	0	0	0	113.8	I265 R267 K271 L277 L332 L335	I265-V269 HydrophobicContact CD1-CG1 3.67Å; I265-V269 HydrophobicContact CG1-CG1 4.1Å; I265-V269 WeakPolarHBondContact O-CG2 3.22Å; I265-V269 PolarHBondContact O-N 3.38Å; I265-V269 VanDerWaalsContact O-N 3.1Å; R267-V269 VanDerWaalsContact C-N 3.25Å; R267-V269 PolarHBondContact O-N 3.3Å; V269-K271 PolarHBondContact O-N 3.42Å; V269-L277 HydrophobicContact CG1-CD2 4.25Å; V269-L332 HydrophobicContact CG1-CD2 3.96Å; V269-L332 HydrophobicContact CG2-CD2 4.14Å; V269-L335 HydrophobicContact CB-CD2 4.38Å; V269-L335 HydrophobicContact CG1-CD2 3.49Å; V269-L335 VanDerWaalsContact CG1-CD2 3.49Å
270	E	75.5	Confident	83.1	Confident	46 Å²	46	43.1 Å²	43.1	22%	0.215	23%	0.227	C	C	.	.	S	Bend	trans	-62.2	137.2	174.3	-78	179.6	158.7	0	0	110.2	D266 R267 G272 H273	D266-E270 WeakPolarHBondContact O-CG 3.35Å; R267-E270 IonicContact CZ-OE1 3.14Å; R267-E270 VanDerWaalsContact CZ-OE1 3.23Å; R267-E270 IonicContact CZ-OE2 2.82Å; R267-E270 IonicContact NH1-OE1 3.74Å; R267-E270 PolarHBondContact NH1-OE1 3.06Å; R267-E270 IonicContact NH1-OE2 3.12Å; R267-E270 PolarHBondContact NH1-OE2 3.24Å; R267-E270 IonicContact NH2-OE1 2.68Å; R267-E270 PolarHBondContact O-N 2.89Å; E270-G272 PolarHBondContact O-N 3.16Å; E270-H273 VanDerWaalsContact CB-CD2 3.47Å; E270-H273 WeakPolarHBondContact CB-CD2 3.35Å; E270-H273 PolarHBondContact O-N 3.39Å; E270-H273 IonicContact OE2-CD2 3.25Å; E270-H273 IonicContact OE2-NE2 2.78Å
271	K	67.5	Low	82.8	Confident	209 Å²	209	43.2 Å²	43.2	91%	0.909	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	131.9	179.6	-70.2	-172	176.4	-172.3	0	110.5	V269	V269-K271 PolarHBondContact O-N 3.42Å
272	G	65.5	Low	82.4	Confident	78 Å²	78	49.7 Å²	49.7	80%	0.804	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	-1	178	0	0	0	0	0	115.7	E270	E270-G272 PolarHBondContact O-N 3.16Å
273	H	65.5	Low	82	Confident	76 Å²	76	52.6 Å²	52.6	35%	0.352	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-42.8	-175.7	-78.2	-78.1	0	0	0	115	E270 R444	E270-H273 VanDerWaalsContact CB-CD2 3.47Å; E270-H273 WeakPolarHBondContact CB-CD2 3.35Å; E270-H273 PolarHBondContact O-N 3.39Å; E270-H273 IonicContact OE2-CD2 3.25Å; E270-H273 IonicContact OE2-NE2 2.78Å; H273-R444 PolarHBondContact CE1-NH1 2.85Å
274	F	68.8	Low	81.9	Confident	35 Å²	35	52.3 Å²	52.3	15%	0.154	27%	0.269	C	S	.	.			trans	-151.1	77	-176.2	-57.3	-85.5	0	0	0	112.5	P187 P237 M268 E276 L277	P187-F274 HydrophobicContact CB-CE2 3.88Å; P187-F274 HydrophobicContact CB-CZ 3.74Å; P187-F274 WeakPolarHBondContact O-CZ 3.48Å; P237-F274 HydrophobicContact CB-CD1 3.99Å; P237-F274 HydrophobicContact CG-CD1 3.9Å; P237-F274 HydrophobicContact CG-CE1 4.32Å; P237-F274 HydrophobicContact CG-CG 4.37Å; M268-F274 HydrophobicContact CB-CD2 3.98Å; M268-F274 HydrophobicContact CB-CE2 4.34Å; M268-F274 HydrophobicContact CG-CD2 3.95Å; M268-F274 HydrophobicContact CG-CE2 3.87Å; M268-F274 HydrophobicContact CG-CZ 4.5Å; F274-E276 WeakPolarHBondContact CA-OE2 3.35Å; F274-E276 PolarHBondContact O-N 2.93Å; F274-L277 HydrophobicContact CB-CB 3.69Å; F274-L277 WeakPolarHBondContact O-CB 3.47Å; F274-L277 PolarHBondContact O-N 3.16Å; F274-L277 VanDerWaalsContact O-N 3.07Å
275	E	80.9	Confident	81.8	Confident	147 Å²	147	53.6 Å²	53.6	69%	0.687	28%	0.276	S	S	*	.	H	α-helix	trans	-60.4	-32.1	170	-66.2	-171.2	169.2	0	0	111.1	L277 N278 N279	E275-L277 PolarHBondContact O-N 3.31Å; E275-N278 WeakPolarHBondContact O-CB 3.48Å; E275-N278 PolarHBondContact O-N 3.11Å; E275-N279 PolarHBondContact O-N 3.07Å; E275-N279 VanDerWaalsContact O-N 3.15Å
276	E	83.6	Confident	81.5	Confident	73 Å²	73	55.4 Å²	55.4	34%	0.341	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-26	175.7	-50.9	91.2	150.4	0	0	112.5	W241 F274 M280	W241-E276 HydrophobicContact CB-CB 4.01Å; W241-E276 HydrophobicContact CG-CB 4.04Å; W241-E276 HydrophobicContact CG-CG 4.49Å; F274-E276 WeakPolarHBondContact CA-OE2 3.35Å; F274-E276 PolarHBondContact O-N 2.93Å; E276-M280 WeakPolarHBondContact O-CB 3.28Å; E276-M280 PolarHBondContact O-N 3.12Å
277	L	88.3	Confident	80.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-45.3	171.9	-179.7	74.7	0	0	0	110.3	L185 P237 I265 M268 V269 F274 E275 N279 M280 L281	L185-L277 HydrophobicContact CD1-CD1 3.84Å; P237-L277 HydrophobicContact CB-CB 4.33Å; P237-L277 HydrophobicContact CG-CB 4.48Å; P237-L277 HydrophobicContact CG-CD1 4.11Å; I265-L277 HydrophobicContact CD1-CD2 4.42Å; M268-L277 HydrophobicContact CB-CD2 3.59Å; V269-L277 HydrophobicContact CG1-CD2 4.25Å; F274-L277 HydrophobicContact CB-CB 3.69Å; F274-L277 WeakPolarHBondContact O-CB 3.47Å; F274-L277 PolarHBondContact O-N 3.16Å; F274-L277 VanDerWaalsContact O-N 3.07Å; E275-L277 PolarHBondContact O-N 3.31Å; L277-N279 VanDerWaalsContact C-N 3.32Å; L277-N279 PolarHBondContact O-N 2.87Å; L277-M280 PolarHBondContact O-N 3.1Å; L277-L281 HydrophobicContact CD1-CD1 4.24Å; L277-L281 HydrophobicContact CD1-CG 4.21Å; L277-L281 HydrophobicContact CD2-CD1 4.21Å; L277-L281 HydrophobicContact CG-CD1 3.87Å; L277-L281 HydrophobicContact CG-CG 4.18Å; L277-L281 WeakPolarHBondContact O-CB 3.43Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.4Å; L277-L281 PolarHBondContact O-N 3.25Å
278	N	87.8	Confident	79.4	Confident	74 Å²	74	61 Å²	61	40%	0.396	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-43.8	179.3	-67.3	-36	0	0	0	110.6	E275 M280 L281 H282 L335	E275-N278 WeakPolarHBondContact O-CB 3.48Å; E275-N278 PolarHBondContact O-N 3.11Å; N278-M280 PolarHBondContact O-N 2.87Å; N278-L281 PolarHBondContact O-N 3.2Å; N278-H282 VanDerWaalsContact O-CB 3.24Å; N278-H282 WeakPolarHBondContact O-CB 3.22Å; N278-H282 PolarHBondContact O-N 3.04Å; N278-L335 WeakPolarHBondContact OD1-CD1 3.15Å
279	N	89.1	Confident	77.6	Confident	81 Å²	81	71.1 Å²	71.1	43%	0.433	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-45.4	175.6	-65.4	-19.5	0	0	0	111.5	W241 E275 L277 H282 F283	W241-N279 HydrophobicContact CD2-CB 4.25Å; W241-N279 HydrophobicContact CE3-CB 4.48Å; W241-N279 HydrophobicContact CH2-CB 3.94Å; W241-N279 HydrophobicContact CZ2-CB 3.68Å; W241-N279 HydrophobicContact CZ3-CB 4.35Å; E275-N279 PolarHBondContact O-N 3.07Å; E275-N279 VanDerWaalsContact O-N 3.15Å; L277-N279 VanDerWaalsContact C-N 3.32Å; L277-N279 PolarHBondContact O-N 2.87Å; N279-H282 PolarHBondContact O-N 3.23Å; N279-F283 VanDerWaalsContact O-CB 3.27Å; N279-F283 WeakPolarHBondContact O-CB 3.45Å; N279-F283 PolarHBondContact O-N 3.08Å
280	M	89	Confident	76.1	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-62.4	-48.9	176.8	-175.7	63.6	82.6	0	0	111.7	L185 I240 W241 V244 E276 L277 N278 H282 F283 L284	L185-M280 HydrophobicContact CD1-CG 4.47Å; I240-M280 HydrophobicContact CB-CE 4.15Å; I240-M280 HydrophobicContact CD1-CE 4.38Å; I240-M280 HydrophobicContact CG1-CE 3.85Å; I240-M280 HydrophobicContact CG2-CE 3.61Å; W241-M280 HydrophobicContact CB-CE 4.08Å; W241-M280 HydrophobicContact CE3-CB 3.93Å; W241-M280 HydrophobicContact CE3-CE 3.69Å; W241-M280 HydrophobicContact CE3-SD 3.86Å; W241-M280 HydrophobicContact CZ3-CB 4.4Å; W241-M280 HydrophobicContact CZ3-SD 4.21Å; V244-M280 HydrophobicContact CG2-CE 4.16Å; E276-M280 WeakPolarHBondContact O-CB 3.28Å; E276-M280 PolarHBondContact O-N 3.12Å; L277-M280 PolarHBondContact O-N 3.1Å; N278-M280 PolarHBondContact O-N 2.87Å; M280-H282 PolarHBondContact O-N 3.14Å; M280-F283 WeakPolarHBondContact O-CB 3.4Å; M280-F283 PolarHBondContact O-N 3.18Å; M280-F283 HydrophobicContact SD-CD1 4.48Å; M280-L284 HydrophobicContact CG-CD1 3.91Å; M280-L284 HydrophobicContact CG-CG 4.24Å; M280-L284 WeakPolarHBondContact O-CB 3.39Å; M280-L284 WeakPolarHBondContact O-CG 3.37Å; M280-L284 PolarHBondContact O-N 3.27Å; M280-L284 HydrophobicContact SD-CD1 4.3Å; M280-L284 HydrophobicContact SD-CD2 4.49Å; M280-L284 HydrophobicContact SD-CG 4.17Å
281	L	90.5	Very high	75.1	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	40%	0.395	C	S	.	.	H	α-helix	trans	-62.9	-44.2	179.3	-70.5	177	0	0	0	111	L260 I262 L277 N278 F283 L284 N285 L335 L336	L260-L281 HydrophobicContact CD2-CD2 4.09Å; I262-L281 HydrophobicContact CD1-CD2 3.83Å; L277-L281 HydrophobicContact CD1-CD1 4.24Å; L277-L281 HydrophobicContact CD1-CG 4.21Å; L277-L281 HydrophobicContact CD2-CD1 4.21Å; L277-L281 HydrophobicContact CG-CD1 3.87Å; L277-L281 HydrophobicContact CG-CG 4.18Å; L277-L281 WeakPolarHBondContact O-CB 3.43Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.4Å; L277-L281 PolarHBondContact O-N 3.25Å; N278-L281 PolarHBondContact O-N 3.2Å; L281-F283 VanDerWaalsContact C-N 3.33Å; L281-F283 PolarHBondContact O-N 3.01Å; L281-L284 PolarHBondContact O-N 3.42Å; L281-N285 WeakPolarHBondContact O-CB 3.5Å; L281-N285 PolarHBondContact O-N 3.13Å; L281-N285 PolarHBondContact O-ND2 3.28Å; L281-L335 HydrophobicContact CD1-CD1 4.19Å; L281-L335 HydrophobicContact CD1-CD2 4.38Å; L281-L335 HydrophobicContact CD1-CG 3.87Å; L281-L336 HydrophobicContact CD1-CD2 3.94Å; L281-L336 HydrophobicContact CD2-CD2 4.3Å
282	H	88.6	Confident	74.7	Confident	137 Å²	137	62.9 Å²	62.9	63%	0.634	36%	0.361	S	S	*	.	H	α-helix	trans	-57.8	-47.1	174	-177.5	-85.1	0	0	0	111.1	N278 N279 M280 N285 S286	N278-H282 VanDerWaalsContact O-CB 3.24Å; N278-H282 WeakPolarHBondContact O-CB 3.22Å; N278-H282 PolarHBondContact O-N 3.04Å; N279-H282 PolarHBondContact O-N 3.23Å; M280-H282 PolarHBondContact O-N 3.14Å; H282-N285 PolarHBondContact O-N 3.17Å; H282-S286 PolarHBondContact CE1-OG 2.97Å; H282-S286 PolarHBondContact ND1-OG 3.36Å; H282-S286 WeakPolarHBondContact O-CB 3.46Å; H282-S286 PolarHBondContact O-N 2.95Å; H282-S286 PolarHBondContact O-OG 3.48Å
283	F	88.9	Confident	74.3	Confident	62 Å²	62	60.1 Å²	60.1	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-46.3	177.1	175.9	-104.6	0	0	0	112.7	W241 V244 I254 K255 N279 M280 L281 N285	W241-F283 HydrophobicContact CH2-CB 4.12Å; W241-F283 HydrophobicContact CH2-CG 4.49Å; W241-F283 HydrophobicContact CZ3-CB 3.8Å; W241-F283 HydrophobicContact CZ3-CD1 4.39Å; W241-F283 HydrophobicContact CZ3-CG 4.13Å; V244-F283 HydrophobicContact CG1-CD1 4.32Å; V244-F283 HydrophobicContact CG1-CE1 3.85Å; V244-F283 HydrophobicContact CG1-CZ 4.15Å; I254-F283 HydrophobicContact CG2-CE1 3.79Å; K255-F283 HydrophobicContact CB-CE1 4.08Å; K255-F283 HydrophobicContact CB-CZ 4.28Å; K255-F283 HydrophobicContact CD-CE2 4.43Å; K255-F283 HydrophobicContact CD-CZ 4.31Å; K255-F283 VanDerWaalsContact CE-O 3.26Å; K255-F283 WeakPolarHBondContact CE-O 3.48Å; N279-F283 VanDerWaalsContact O-CB 3.27Å; N279-F283 WeakPolarHBondContact O-CB 3.45Å; N279-F283 PolarHBondContact O-N 3.08Å; M280-F283 WeakPolarHBondContact O-CB 3.4Å; M280-F283 PolarHBondContact O-N 3.18Å; M280-F283 HydrophobicContact SD-CD1 4.48Å; L281-F283 VanDerWaalsContact C-N 3.33Å; L281-F283 PolarHBondContact O-N 3.01Å; F283-N285 VanDerWaalsContact C-N 3.32Å; F283-N285 PolarHBondContact O-N 3.1Å
284	L	89.6	Confident	74.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.7	-31.1	177.5	-67.9	177.5	0	0	0	112.5	L183 I254 L260 M280 L281 R296	L183-L284 HydrophobicContact CD2-CD1 4.01Å; I254-L284 WeakPolarHBondContact O-CD2 3.4Å; L260-L284 HydrophobicContact CD1-CD1 4.08Å; L260-L284 HydrophobicContact CD2-CD1 4.13Å; M280-L284 HydrophobicContact CG-CD1 3.91Å; M280-L284 HydrophobicContact CG-CG 4.24Å; M280-L284 WeakPolarHBondContact O-CB 3.39Å; M280-L284 WeakPolarHBondContact O-CG 3.37Å; M280-L284 PolarHBondContact O-N 3.27Å; M280-L284 HydrophobicContact SD-CD1 4.3Å; M280-L284 HydrophobicContact SD-CD2 4.49Å; M280-L284 HydrophobicContact SD-CG 4.17Å; L281-L284 PolarHBondContact O-N 3.42Å; L284-R296 PolarHBondContact O-NH1 3.16Å
285	N	86.6	Confident	74.6	Confident	43 Å²	43	70 Å²	70	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-89.9	-18.5	-177.8	-67.2	-18.2	0	0	0	113.2	L281 H282 F283 S287 R296 L335	L281-N285 WeakPolarHBondContact O-CB 3.5Å; L281-N285 PolarHBondContact O-N 3.13Å; L281-N285 PolarHBondContact O-ND2 3.28Å; H282-N285 PolarHBondContact O-N 3.17Å; F283-N285 VanDerWaalsContact C-N 3.32Å; F283-N285 PolarHBondContact O-N 3.1Å; N285-S287 PolarHBondContact O-N 3.11Å; N285-S287 VanDerWaalsContact O-N 3.09Å; N285-R296 PolarHBondContact OD1-NH2 2.8Å; N285-L335 PolarHBondContact ND2-O 3.4Å
286	S	81.9	Confident	75.1	Confident	38 Å²	38	63.3 Å²	63.3	27%	0.266	34%	0.34	S	S	.	.			trans	-63.5	107.7	-179.8	-68.7	0	0	0	0	110.6	K255 H282 P288	K255-S286 WeakPolarHBondContact CE-O 3.39Å; K255-S286 PolarHBondContact NZ-O 2.71Å; H282-S286 PolarHBondContact CE1-OG 2.97Å; H282-S286 PolarHBondContact ND1-OG 3.36Å; H282-S286 WeakPolarHBondContact O-CB 3.46Å; H282-S286 PolarHBondContact O-N 2.95Å; H282-S286 PolarHBondContact O-OG 3.48Å; S286-P288 WeakPolarHBondContact O-CD 3.49Å
287	S	60.9	Low	75.7	Confident	63 Å²	63	60.4 Å²	60.4	44%	0.441	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-85.9	127.7	-173.4	-170.9	0	0	0	0	113.5	N285 S291	N285-S287 PolarHBondContact O-N 3.11Å; N285-S287 VanDerWaalsContact O-N 3.09Å; S287-S291 PolarHBondContact OG-OG 2.8Å
288	P	52.9	Low	76	Confident	65 Å²	65	60.5 Å²	60.5	42%	0.422	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-79	139	145.9	-10.3	26	0	0	0	109.5	S286 G290 S291	S286-P288 WeakPolarHBondContact O-CD 3.49Å; P288-G290 PolarHBondContact O-N 3.46Å; P288-S291 VanDerWaalsContact O-CB 3.23Å; P288-S291 WeakPolarHBondContact O-CB 3.49Å; P288-S291 PolarHBondContact O-N 3.32Å; P288-S291 PolarHBondContact O-OG 3.03Å
289	K	45.8	Very low	76.5	Confident	216 Å²	216	57 Å²	57	94%	0.939	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	124.4	175.1	-67.9	-178.1	179	179.1	0	110.1
290	G	51.7	Low	76.8	Confident	84 Å²	84	53.1 Å²	53.1	87%	0.866	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	1.4	-179.6	0	0	0	0	0	116.3	P288	P288-G290 PolarHBondContact O-N 3.46Å
291	S	53.2	Low	77	Confident	20 Å²	20	53.1 Å²	53.1	14%	0.14	29%	0.288	C	S	.	.			trans	-70.7	152.6	-179.4	61.7	0	0	0	0	114.1	S287 P288 V293	S287-S291 PolarHBondContact OG-OG 2.8Å; P288-S291 VanDerWaalsContact O-CB 3.23Å; P288-S291 WeakPolarHBondContact O-CB 3.49Å; P288-S291 PolarHBondContact O-N 3.32Å; P288-S291 PolarHBondContact O-OG 3.03Å; S291-V293 PolarHBondContact O-N 2.91Å
292	S	59.7	Low	76.9	Confident	28 Å²	28	53.1 Å²	53.1	20%	0.196	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.9	-4.4	178	62.8	0	0	0	0	114.2	Y177 N256 H294 K295 R296	Y177-S292 PolarHBondContact OH-OG 3.24Å; N256-S292 PolarHBondContact O-OG 3.21Å; S292-H294 PolarHBondContact O-N 3.39Å; S292-K295 CarbonylContact O-C 3.6Å; S292-K295 WeakPolarHBondContact O-CA 3.46Å; S292-K295 WeakPolarHBondContact O-CB 3.35Å; S292-K295 PolarHBondContact O-N 3.32Å; S292-R296 PolarHBondContact O-N 3.09Å
293	V	56.6	Low	76.5	Confident	19 Å²	19	46.8 Å²	46.8	12%	0.115	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-53.4	-40.3	178.2	180	0	0	0	0	111.4	S291 K295 R296	S291-V293 PolarHBondContact O-N 2.91Å; V293-K295 PolarHBondContact O-N 3.37Å; V293-R296 WeakPolarHBondContact O-CB 3.42Å; V293-R296 PolarHBondContact O-N 3.4Å; V293-R296 VanDerWaalsContact O-N 3.17Å
294	H	61.9	Low	75.9	Confident	141 Å²	141	43.9 Å²	43.9	65%	0.653	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-69.1	-17	177	-67.2	-66	0	0	0	114	S292	S292-H294 PolarHBondContact O-N 3.39Å
295	K	80.2	Confident	75.1	Confident	178 Å²	178	44.2 Å²	44.2	77%	0.774	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-98.1	-8.2	175.7	-62.8	-175.2	178.9	-179.5	0	112.9	S292 V293	S292-K295 CarbonylContact O-C 3.6Å; S292-K295 WeakPolarHBondContact O-CA 3.46Å; S292-K295 WeakPolarHBondContact O-CB 3.35Å; S292-K295 PolarHBondContact O-N 3.32Å; V293-K295 PolarHBondContact O-N 3.37Å
296	R	90.9	Very high	74.1	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.026	25%	0.252	C	S	.	.			trans	-66.3	136.2	179.9	-175.8	172.3	67.7	-142.9	-2.3	110.8	V257 R258 L284 N285 S292 V293 R339	V257-R296 WeakPolarHBondContact O-CD 3.25Å; V257-R296 VanDerWaalsContact O-CG 3.3Å; V257-R296 WeakPolarHBondContact O-CG 3.38Å; R258-R296 CarbonylContact O-C 3.58Å; R258-R296 WeakPolarHBondContact O-CA 3.31Å; R258-R296 WeakPolarHBondContact O-CG 3.18Å; L284-R296 PolarHBondContact O-NH1 3.16Å; N285-R296 PolarHBondContact OD1-NH2 2.8Å; S292-R296 PolarHBondContact O-N 3.09Å; V293-R296 WeakPolarHBondContact O-CB 3.42Å; V293-R296 PolarHBondContact O-N 3.4Å; V293-R296 VanDerWaalsContact O-N 3.17Å; R296-R339 PolarHBondContact O-NE 3.05Å
297	Q	95	Very high	73.3	Confident	11 Å²	11	43.4 Å²	43.4	5%	0.051	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.5	169	-176.1	-178.7	42.9	0	0	110	A141 M146 D147 R258 Y259 L260 L299	A141-Q297 PolarHBondContact O-NE2 3.19Å; M146-Q297 PolarHBondContact O-NE2 2.94Å; D147-Q297 WeakPolarHBondContact OD1-CA 3.24Å; R258-Q297 PolarHBondContact O-N 3.03Å; Y259-Q297 WeakPolarHBondContact CA-O 3.35Å; Y259-Q297 HydrophobicContact CD1-CB 3.98Å; Y259-Q297 VanDerWaalsContact CD1-OE1 3.29Å; Y259-Q297 HydrophobicContact CE1-CB 4.23Å; L260-Q297 PolarHBondContact N-O 3.07Å; Q297-L299 HydrophobicContact CG-CD2 4.15Å; Q297-L299 HydrophobicContact CG-CG 4.31Å
298	T	95.9	Very high	73.4	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.6	177.5	-55.9	0	0	0	0	110.8	D147 I148 L260 L338	D147-T298 CarbonylContact C-O 3.6Å; D147-T298 VanDerWaalsContact CA-O 3.24Å; D147-T298 WeakPolarHBondContact CA-O 3.49Å; D147-T298 WeakPolarHBondContact CB-O 3.45Å; D147-T298 PolarHBondContact OD1-N 2.92Å; I148-T298 PolarHBondContact N-O 3.32Å; L260-T298 HydrophobicContact CB-CG2 4.41Å; L260-T298 HydrophobicContact CD2-CG2 4.32Å; L260-T298 HydrophobicContact CG-CG2 4.36Å; L260-T298 CarbonylContact O-C 3.53Å; L260-T298 VanDerWaalsContact O-CA 3.26Å; L260-T298 WeakPolarHBondContact O-CA 3.18Å; T298-L338 VanDerWaalsContact CB-CD2 3.5Å; T298-L338 HydrophobicContact CG2-CD2 3.44Å; T298-L338 VanDerWaalsContact CG2-CD2 3.44Å
299	L	97.7	Very high	73.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	104.7	-176.8	-57.7	174	0	0	0	108.9	A141 I148 F162 P165 V166 L260 V261 I262 Q297 F301	A141-L299 HydrophobicContact CB-CD2 4.35Å; I148-L299 HydrophobicContact CB-CD2 3.56Å; I148-L299 HydrophobicContact CG1-CD2 3.37Å; I148-L299 CarbonylContact O-C 3.59Å; I148-L299 WeakPolarHBondContact O-CA 3.35Å; F162-L299 HydrophobicContact CB-CB 4.23Å; F162-L299 HydrophobicContact CB-CD1 4.17Å; P165-L299 HydrophobicContact CB-CD1 4.1Å; P165-L299 HydrophobicContact CG-CD1 4.48Å; V166-L299 HydrophobicContact CG2-CD1 4.24Å; L260-L299 PolarHBondContact O-N 2.82Å; V261-L299 CarbonylContact C-O 3.55Å; V261-L299 VanDerWaalsContact CA-O 3.24Å; V261-L299 WeakPolarHBondContact CA-O 3.27Å; V261-L299 HydrophobicContact CG2-CB 4.22Å; V261-L299 HydrophobicContact CG2-CD1 4.25Å; I262-L299 PolarHBondContact N-O 3.2Å; Q297-L299 HydrophobicContact CG-CD2 4.15Å; Q297-L299 HydrophobicContact CG-CG 4.31Å; L299-F301 HydrophobicContact CB-CE2 4.15Å
300	A	95.8	Very high	74.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.6	-178.8	0	0	0	0	0	111.3	I148 L149 G150 I262 L336	I148-A300 PolarHBondContact O-N 3.44Å; L149-A300 CarbonylContact C-O 3.57Å; L149-A300 WeakPolarHBondContact CA-O 3.37Å; L149-A300 HydrophobicContact CD1-CB 3.78Å; G150-A300 PolarHBondContact N-O 2.91Å; I262-A300 CarbonylContact O-C 3.49Å; I262-A300 WeakPolarHBondContact O-CA 3.32Å; A300-L336 HydrophobicContact CB-CD1 3.44Å; A300-L336 VanDerWaalsContact CB-CD1 3.44Å
301	F	93.8	Very high	74.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.9	-175	-76.5	-90.9	0	0	0	112.1	I133 I148 G150 K158 A161 F162 I262 E264 I265 L299	I133-F301 HydrophobicContact CD1-CE1 4.3Å; I133-F301 HydrophobicContact CG1-CE1 4.08Å; I148-F301 HydrophobicContact CG2-CE1 4.49Å; I148-F301 HydrophobicContact CG2-CE2 4.35Å; I148-F301 HydrophobicContact CG2-CZ 3.89Å; G150-F301 CarbonylContact O-C 3.51Å; G150-F301 VanDerWaalsContact O-CA 3.25Å; G150-F301 WeakPolarHBondContact O-CA 3.27Å; K158-F301 HydrophobicContact CB-CD1 4.12Å; K158-F301 HydrophobicContact CD-CB 4.17Å; K158-F301 HydrophobicContact CD-CD1 3.98Å; K158-F301 HydrophobicContact CG-CD1 4.13Å; A161-F301 HydrophobicContact CB-CE1 4.07Å; A161-F301 HydrophobicContact CB-CZ 4Å; F162-F301 HydrophobicContact CB-CD2 3.96Å; F162-F301 HydrophobicContact CB-CE2 3.61Å; F162-F301 HydrophobicContact CB-CZ 4.45Å; F162-F301 AromaticContact CD1-CD2 3.93Å; F162-F301 HydrophobicContact CD1-CD2 3.93Å; F162-F301 HydrophobicContact CD1-CE2 4.33Å; F162-F301 HydrophobicContact CD1-CG 4.45Å; F162-F301 HydrophobicContact CG-CD2 4.44Å; F162-F301 HydrophobicContact CG-CE2 4.5Å; I262-F301 PolarHBondContact O-N 3.26Å; E264-F301 WeakPolarHBondContact CA-O 3.27Å; E264-F301 PolarHBondContact N-O 3.06Å; I265-F301 PolarHBondContact N-O 3.02Å; I265-F301 VanDerWaalsContact N-O 3.11Å; L299-F301 HydrophobicContact CB-CE2 4.15Å
302	S	88.4	Confident	74.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	163	177	147.6	0	0	0	0	111	G150 A151 A152 D266 T304 L305	G150-S302 PolarHBondContact O-N 3Å; A151-S302 WeakPolarHBondContact CA-O 3.26Å; A152-S302 PolarHBondContact N-O 2.58Å; D266-S302 WeakPolarHBondContact CB-OG 3.36Å; D266-S302 PolarHBondContact OD2-OG 2.86Å; S302-T304 PolarHBondContact OG-N 2.81Å; S302-L305 PolarHBondContact OG-N 3.15Å
303	A	79.3	Confident	74.9	Confident	4 Å²	4	47 Å²	47	3%	0.033	24%	0.239	C	C	.	.	S	Bend	trans	-99	-17	172	0	0	0	0	0	113.7	A152 T154 T348	A152-A303 VanDerWaalsContact O-CA 3.28Å; A152-A303 WeakPolarHBondContact O-CA 3.4Å; T154-A303 HydrophobicContact CG2-CB 4.36Å; A303-T348 WeakPolarHBondContact O-CG2 3.44Å
304	T	75.7	Confident	75.2	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	27%	0.273	C	S	.	.			trans	-132.1	34.9	-169.4	65.2	0	0	0	0	113	D266 S302 T306 F307 K328 E464 V467	D266-T304 PolarHBondContact OD2-N 2.97Å; D266-T304 VanDerWaalsContact OD2-N 3.13Å; D266-T304 PolarHBondContact OD2-OG1 3.23Å; S302-T304 PolarHBondContact OG-N 2.81Å; T304-T306 VanDerWaalsContact C-N 3.26Å; T304-T306 PolarHBondContact O-N 2.85Å; T304-F307 VanDerWaalsContact CB-CD2 3.48Å; T304-F307 HydrophobicContact CG2-CD2 3.76Å; T304-F307 HydrophobicContact CG2-CE2 4.03Å; T304-F307 HydrophobicContact CG2-CG 4.25Å; T304-F307 PolarHBondContact O-N 2.79Å; T304-F307 VanDerWaalsContact O-N 3.1Å; T304-K328 PolarHBondContact O-NZ 2.86Å; T304-E464 HydrophobicContact CG2-CB 4.02Å; T304-E464 HydrophobicContact CG2-CG 4.2Å; T304-V467 HydrophobicContact CG2-CB 4.27Å; T304-V467 HydrophobicContact CG2-CG1 4.12Å
305	L	73.2	Confident	75.1	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.042	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-41.5	179	-78.2	176.3	0	0	0	112.3	L149 A151 I265 S302 F307 K328 L332	L149-L305 HydrophobicContact CD1-CD1 3.84Å; L149-L305 HydrophobicContact CD1-CD2 4.43Å; L149-L305 HydrophobicContact CG-CD1 3.93Å; A151-L305 HydrophobicContact CB-CB 3.89Å; A151-L305 HydrophobicContact CB-CD1 3.63Å; A151-L305 HydrophobicContact CB-CG 4.04Å; I265-L305 HydrophobicContact CG2-CD2 4.47Å; S302-L305 PolarHBondContact OG-N 3.15Å; L305-F307 VanDerWaalsContact C-N 3.33Å; L305-F307 PolarHBondContact O-N 2.78Å; L305-K328 WeakPolarHBondContact O-CD 3.32Å; L305-K328 PolarHBondContact O-NZ 2.97Å; L305-L332 HydrophobicContact CD2-CD1 3.32Å
306	T	66.2	Low	74.1	Confident	49 Å²	49	48.1 Å²	48.1	30%	0.301	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8	-179.9	46	0	0	0	0	115.4	T304 V308 S325 D346 T348	T304-T306 VanDerWaalsContact C-N 3.26Å; T304-T306 PolarHBondContact O-N 2.85Å; T306-V308 PolarHBondContact O-N 2.97Å; T306-S325 PolarHBondContact O-OG 2.82Å; T306-D346 WeakPolarHBondContact CG2-OD2 3.41Å; T306-T348 PolarHBondContact OG1-OG1 2.66Å
307	F	65.4	Low	72.9	Confident	14 Å²	14	51.8 Å²	51.8	6%	0.061	27%	0.272	C	S	.	.			trans	-81.2	117.4	179.6	-72.1	-103.4	0	0	0	109.8	T304 L305 K328 S351 E464 V467 T500	T304-F307 VanDerWaalsContact CB-CD2 3.48Å; T304-F307 HydrophobicContact CG2-CD2 3.76Å; T304-F307 HydrophobicContact CG2-CE2 4.03Å; T304-F307 HydrophobicContact CG2-CG 4.25Å; T304-F307 PolarHBondContact O-N 2.79Å; T304-F307 VanDerWaalsContact O-N 3.1Å; L305-F307 VanDerWaalsContact C-N 3.33Å; L305-F307 PolarHBondContact O-N 2.78Å; F307-K328 PolarHBondContact O-NZ 3.5Å; F307-S351 WeakPolarHBondContact CZ-O 3.47Å; F307-E464 HydrophobicContact CB-CG 3.52Å; F307-E464 WeakPolarHBondContact CB-OE1 3.14Å; F307-E464 HydrophobicContact CD1-CG 4.24Å; F307-E464 HydrophobicContact CG-CG 4Å; F307-V467 HydrophobicContact CE1-CG2 4.09Å; F307-V467 HydrophobicContact CZ-CG2 3.92Å; F307-T500 HydrophobicContact CD1-CG2 3.79Å; F307-T500 HydrophobicContact CE1-CG2 3.88Å
308	V	63.2	Low	71.7	Confident	49 Å²	49	59.1 Å²	59.1	30%	0.297	30%	0.304	S	S	.	.			trans	-115.9	128.7	172.3	-169.2	0	0	0	0	109.5	T306 M323 S325	T306-V308 PolarHBondContact O-N 2.97Å; V308-M323 HydrophobicContact CG1-CB 4.44Å; V308-M323 WeakPolarHBondContact CG1-O 3.43Å; V308-S325 WeakPolarHBondContact CG2-OG 3.47Å
309	H	62.3	Low	70	Confident	93 Å²	93	68.2 Å²	68.2	43%	0.431	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-73.2	131.4	175.1	-50.5	-67.4	0	0	0	111.5	L311 E464	H309-L311 PolarHBondContact O-N 3.48Å; H309-E464 IonicContact CE1-OE1 3.14Å; H309-E464 PolarHBondContact CE1-OE1 3.28Å; H309-E464 IonicContact CE1-OE2 3.55Å; H309-E464 PolarHBondContact CE1-OE2 3Å; H309-E464 IonicContact CG-OE1 2.76Å; H309-E464 VanDerWaalsContact ND1-CD 3.33Å; H309-E464 IonicContact ND1-OE1 2.76Å; H309-E464 PolarHBondContact ND1-OE1 3.02Å; H309-E464 IonicContact ND1-OE2 3.77Å; H309-E464 PolarHBondContact ND1-OE2 3.34Å; H309-E464 VanDerWaalsContact ND1-OE2 3.15Å; H309-E464 IonicContact NE2-OE1 3.28Å
310	P	57.2	Low	68.1	Low	103 Å²	103	73.3 Å²	73.3	67%	0.669	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-65.2	127.9	167.3	24.6	-30.1	0	0	0	109.8
311	L	53.8	Low	66.5	Low	42 Å²	42	81.6 Å²	81.6	22%	0.22	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-58.2	141	178	-78.4	173.9	0	0	0	111.2	H309 K313 L315 L316 M320 Q321 P322	H309-L311 PolarHBondContact O-N 3.48Å; L311-K313 PolarHBondContact O-N 3.37Å; L311-L315 HydrophobicContact CD2-CB 4.45Å; L311-L315 HydrophobicContact CD2-CD1 4.15Å; L311-L316 HydrophobicContact CB-CD1 4.46Å; L311-L316 HydrophobicContact CB-CD2 3.89Å; L311-L316 HydrophobicContact CB-CG 3.81Å; L311-L316 HydrophobicContact CD1-CD2 4.08Å; L311-L316 WeakPolarHBondContact O-CD1 3.47Å; L311-M320 HydrophobicContact CD1-CB 3.96Å; L311-M320 VanDerWaalsContact CD1-O 3.23Å; L311-M320 WeakPolarHBondContact CD1-O 3.21Å; L311-Q321 VanDerWaalsContact CD1-C 3.5Å; L311-Q321 WeakPolarHBondContact CD1-O 3.38Å; L311-P322 HydrophobicContact CD1-CB 4.12Å; L311-P322 HydrophobicContact CG-CB 4.13Å
312	P	57.8	Low	65.2	Low	80 Å²	80	84.4 Å²	84.4	52%	0.519	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-51.9	136.8	168.9	-23.8	31.2	0	0	0	110.7	R314 L315 L316	P312-R314 PolarHBondContact O-N 2.81Å; P312-L315 HydrophobicContact CG-CD1 4.31Å; P312-L315 PolarHBondContact O-N 3.11Å; P312-L316 PolarHBondContact O-N 3.45Å; P312-L316 VanDerWaalsContact O-N 3.16Å
313	K	62.2	Low	64.4	Low	184 Å²	184	88.9 Å²	88.9	80%	0.8	45%	0.448	S	S	*	.	H	α-helix	trans	-49.1	-30.6	-179.3	-70.4	-170.9	175.2	-169.3	0	114.1	L311 A317	L311-K313 PolarHBondContact O-N 3.37Å; K313-A317 WeakPolarHBondContact O-CB 3.45Å; K313-A317 PolarHBondContact O-N 2.96Å
314	R	63.2	Low	64.4	Low	221 Å²	221	91.5 Å²	91.5	83%	0.834	46%	0.463	S	S	*	.	H	α-helix	trans	-66.3	-37	176.3	-66.9	-178	178.7	164.7	-1.6	113.1	P312 K318	P312-R314 PolarHBondContact O-N 2.81Å; R314-K318 PolarHBondContact O-N 2.95Å
315	L	60	Low	64.4	Low	62 Å²	62	93 Å²	93	33%	0.325	47%	0.473	S	S	.	.	H	α-helix	trans	-78.7	-35.3	177	-63.4	-176	0	0	0	111.4	L311 P312 A317 K318 M320	L311-L315 HydrophobicContact CD2-CB 4.45Å; L311-L315 HydrophobicContact CD2-CD1 4.15Å; P312-L315 HydrophobicContact CG-CD1 4.31Å; P312-L315 PolarHBondContact O-N 3.11Å; L315-A317 VanDerWaalsContact C-N 3.26Å; L315-A317 PolarHBondContact O-N 3.13Å; L315-K318 CarbonylContact O-C 3.57Å; L315-K318 WeakPolarHBondContact O-CA 3.36Å; L315-K318 WeakPolarHBondContact O-CB 3.33Å; L315-K318 PolarHBondContact O-N 3.2Å; L315-M320 PolarHBondContact O-N 2.92Å
316	L	58.1	Low	64.8	Low	80 Å²	80	98.5 Å²	98.5	42%	0.419	50%	0.499	S	S	.	.	H	α-helix	trans	-59.8	-38.2	169.3	-69.1	171.1	0	0	0	111.6	L311 P312 K318 K319	L311-L316 HydrophobicContact CB-CD1 4.46Å; L311-L316 HydrophobicContact CB-CD2 3.89Å; L311-L316 HydrophobicContact CB-CG 3.81Å; L311-L316 HydrophobicContact CD1-CD2 4.08Å; L311-L316 WeakPolarHBondContact O-CD1 3.47Å; P312-L316 PolarHBondContact O-N 3.45Å; P312-L316 VanDerWaalsContact O-N 3.16Å; L316-K318 PolarHBondContact O-N 2.98Å; L316-K319 WeakPolarHBondContact O-CA 3.39Å; L316-K319 PolarHBondContact O-N 3.34Å
317	A	67.1	Low	65.5	Low	84 Å²	84	99.1 Å²	99.1	69%	0.694	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-24.4	173.8	0	0	0	0	0	113.1	K313 L315 K319	K313-A317 WeakPolarHBondContact O-CB 3.45Å; K313-A317 PolarHBondContact O-N 2.96Å; L315-A317 VanDerWaalsContact C-N 3.26Å; L315-A317 PolarHBondContact O-N 3.13Å; A317-K319 PolarHBondContact O-N 3.3Å
318	K	69.6	Low	66.3	Low	164 Å²	164	100.1 Å²	100.1	71%	0.713	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	14.7	170.1	-69.1	-172.7	174.9	-175.3	0	113	R314 L315 L316 M320	R314-K318 PolarHBondContact O-N 2.95Å; L315-K318 CarbonylContact O-C 3.57Å; L315-K318 WeakPolarHBondContact O-CA 3.36Å; L315-K318 WeakPolarHBondContact O-CB 3.33Å; L315-K318 PolarHBondContact O-N 3.2Å; L316-K318 PolarHBondContact O-N 2.98Å; K318-M320 PolarHBondContact O-N 3.14Å; K318-M320 VanDerWaalsContact O-N 3.12Å
319	K	59.7	Low	67.3	Low	194 Å²	194	99.7 Å²	99.7	84%	0.843	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	21.2	-177.2	-61.9	-175.6	175.5	-177.8	0	114.5	L316 A317 Q321	L316-K319 WeakPolarHBondContact O-CA 3.39Å; L316-K319 PolarHBondContact O-N 3.34Å; A317-K319 PolarHBondContact O-N 3.3Å; K319-Q321 PolarHBondContact O-N 3.14Å
320	M	58.8	Low	68.5	Low	108 Å²	108	101.3 Å²	101.3	53%	0.532	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-70.9	124.6	170.2	-71.2	-161.2	77.8	0	0	109.1	L311 L315 K318	L311-M320 HydrophobicContact CD1-CB 3.96Å; L311-M320 VanDerWaalsContact CD1-O 3.23Å; L311-M320 WeakPolarHBondContact CD1-O 3.21Å; L315-M320 PolarHBondContact O-N 2.92Å; K318-M320 PolarHBondContact O-N 3.14Å; K318-M320 VanDerWaalsContact O-N 3.12Å
321	Q	62.4	Low	69.9	Low	173 Å²	173	100.5 Å²	100.5	81%	0.808	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-74.7	137.1	173.1	-65.8	-169.3	7.2	0	0	109.6	L311 K319	L311-Q321 VanDerWaalsContact CD1-C 3.5Å; L311-Q321 WeakPolarHBondContact CD1-O 3.38Å; K319-Q321 PolarHBondContact O-N 3.14Å
322	P	66.5	Low	71.5	Confident	60 Å²	60	98.8 Å²	98.8	39%	0.39	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-63	138.6	169.3	27.2	-30.7	0	0	0	108.5	L311	L311-P322 HydrophobicContact CD1-CB 4.12Å; L311-P322 HydrophobicContact CG-CB 4.13Å
323	M	71.4	Confident	73	Confident	94 Å²	94	96.1 Å²	96.1	46%	0.463	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-56.6	140.5	172	-172.5	173.4	-85.3	0	0	108.7	V308 D327 K328 N331	V308-M323 HydrophobicContact CG1-CB 4.44Å; V308-M323 WeakPolarHBondContact CG1-O 3.43Å; M323-D327 HydrophobicContact CG-CB 3.65Å; M323-K328 HydrophobicContact CG-CB 4.37Å; M323-K328 HydrophobicContact SD-CB 3.97Å; M323-K328 HydrophobicContact SD-CG 4.37Å; M323-N331 VanDerWaalsContact CE-ND2 3.32Å; M323-N331 WeakPolarHBondContact CE-ND2 3.37Å
324	T	78.2	Confident	74.2	Confident	59 Å²	59	91.9 Å²	91.9	36%	0.362	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-89.4	170.1	171.4	63.5	0	0	0	0	110.8	E326 D327 K328	T324-E326 WeakPolarHBondContact CB-OE2 3.39Å; T324-E326 PolarHBondContact O-N 2.98Å; T324-D327 WeakPolarHBondContact CB-OD2 3.18Å; T324-D327 PolarHBondContact N-OD2 2.7Å; T324-D327 PolarHBondContact O-N 2.88Å; T324-D327 PolarHBondContact OG1-N 2.69Å; T324-D327 PolarHBondContact OG1-OD1 3.49Å; T324-D327 PolarHBondContact OG1-OD2 2.78Å; T324-K328 PolarHBondContact O-N 3.38Å
325	S	75.7	Confident	75.4	Confident	31 Å²	31	83.9 Å²	83.9	22%	0.217	44%	0.437	C	S	.	.	H	α-helix	trans	-64	-37.7	174.2	-61.9	0	0	0	0	110.4	T306 V308 K328 I329	T306-S325 PolarHBondContact O-OG 2.82Å; V308-S325 WeakPolarHBondContact CG2-OG 3.47Å; S325-K328 PolarHBondContact O-N 2.88Å; S325-I329 WeakPolarHBondContact O-CG1 3.1Å; S325-I329 PolarHBondContact O-N 3.34Å
326	E	81	Confident	76.8	Confident	124 Å²	124	80.9 Å²	80.9	58%	0.579	42%	0.422	S	S	*	.	H	α-helix	trans	-62.5	-49.6	175.8	-63.8	73	-160.5	0	0	110.6	T324 K328 I329 E330	T324-E326 WeakPolarHBondContact CB-OE2 3.39Å; T324-E326 PolarHBondContact O-N 2.98Å; E326-K328 VanDerWaalsContact C-N 3.26Å; E326-K328 PolarHBondContact O-N 2.68Å; E326-I329 PolarHBondContact O-N 3.41Å; E326-I329 VanDerWaalsContact O-N 3.09Å; E326-E330 WeakPolarHBondContact O-CG 3.49Å; E326-E330 PolarHBondContact O-N 3.4Å
327	D	81.4	Confident	78.2	Confident	63 Å²	63	78.9 Å²	78.9	34%	0.337	42%	0.42	S	S	.	.	H	α-helix	trans	-58.3	-40.2	176.1	-62.1	-36.7	0	0	0	111.4	M323 T324 E330 N331	M323-D327 HydrophobicContact CG-CB 3.65Å; T324-D327 WeakPolarHBondContact CB-OD2 3.18Å; T324-D327 PolarHBondContact N-OD2 2.7Å; T324-D327 PolarHBondContact O-N 2.88Å; T324-D327 PolarHBondContact OG1-N 2.69Å; T324-D327 PolarHBondContact OG1-OD1 3.49Å; T324-D327 PolarHBondContact OG1-OD2 2.78Å; D327-E330 PolarHBondContact O-N 2.9Å; D327-N331 VanDerWaalsContact O-CB 3.32Å; D327-N331 WeakPolarHBondContact O-CB 3.49Å; D327-N331 VanDerWaalsContact O-CG 3.24Å; D327-N331 PolarHBondContact O-N 3.31Å; D327-N331 PolarHBondContact O-ND2 2.96Å
328	K	81.9	Confident	79.3	Confident	35 Å²	35	75.6 Å²	75.6	15%	0.152	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-42	178.2	-172	177.2	174	-167.3	0	110.9	T304 L305 F307 M323 T324 S325 E326 L332	T304-K328 PolarHBondContact O-NZ 2.86Å; L305-K328 WeakPolarHBondContact O-CD 3.32Å; L305-K328 PolarHBondContact O-NZ 2.97Å; F307-K328 PolarHBondContact O-NZ 3.5Å; M323-K328 HydrophobicContact CG-CB 4.37Å; M323-K328 HydrophobicContact SD-CB 3.97Å; M323-K328 HydrophobicContact SD-CG 4.37Å; T324-K328 PolarHBondContact O-N 3.38Å; S325-K328 PolarHBondContact O-N 2.88Å; E326-K328 VanDerWaalsContact C-N 3.26Å; E326-K328 PolarHBondContact O-N 2.68Å; K328-L332 WeakPolarHBondContact O-CB 3.38Å; K328-L332 VanDerWaalsContact O-CG 3.27Å; K328-L332 WeakPolarHBondContact O-CG 3.21Å; K328-L332 PolarHBondContact O-N 3.45Å
329	I	85.7	Confident	80.3	Confident	39 Å²	39	71.1 Å²	71.1	20%	0.2	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-44.4	176	-70.5	166.3	0	0	0	110.8	L149 S325 E326 L332 I333 L344	L149-I329 HydrophobicContact CD2-CG2 4.09Å; S325-I329 WeakPolarHBondContact O-CG1 3.1Å; S325-I329 PolarHBondContact O-N 3.34Å; E326-I329 PolarHBondContact O-N 3.41Å; E326-I329 VanDerWaalsContact O-N 3.09Å; I329-L332 PolarHBondContact O-N 3.16Å; I329-I333 HydrophobicContact CG2-CD1 3.71Å; I329-I333 HydrophobicContact CG2-CG1 4.38Å; I329-I333 WeakPolarHBondContact O-CB 3.49Å; I329-I333 VanDerWaalsContact O-CG1 3.3Å; I329-I333 WeakPolarHBondContact O-CG1 3.4Å; I329-I333 PolarHBondContact O-N 3.08Å; I329-L344 HydrophobicContact CG2-CD1 4.3Å; I329-L344 HydrophobicContact CG2-CD2 3.99Å
330	E	87.4	Confident	81.6	Confident	128 Å²	128	71.4 Å²	71.4	60%	0.598	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-43.2	178.2	-72.3	-171.5	172.2	0	0	112.3	E326 D327 L332 I333 S334	E326-E330 WeakPolarHBondContact O-CG 3.49Å; E326-E330 PolarHBondContact O-N 3.4Å; D327-E330 PolarHBondContact O-N 2.9Å; E330-L332 VanDerWaalsContact C-N 3.31Å; E330-L332 PolarHBondContact O-N 2.98Å; E330-I333 WeakPolarHBondContact O-CB 3.46Å; E330-I333 PolarHBondContact O-N 2.9Å; E330-S334 WeakPolarHBondContact O-CB 3.32Å; E330-S334 PolarHBondContact O-N 3.5Å
331	N	85.9	Confident	83	Confident	86 Å²	86	73.2 Å²	73.2	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-41.2	174.6	-77.2	-50.2	0	0	0	111.6	M323 D327 S334 L335	M323-N331 VanDerWaalsContact CE-ND2 3.32Å; M323-N331 WeakPolarHBondContact CE-ND2 3.37Å; D327-N331 VanDerWaalsContact O-CB 3.32Å; D327-N331 WeakPolarHBondContact O-CB 3.49Å; D327-N331 VanDerWaalsContact O-CG 3.24Å; D327-N331 PolarHBondContact O-N 3.31Å; D327-N331 PolarHBondContact O-ND2 2.96Å; N331-S334 PolarHBondContact O-N 3.44Å; N331-L335 VanDerWaalsContact O-CB 3.22Å; N331-L335 WeakPolarHBondContact O-CB 3.28Å; N331-L335 PolarHBondContact O-N 3.38Å
332	L	87.9	Confident	84.5	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-44.2	175.1	-73.5	175.5	0	0	0	112	I265 V269 L305 K328 I329 E330 S334 L335 L336	I265-L332 HydrophobicContact CD1-CD2 4.38Å; I265-L332 HydrophobicContact CG1-CD2 3.64Å; I265-L332 HydrophobicContact CG2-CD1 4.5Å; V269-L332 HydrophobicContact CG1-CD2 3.96Å; V269-L332 HydrophobicContact CG2-CD2 4.14Å; L305-L332 HydrophobicContact CD2-CD1 3.32Å; K328-L332 WeakPolarHBondContact O-CB 3.38Å; K328-L332 VanDerWaalsContact O-CG 3.27Å; K328-L332 WeakPolarHBondContact O-CG 3.21Å; K328-L332 PolarHBondContact O-N 3.45Å; I329-L332 PolarHBondContact O-N 3.16Å; E330-L332 VanDerWaalsContact C-N 3.31Å; E330-L332 PolarHBondContact O-N 2.98Å; L332-S334 VanDerWaalsContact C-N 3.26Å; L332-S334 PolarHBondContact O-N 3.34Å; L332-L335 PolarHBondContact O-N 3.39Å; L332-L336 WeakPolarHBondContact O-CB 3.19Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.48Å
333	I	88.7	Confident	85.9	Confident	25 Å²	25	68.7 Å²	68.7	13%	0.128	34%	0.342	C	S	.	.	H	α-helix	trans	-54.9	-46.3	175.9	-76.9	164	0	0	0	110.6	I329 E330 G337 L338 R342	I329-I333 HydrophobicContact CG2-CD1 3.71Å; I329-I333 HydrophobicContact CG2-CG1 4.38Å; I329-I333 WeakPolarHBondContact O-CB 3.49Å; I329-I333 VanDerWaalsContact O-CG1 3.3Å; I329-I333 WeakPolarHBondContact O-CG1 3.4Å; I329-I333 PolarHBondContact O-N 3.08Å; E330-I333 WeakPolarHBondContact O-CB 3.46Å; E330-I333 PolarHBondContact O-N 2.9Å; I333-G337 PolarHBondContact O-N 3.26Å; I333-L338 HydrophobicContact CG1-CD1 4.05Å; I333-L338 HydrophobicContact CG2-CB 4.35Å; I333-L338 PolarHBondContact O-N 2.81Å; I333-R342 VanDerWaalsContact CG2-CZ 3.47Å; I333-R342 VanDerWaalsContact CG2-NH1 3.29Å
334	S	88.7	Confident	86.9	Confident	94 Å²	94	68.8 Å²	68.8	66%	0.657	34%	0.344	S	S	*	.	H	α-helix	trans	-65.5	-53	178.9	-177.3	0	0	0	0	111.6	E330 N331 L332 L336 G337	E330-S334 WeakPolarHBondContact O-CB 3.32Å; E330-S334 PolarHBondContact O-N 3.5Å; N331-S334 PolarHBondContact O-N 3.44Å; L332-S334 VanDerWaalsContact C-N 3.26Å; L332-S334 PolarHBondContact O-N 3.34Å; S334-L336 VanDerWaalsContact C-N 3.3Å; S334-L336 PolarHBondContact O-N 3.08Å; S334-G337 PolarHBondContact O-N 3.15Å; S334-G337 VanDerWaalsContact O-N 3.07Å
335	L	87.6	Confident	87.5	Confident	53 Å²	53	66.5 Å²	66.5	28%	0.277	33%	0.33	S	S	.	.	H	α-helix	trans	-58.8	-41.3	-178.4	179.2	63.5	0	0	0	112.5	V269 N278 L281 N285 N331 L332 G337	V269-L335 HydrophobicContact CB-CD2 4.38Å; V269-L335 HydrophobicContact CG1-CD2 3.49Å; V269-L335 VanDerWaalsContact CG1-CD2 3.49Å; N278-L335 WeakPolarHBondContact OD1-CD1 3.15Å; L281-L335 HydrophobicContact CD1-CD1 4.19Å; L281-L335 HydrophobicContact CD1-CD2 4.38Å; L281-L335 HydrophobicContact CD1-CG 3.87Å; N285-L335 PolarHBondContact ND2-O 3.4Å; N331-L335 VanDerWaalsContact O-CB 3.22Å; N331-L335 WeakPolarHBondContact O-CB 3.28Å; N331-L335 PolarHBondContact O-N 3.38Å; L332-L335 PolarHBondContact O-N 3.39Å; L335-G337 VanDerWaalsContact C-N 3.3Å
336	L	89.3	Confident	88.1	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-79.9	-12.1	-179.2	-64.7	-177.9	0	0	0	113.5	I262 I265 L281 A300 L332 S334 L338	I262-L336 HydrophobicContact CD1-CD2 3.22Å; I262-L336 HydrophobicContact CD1-CG 4.48Å; I265-L336 HydrophobicContact CD1-CD2 3.87Å; I265-L336 HydrophobicContact CG1-CD1 4.48Å; L281-L336 HydrophobicContact CD1-CD2 3.94Å; L281-L336 HydrophobicContact CD2-CD2 4.3Å; A300-L336 HydrophobicContact CB-CD1 3.44Å; A300-L336 VanDerWaalsContact CB-CD1 3.44Å; L332-L336 WeakPolarHBondContact O-CB 3.19Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.48Å; S334-L336 VanDerWaalsContact C-N 3.3Å; S334-L336 PolarHBondContact O-N 3.08Å; L336-L338 VanDerWaalsContact C-N 3.34Å; L336-L338 HydrophobicContact CB-CD2 3.83Å; L336-L338 HydrophobicContact CB-CG 3.88Å; L336-L338 HydrophobicContact CD1-CD1 4.43Å; L336-L338 HydrophobicContact CD1-CD2 4.32Å; L336-L338 HydrophobicContact CD1-CG 4.43Å
337	G	88.2	Confident	88.3	Confident	38 Å²	38	66.8 Å²	66.8	39%	0.392	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	38.9	-174.3	0	0	0	0	0	112.7	I333 S334 L335	I333-G337 PolarHBondContact O-N 3.26Å; S334-G337 PolarHBondContact O-N 3.15Å; S334-G337 VanDerWaalsContact O-N 3.07Å; L335-G337 VanDerWaalsContact C-N 3.3Å
338	L	89	Confident	88.3	Confident	14 Å²	14	64.9 Å²	64.9	7%	0.073	32%	0.323	C	S	.	.			trans	-67.3	137.5	-179.3	-58.4	-172.9	0	0	0	111	D147 L149 T298 I333 L336 R342	D147-L338 HydrophobicContact CB-CD2 4.27Å; L149-L338 HydrophobicContact CB-CD1 4.15Å; T298-L338 VanDerWaalsContact CB-CD2 3.5Å; T298-L338 HydrophobicContact CG2-CD2 3.44Å; T298-L338 VanDerWaalsContact CG2-CD2 3.44Å; I333-L338 HydrophobicContact CG1-CD1 4.05Å; I333-L338 HydrophobicContact CG2-CB 4.35Å; I333-L338 PolarHBondContact O-N 2.81Å; L336-L338 VanDerWaalsContact C-N 3.34Å; L336-L338 HydrophobicContact CB-CD2 3.83Å; L336-L338 HydrophobicContact CB-CG 3.88Å; L336-L338 HydrophobicContact CD1-CD1 4.43Å; L336-L338 HydrophobicContact CD1-CD2 4.32Å; L336-L338 HydrophobicContact CD1-CG 4.43Å; L338-R342 PolarHBondContact O-NH1 3.41Å; L338-R342 VanDerWaalsContact O-NH1 3.09Å
339	R	90.4	Very high	88	Confident	70 Å²	70	65 Å²	65	26%	0.264	33%	0.331	S	S	.	.			trans	-67.5	160.7	177.7	-61.6	172.6	-65.8	168.2	3.3	110.7	G145 D147 R296 R341 R342	G145-R339 PolarHBondContact O-NH2 3.38Å; D147-R339 IonicContact OD1-CZ 2.7Å; D147-R339 VanDerWaalsContact OD1-CZ 3.32Å; D147-R339 IonicContact OD1-NE 3.14Å; D147-R339 PolarHBondContact OD1-NE 2.83Å; D147-R339 VanDerWaalsContact OD1-NE 3.13Å; D147-R339 IonicContact OD1-NH2 3.13Å; D147-R339 PolarHBondContact OD1-NH2 2.81Å; D147-R339 WeakPolarHBondContact OD2-CB 3.49Å; D147-R339 WeakPolarHBondContact OD2-CG 3.35Å; D147-R339 PolarHBondContact OD2-N 3.5Å; D147-R339 IonicContact OD2-NE 3.99Å; D147-R339 PolarHBondContact OD2-NE 3.45Å; D147-R339 VanDerWaalsContact OD2-NE 3.14Å; R296-R339 PolarHBondContact O-NE 3.05Å; R339-R341 PolarHBondContact O-N 3.49Å; R339-R342 WeakPolarHBondContact O-CD 3.48Å; R339-R342 PolarHBondContact O-NH1 3.41Å
340	K	87.3	Confident	87.4	Confident	201 Å²	201	73.5 Å²	73.5	87%	0.874	37%	0.366	S	S	*	.	S	Bend	trans	-59.9	-35.6	174.8	-170.7	177	-178.6	179.6	0	111.7	R342	K340-R342 PolarHBondContact O-N 3.38Å
341	R	89.2	Confident	86.8	Confident	146 Å²	146	69 Å²	69	55%	0.551	35%	0.349	S	S	*	.	S	Bend	trans	-81.6	89.2	174.4	-168.4	-173.7	-177.9	-170.5	1.5	109.9	D144 M146 D147 R339	D144-R341 PolarHBondContact O-NH1 3.02Å; D144-R341 VanDerWaalsContact O-NH1 3.08Å; D144-R341 PolarHBondContact O-NH2 3.25Å; M146-R341 HydrophobicContact CG-CG 3.86Å; M146-R341 HydrophobicContact SD-CG 3.8Å; D147-R341 PolarHBondContact N-O 2.93Å; R339-R341 PolarHBondContact O-N 3.49Å
342	R	93.7	Very high	86.4	Confident	88 Å²	88	65 Å²	65	33%	0.332	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157	-177.2	61.3	-176.2	160.3	-119.9	6.1	111.2	D147 I333 L338 R339 K340	D147-R342 HydrophobicContact CB-CB 3.95Å; D147-R342 CarbonylContact O-C 3.55Å; D147-R342 VanDerWaalsContact O-CA 3.22Å; D147-R342 WeakPolarHBondContact O-CA 3.48Å; I333-R342 VanDerWaalsContact CG2-CZ 3.47Å; I333-R342 VanDerWaalsContact CG2-NH1 3.29Å; L338-R342 PolarHBondContact O-NH1 3.41Å; L338-R342 VanDerWaalsContact O-NH1 3.09Å; R339-R342 WeakPolarHBondContact O-CD 3.48Å; R339-R342 PolarHBondContact O-NH1 3.41Å; K340-R342 PolarHBondContact O-N 3.38Å
343	Q	94.8	Very high	86.2	Confident	49 Å²	49	65.7 Å²	65.7	23%	0.229	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.5	171.3	-168.8	-173.8	-2.4	0	0	110	A136 S140 D147 I148 L149 V345	A136-Q343 PolarHBondContact O-NE2 3.17Å; A136-Q343 PolarHBondContact O-OE1 2.99Å; S140-Q343 PolarHBondContact OG-OE1 3.15Å; D147-Q343 PolarHBondContact O-N 3.39Å; I148-Q343 HydrophobicContact CD1-CB 3.8Å; L149-Q343 PolarHBondContact N-O 3.21Å; Q343-V345 HydrophobicContact CG-CG2 3.8Å
344	L	92.3	Very high	85.8	Confident	97 Å²	97	65.3 Å²	65.3	51%	0.508	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.3	167.8	-63.7	170.2	0	0	0	107.6	L149 I329	L149-L344 HydrophobicContact CB-CD2 3.84Å; L149-L344 HydrophobicContact CD2-CD2 3.67Å; L149-L344 HydrophobicContact CG-CD2 4.06Å; I329-L344 HydrophobicContact CG2-CD1 4.3Å; I329-L344 HydrophobicContact CG2-CD2 3.99Å
345	V	91.4	Very high	85.4	Confident	11 Å²	11	66.7 Å²	66.7	7%	0.067	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116.5	176.4	-179.7	0	0	0	0	107.6	I133 A136 L149 G150 A151 Q343 L347	I133-V345 HydrophobicContact CD1-CB 4.32Å; I133-V345 HydrophobicContact CD1-CG1 3.63Å; A136-V345 HydrophobicContact CB-CG1 3.68Å; A136-V345 HydrophobicContact CB-CG2 4.35Å; L149-V345 PolarHBondContact O-N 3.28Å; G150-V345 CarbonylContact C-O 3.56Å; G150-V345 VanDerWaalsContact CA-O 3.31Å; G150-V345 WeakPolarHBondContact CA-O 3.46Å; A151-V345 PolarHBondContact N-O 2.76Å; Q343-V345 HydrophobicContact CG-CG2 3.8Å; V345-L347 HydrophobicContact CG1-CD1 4.21Å; V345-L347 HydrophobicContact CG1-CG 4.02Å
346	D	88.7	Confident	85.3	Confident	78 Å²	78	65.4 Å²	65.4	42%	0.417	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.2	175.2	-172	-4.8	0	0	0	110.2	A151 T306 T348	A151-D346 HydrophobicContact CB-CB 4.18Å; A151-D346 WeakPolarHBondContact CB-OD1 3.31Å; T306-D346 WeakPolarHBondContact CG2-OD2 3.41Å; D346-T348 VanDerWaalsContact OD1-CB 3.3Å; D346-T348 WeakPolarHBondContact OD1-CB 3.46Å; D346-T348 WeakPolarHBondContact OD1-CG2 3.31Å; D346-T348 PolarHBondContact OD1-N 2.98Å; D346-T348 PolarHBondContact OD1-OG1 3.33Å
347	L	85.8	Confident	85.3	Confident	82 Å²	82	66.3 Å²	66.3	43%	0.429	34%	0.34	S	S	.	.			trans	-115.2	21.3	176.5	-58.7	176.2	0	0	0	110.8	P132 I133 A151 A152 V345	P132-L347 HydrophobicContact CB-CD1 3.97Å; I133-L347 HydrophobicContact CB-CD1 3.98Å; I133-L347 HydrophobicContact CD1-CD1 3.99Å; A151-L347 PolarHBondContact O-N 3.19Å; A152-L347 HydrophobicContact CB-CB 4.37Å; V345-L347 HydrophobicContact CG1-CD1 4.21Å; V345-L347 HydrophobicContact CG1-CG 4.02Å
348	T	80.4	Confident	85.5	Confident	24 Å²	24	65.9 Å²	65.9	15%	0.147	33%	0.33	C	S	.	.			trans	-73.8	133.2	177.6	60	0	0	0	0	110.9	A151 A303 T306 D346	A151-T348 HydrophobicContact CB-CG2 3.64Å; A303-T348 WeakPolarHBondContact O-CG2 3.44Å; T306-T348 PolarHBondContact OG1-OG1 2.66Å; D346-T348 VanDerWaalsContact OD1-CB 3.3Å; D346-T348 WeakPolarHBondContact OD1-CB 3.46Å; D346-T348 WeakPolarHBondContact OD1-CG2 3.31Å; D346-T348 PolarHBondContact OD1-N 2.98Å; D346-T348 PolarHBondContact OD1-OG1 3.33Å
349	A	76	Confident	85.7	Confident	38 Å²	38	66.6 Å²	66.6	31%	0.314	34%	0.335	S	S	.	.			trans	-65.9	153.9	168.4	0	0	0	0	0	109.8	S351 G352	A349-S351 PolarHBondContact O-N 3.17Å; A349-S351 VanDerWaalsContact O-N 3.1Å; A349-G352 WeakPolarHBondContact O-CA 3.36Å; A349-G352 PolarHBondContact O-N 3.05Å
350	K	72.4	Confident	85.9	Confident	216 Å²	216	63.3 Å²	63.3	94%	0.939	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-35.6	176.9	-70	-174.5	178.2	-178.3	0	113.2
351	S	74.5	Confident	86.3	Confident	35 Å²	35	53.7 Å²	53.7	25%	0.245	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.4	176.7	63.2	0	0	0	0	113.7	F307 A349 L353	F307-S351 WeakPolarHBondContact CZ-O 3.47Å; A349-S351 PolarHBondContact O-N 3.17Å; A349-S351 VanDerWaalsContact O-N 3.1Å; S351-L353 PolarHBondContact O-N 2.91Å; S351-L353 PolarHBondContact OG-N 3.2Å
352	G	78.3	Confident	86.6	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	70.2	1	-172.6	0	0	0	0	0	115.1	A349 V467	A349-G352 WeakPolarHBondContact O-CA 3.36Å; A349-G352 PolarHBondContact O-N 3.05Å; G352-V467 WeakPolarHBondContact O-CG1 3.26Å
353	L	82.4	Confident	86.6	Confident	20 Å²	20	44.9 Å²	44.9	11%	0.105	25%	0.25	C	S	.	.	S	Bend	trans	-99.8	145.9	-177.4	-57.8	176.6	0	0	0	111.6	S351 L357 T359 Y466 V467 I501	S351-L353 PolarHBondContact O-N 2.91Å; S351-L353 PolarHBondContact OG-N 3.2Å; L353-L357 HydrophobicContact CB-CD2 4.14Å; L353-L357 HydrophobicContact CD1-CD2 4.16Å; L353-L357 HydrophobicContact CD2-CD2 3.88Å; L353-L357 HydrophobicContact CG-CD2 4.29Å; L353-T359 HydrophobicContact CD1-CG2 3.92Å; L353-Y466 HydrophobicContact CD1-CE1 4.04Å; L353-Y466 HydrophobicContact CD2-CD1 4.35Å; L353-Y466 HydrophobicContact CD2-CE1 4Å; L353-V467 HydrophobicContact CD2-CB 4.47Å; L353-V467 HydrophobicContact CD2-CG2 4.22Å; L353-I501 HydrophobicContact CD1-CG2 3.62Å; L353-I501 HydrophobicContact CG-CG2 4.15Å
354	A	80.7	Confident	86.6	Confident	17 Å²	17	42.9 Å²	42.9	14%	0.14	24%	0.241	C	C	.	.			trans	-59.7	140.7	171.9	0	0	0	0	0	111.3	E153 T356 L357 A474	E153-A354 WeakPolarHBondContact OE2-CA 3.43Å; E153-A354 PolarHBondContact OE2-N 3.4Å; A354-T356 PolarHBondContact O-N 3.4Å; A354-L357 HydrophobicContact CB-CB 4.42Å; A354-L357 VanDerWaalsContact O-CB 3.22Å; A354-L357 WeakPolarHBondContact O-CB 3.38Å; A354-L357 PolarHBondContact O-N 2.99Å; A354-A474 HydrophobicContact CB-CB 4.3Å
355	S	81.9	Confident	86.6	Confident	123 Å²	123	40.7 Å²	40.7	86%	0.86	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-24	-179.6	57.6	0	0	0	0	113.8	L357	S355-L357 VanDerWaalsContact C-N 3.31Å
356	T	85.6	Confident	86.6	Confident	25 Å²	25	42.2 Å²	42.2	15%	0.153	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	4	176.6	58.6	0	0	0	0	113.2	A354 K478 Q479 G480	A354-T356 PolarHBondContact O-N 3.4Å; T356-K478 WeakPolarHBondContact CB-O 3.31Å; T356-K478 PolarHBondContact OG1-O 3.31Å; T356-Q479 PolarHBondContact O-OE1 3.13Å; T356-Q479 VanDerWaalsContact O-OE1 3.12Å; T356-G480 PolarHBondContact O-N 3.49Å
357	L	88.8	Confident	86.9	Confident	19 Å²	19	43 Å²	43	10%	0.099	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.3	176.7	-175.7	73.9	0	0	0	110.3	L353 A354 S355 T359 T473 A474	L353-L357 HydrophobicContact CB-CD2 4.14Å; L353-L357 HydrophobicContact CD1-CD2 4.16Å; L353-L357 HydrophobicContact CD2-CD2 3.88Å; L353-L357 HydrophobicContact CG-CD2 4.29Å; A354-L357 HydrophobicContact CB-CB 4.42Å; A354-L357 VanDerWaalsContact O-CB 3.22Å; A354-L357 WeakPolarHBondContact O-CB 3.38Å; A354-L357 PolarHBondContact O-N 2.99Å; S355-L357 VanDerWaalsContact C-N 3.31Å; L357-T359 HydrophobicContact CD2-CG2 3.72Å; L357-T359 HydrophobicContact CG-CG2 4.01Å; L357-T473 HydrophobicContact CD1-CG2 3.42Å; L357-T473 VanDerWaalsContact CD1-CG2 3.42Å; L357-A474 HydrophobicContact CB-CB 3.83Å; L357-A474 HydrophobicContact CD1-CB 3.81Å; L357-A474 HydrophobicContact CG-CB 4.46Å
358	T	91.7	Very high	87.3	Confident	29 Å²	29	45.4 Å²	45.4	18%	0.178	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.3	165.2	-59.9	0	0	0	0	109.2	G480 L481 S482 L605	T358-G480 PolarHBondContact N-O 3.47Å; T358-L481 HydrophobicContact CG2-CD1 3.71Å; T358-L481 WeakPolarHBondContact O-CA 3.25Å; T358-S482 PolarHBondContact O-N 3.03Å; T358-L605 HydrophobicContact CG2-CD1 3.4Å; T358-L605 VanDerWaalsContact CG2-CD1 3.4Å; T358-L605 HydrophobicContact CG2-CD2 3.99Å; T358-L605 HydrophobicContact CG2-CG 4.31Å
359	T	92.8	Very high	87.9	Confident	29 Å²	29	46.9 Å²	46.9	18%	0.178	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.9	175.5	59.4	0	0	0	0	111.3	L353 L357 Y466 S482 F507 S508	L353-T359 HydrophobicContact CD1-CG2 3.92Å; L357-T359 HydrophobicContact CD2-CG2 3.72Å; L357-T359 HydrophobicContact CG-CG2 4.01Å; T359-Y466 WeakPolarHBondContact CG2-OH 3.38Å; T359-S482 WeakPolarHBondContact CA-O 3.32Å; T359-F507 HydrophobicContact CG2-CE1 4.45Å; T359-F507 WeakPolarHBondContact OG1-CD1 3.49Å; T359-S508 PolarHBondContact O-OG 2.97Å
360	S	94.5	Very high	88.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.7	179	60.7	0	0	0	0	111.6	S482 L483 M484 S508	S360-S482 PolarHBondContact N-O 3.31Å; S360-L483 WeakPolarHBondContact O-CA 3.46Å; S360-L483 WeakPolarHBondContact OG-CD1 3.1Å; S360-M484 PolarHBondContact O-N 3.48Å; S360-S508 CarbonylContact C-O 3.42Å; S360-S508 WeakPolarHBondContact CA-O 3.2Å; S360-S508 WeakPolarHBondContact CB-O 3.48Å
361	C	95.7	Very high	90	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	160.7	175.2	69.7	0	0	0	0	113	M484 V486 Y494 F507 S508 L509 F510	C361-M484 CarbonylContact C-O 3.51Å; C361-M484 WeakPolarHBondContact CA-O 3.2Å; C361-M484 HydrophobicContact CB-CB 4.33Å; C361-M484 HydrophobicContact CB-CE 4.49Å; C361-M484 WeakPolarHBondContact CB-O 2.94Å; C361-V486 HydrophobicContact CB-CG2 4.45Å; C361-Y494 HydrophobicContact CB-CE2 4.41Å; C361-F507 HydrophobicContact CB-CB 4.16Å; C361-S508 PolarHBondContact N-O 3.15Å; C361-L509 WeakPolarHBondContact O-CA 3.13Å; C361-F510 PolarHBondContact O-N 3.11Å
362	L	95.1	Very high	91.1	Very high	13 Å²	13	34.2 Å²	34.2	7%	0.068	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135.6	168.9	-72.4	167.8	0	0	0	108.9	Y373 L483 M484 L485 V486 F510 I512	L362-Y373 HydrophobicContact CB-CD2 4.22Å; L362-Y373 HydrophobicContact CB-CE2 4.39Å; L362-Y373 HydrophobicContact CD1-CD2 4.11Å; L362-Y373 HydrophobicContact CD1-CG 4.14Å; L362-L483 HydrophobicContact CD1-CD1 4.05Å; L362-L483 HydrophobicContact CD1-CD2 4.21Å; L362-L483 HydrophobicContact CG-CD1 4.05Å; L362-M484 PolarHBondContact N-O 3.17Å; L362-L485 HydrophobicContact CB-CD2 3.81Å; L362-L485 HydrophobicContact CD1-CD2 3.87Å; L362-L485 HydrophobicContact CG-CD2 4.39Å; L362-V486 PolarHBondContact O-N 3.39Å; L362-F510 HydrophobicContact CD1-CB 4.26Å; L362-F510 HydrophobicContact CD1-CD1 4.3Å; L362-F510 HydrophobicContact CD2-CB 3.9Å; L362-F510 WeakPolarHBondContact CD2-O 3.5Å; L362-F510 HydrophobicContact CG-CB 3.84Å; L362-I512 HydrophobicContact CD1-CD1 3.79Å; L362-I512 HydrophobicContact CD1-CG1 4.49Å; L362-I512 HydrophobicContact CD2-CD1 3.53Å; L362-I512 HydrophobicContact CD2-CG1 4Å; L362-I512 HydrophobicContact CG-CD1 4.3Å
363	F	95.1	Very high	92	Very high	36 Å²	36	34.6 Å²	34.6	16%	0.158	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	131	172.5	-65.3	-80.4	0	0	0	109.5	V486 Y494 L509 P617	F363-V486 CarbonylContact C-O 3.56Å; F363-V486 WeakPolarHBondContact CA-O 3.22Å; F363-V486 HydrophobicContact CD1-CB 3.82Å; F363-V486 HydrophobicContact CD1-CG1 3.98Å; F363-V486 HydrophobicContact CE1-CB 4.03Å; F363-V486 HydrophobicContact CE1-CG1 3.94Å; F363-V486 HydrophobicContact CE1-CG2 4.4Å; F363-Y494 HydrophobicContact CE1-CD1 4.49Å; F363-Y494 HydrophobicContact CE1-CE1 4.1Å; F363-Y494 AromaticContact CZ-CE1 3.98Å; F363-Y494 HydrophobicContact CZ-CE1 3.98Å; F363-Y494 AromaticContact CZ-CZ 4Å; F363-L509 HydrophobicContact CD2-CD2 3.74Å; F363-L509 HydrophobicContact CE2-CD2 3.73Å; F363-P617 HydrophobicContact CD2-CB 4.06Å; F363-P617 HydrophobicContact CE2-CB 3.97Å
364	C	94	Very high	92.7	Very high	6 Å²	6	33.7 Å²	33.7	4%	0.041	19%	0.192	C	C	.	.			trans	-117.6	121	-174.9	-51.7	0	0	0	0	110	K370 V486	C364-K370 HydrophobicContact CB-CB 4.07Å; C364-K370 HydrophobicContact CB-CD 4.48Å; C364-K370 HydrophobicContact CB-CG 4.19Å; C364-V486 PolarHBondContact N-O 3.39Å
365	S	91.8	Very high	93.5	Very high	51 Å²	51	33.5 Å²	33.5	36%	0.357	19%	0.188	S	C	.	.	S	Bend	trans	-78.2	-30.8	178.7	38.4	0	0	0	0	114.4	R369 D615	S365-R369 WeakPolarHBondContact OG-CD 3.23Å; S365-D615 WeakPolarHBondContact CB-OD1 3.39Å; S365-D615 PolarHBondContact N-OD1 2.88Å; S365-D615 PolarHBondContact OG-OD1 3.36Å
366	S	93.2	Very high	94.1	Very high	44 Å²	44	28.1 Å²	28.1	31%	0.308	15%	0.148	S	C	.	.	S	Bend	trans	-137.1	168.1	178.5	81.8	0	0	0	0	112.5	E368 R369 K370	S366-E368 PolarHBondContact OG-N 2.93Å; S366-E368 PolarHBondContact OG-OE2 3.06Å; S366-R369 PolarHBondContact O-N 3.34Å; S366-R369 PolarHBondContact OG-N 3.33Å; S366-K370 PolarHBondContact O-N 2.85Å; S366-K370 VanDerWaalsContact O-N 3.15Å
367	L	93.5	Very high	94.6	Very high	94 Å²	94	27 Å²	27	49%	0.492	14%	0.142	S	C	.	.	H	α-helix	trans	-63.3	-42.9	173	-179.3	64.5	0	0	0	111.3	R369 K370 D371 Y457	L367-R369 VanDerWaalsContact C-N 3.26Å; L367-R369 PolarHBondContact O-N 2.94Å; L367-K370 WeakPolarHBondContact O-CA 3.33Å; L367-K370 VanDerWaalsContact O-CB 3.28Å; L367-K370 WeakPolarHBondContact O-CB 3.45Å; L367-K370 PolarHBondContact O-N 2.95Å; L367-K370 VanDerWaalsContact O-N 3.08Å; L367-D371 PolarHBondContact O-N 2.95Å; L367-Y457 WeakPolarHBondContact CD1-OH 2.95Å
368	E	93.7	Very high	94.9	Very high	132 Å²	132	26.8 Å²	26.8	62%	0.617	14%	0.14	S	C	*	.	H	α-helix	trans	-60.6	-40.4	179.9	-54.1	128.3	164.7	0	0	110.8	S366 K370 D371 L372	S366-E368 PolarHBondContact OG-N 2.93Å; S366-E368 PolarHBondContact OG-OE2 3.06Å; E368-K370 VanDerWaalsContact C-N 3.31Å; E368-K370 PolarHBondContact O-N 3.32Å; E368-D371 PolarHBondContact O-N 3.15Å; E368-L372 VanDerWaalsContact O-CB 3.31Å; E368-L372 WeakPolarHBondContact O-CB 3.47Å; E368-L372 PolarHBondContact O-N 3.19Å
369	R	93.9	Very high	95	Very high	55 Å²	55	27.2 Å²	27.2	21%	0.208	15%	0.147	C	C	.	.	H	α-helix	trans	-68.3	-34.3	178	-163.1	157.2	175.7	109.5	7.3	112.3	S365 S366 L367 L372 Y373 D612 D615	S365-R369 WeakPolarHBondContact OG-CD 3.23Å; S366-R369 PolarHBondContact O-N 3.34Å; S366-R369 PolarHBondContact OG-N 3.33Å; L367-R369 VanDerWaalsContact C-N 3.26Å; L367-R369 PolarHBondContact O-N 2.94Å; R369-L372 PolarHBondContact O-N 3.39Å; R369-Y373 HydrophobicContact CG-CD2 4.48Å; R369-Y373 HydrophobicContact CG-CE1 4.16Å; R369-Y373 HydrophobicContact CG-CE2 3.91Å; R369-Y373 PolarHBondContact NE-OH 2.86Å; R369-Y373 PolarHBondContact NH2-OH 3.44Å; R369-Y373 WeakPolarHBondContact O-CD2 3.15Å; R369-Y373 VanDerWaalsContact O-CG 3.25Å; R369-Y373 PolarHBondContact O-N 3.22Å; R369-D612 IonicContact CZ-OD2 3.45Å; R369-D612 IonicContact NH1-OD2 3.57Å; R369-D612 IonicContact NH2-OD2 2.62Å; R369-D612 PolarHBondContact NH2-OD2 3.31Å; R369-D615 IonicContact CZ-OD2 3.78Å; R369-D615 VanDerWaalsContact CZ-OD2 3.26Å; R369-D615 IonicContact NE-OD1 3.23Å; R369-D615 IonicContact NE-OD2 3.67Å; R369-D615 PolarHBondContact NE-OD2 3.41Å; R369-D615 IonicContact NH2-OD2 3.96Å; R369-D615 PolarHBondContact NH2-OD2 3.43Å; R369-D615 VanDerWaalsContact NH2-OD2 3.08Å
370	K	95.6	Very high	94.9	Very high	3 Å²	3	26.7 Å²	26.7	1%	0.013	14%	0.142	C	C	.	.	H	α-helix	trans	-64.8	-47.1	174.2	-156.8	169.3	-158.9	-174.7	0	111.1	C364 S366 L367 E368 L372 Y373 V374 Y457 L485 D487 D490	C364-K370 HydrophobicContact CB-CB 4.07Å; C364-K370 HydrophobicContact CB-CD 4.48Å; C364-K370 HydrophobicContact CB-CG 4.19Å; S366-K370 PolarHBondContact O-N 2.85Å; S366-K370 VanDerWaalsContact O-N 3.15Å; L367-K370 WeakPolarHBondContact O-CA 3.33Å; L367-K370 VanDerWaalsContact O-CB 3.28Å; L367-K370 WeakPolarHBondContact O-CB 3.45Å; L367-K370 PolarHBondContact O-N 2.95Å; L367-K370 VanDerWaalsContact O-N 3.08Å; E368-K370 VanDerWaalsContact C-N 3.31Å; E368-K370 PolarHBondContact O-N 3.32Å; K370-L372 VanDerWaalsContact C-N 3.33Å; K370-Y373 PolarHBondContact O-N 3.21Å; K370-V374 WeakPolarHBondContact O-CG2 3.45Å; K370-V374 PolarHBondContact O-N 2.93Å; K370-V374 VanDerWaalsContact O-N 3.17Å; K370-Y457 HydrophobicContact CB-CE2 4.37Å; K370-Y457 HydrophobicContact CD-CE1 4.24Å; K370-Y457 HydrophobicContact CD-CE2 4.15Å; K370-Y457 WeakPolarHBondContact CE-O 3.26Å; K370-Y457 HydrophobicContact CG-CD2 4.37Å; K370-Y457 HydrophobicContact CG-CE2 3.73Å; K370-Y457 PolarHBondContact NZ-O 2.99Å; K370-L485 HydrophobicContact CD-CB 4.47Å; K370-L485 WeakPolarHBondContact CE-O 3.32Å; K370-L485 HydrophobicContact CG-CB 4.11Å; K370-L485 HydrophobicContact CG-CD1 3.82Å; K370-D487 IonicContact NZ-OD2 3.94Å; K370-D487 PolarHBondContact NZ-OD2 3.27Å; K370-D490 IonicContact NZ-OD2 3.08Å; K370-D490 PolarHBondContact NZ-OD2 3.47Å
371	D	97.7	Very high	94.8	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.027	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-42	175	-73.8	-24.6	0	0	0	111.6	L367 E368 V374 Y375 R397 L401 Y457 V524	L367-D371 PolarHBondContact O-N 2.95Å; E368-D371 PolarHBondContact O-N 3.15Å; D371-V374 PolarHBondContact O-N 3.44Å; D371-Y375 PolarHBondContact O-N 3.13Å; D371-R397 IonicContact OD1-CZ 3.15Å; D371-R397 IonicContact OD1-NH1 3.81Å; D371-R397 PolarHBondContact OD1-NH1 2.61Å; D371-R397 IonicContact OD1-NH2 3.65Å; D371-R397 PolarHBondContact OD1-NH2 3.33Å; D371-R397 IonicContact OD2-CZ 2.6Å; D371-R397 IonicContact OD2-NH1 2.94Å; D371-R397 PolarHBondContact OD2-NH1 3.21Å; D371-R397 IonicContact OD2-NH2 2.87Å; D371-L401 HydrophobicContact CB-CD2 3.73Å; D371-Y457 PolarHBondContact OD1-OH 3.01Å; D371-V524 HydrophobicContact CB-CG1 3.95Å
372	L	97.1	Very high	94.5	Very high	15 Å²	15	31.6 Å²	31.6	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-46.7	176.8	178.5	63.1	0	0	0	112.2	E368 R369 K370 V374 Y375 Y376 L517 V521 V524	E368-L372 VanDerWaalsContact O-CB 3.31Å; E368-L372 WeakPolarHBondContact O-CB 3.47Å; E368-L372 PolarHBondContact O-N 3.19Å; R369-L372 PolarHBondContact O-N 3.39Å; K370-L372 VanDerWaalsContact C-N 3.33Å; L372-V374 VanDerWaalsContact C-N 3.34Å; L372-V374 PolarHBondContact O-N 3.07Å; L372-Y375 PolarHBondContact O-N 2.62Å; L372-Y376 VanDerWaalsContact O-CB 3.25Å; L372-Y376 WeakPolarHBondContact O-CB 2.92Å; L372-Y376 PolarHBondContact O-N 3.3Å; L372-L517 HydrophobicContact CD1-CD1 4.22Å; L372-L517 HydrophobicContact CD2-CD1 4.1Å; L372-L517 HydrophobicContact CD2-CD2 4.01Å; L372-L517 HydrophobicContact CD2-CG 3.94Å; L372-L517 HydrophobicContact CG-CD1 3.83Å; L372-L517 HydrophobicContact CG-CG 4.22Å; L372-V521 HydrophobicContact CD1-CG2 4.21Å; L372-V521 HydrophobicContact CD2-CG2 3.82Å; L372-V524 HydrophobicContact CB-CG1 4.46Å; L372-V524 HydrophobicContact CD1-CB 4.35Å; L372-V524 HydrophobicContact CD1-CG2 4.03Å
373	Y	97.2	Very high	94.3	Very high	9 Å²	9	31.3 Å²	31.3	4%	0.035	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-38.4	178.1	-67.5	-25	0	0	0	112.8	L362 R369 K370 F377 I512 L517 D615	L362-Y373 HydrophobicContact CB-CD2 4.22Å; L362-Y373 HydrophobicContact CB-CE2 4.39Å; L362-Y373 HydrophobicContact CD1-CD2 4.11Å; L362-Y373 HydrophobicContact CD1-CG 4.14Å; R369-Y373 HydrophobicContact CG-CD2 4.48Å; R369-Y373 HydrophobicContact CG-CE1 4.16Å; R369-Y373 HydrophobicContact CG-CE2 3.91Å; R369-Y373 PolarHBondContact NE-OH 2.86Å; R369-Y373 PolarHBondContact NH2-OH 3.44Å; R369-Y373 WeakPolarHBondContact O-CD2 3.15Å; R369-Y373 VanDerWaalsContact O-CG 3.25Å; R369-Y373 PolarHBondContact O-N 3.22Å; K370-Y373 PolarHBondContact O-N 3.21Å; Y373-F377 VanDerWaalsContact O-CB 3.26Å; Y373-F377 WeakPolarHBondContact O-CB 3.2Å; Y373-F377 PolarHBondContact O-N 3.12Å; Y373-I512 HydrophobicContact CD1-CD1 3.43Å; Y373-I512 VanDerWaalsContact CD1-CD1 3.43Å; Y373-I512 HydrophobicContact CE1-CD1 3.34Å; Y373-I512 HydrophobicContact CE2-CD1 4.49Å; Y373-I512 HydrophobicContact CG-CD1 4.07Å; Y373-L517 HydrophobicContact CD1-CD1 4.25Å; Y373-L517 HydrophobicContact CD1-CD2 4.43Å; Y373-L517 HydrophobicContact CE1-CD2 3.95Å; Y373-D615 PolarHBondContact OH-OD2 3.26Å
374	V	97.3	Very high	94.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-51.2	174.2	174.2	0	0	0	0	110.2	K370 D371 L372 F377 L378 I387 L402 Y457 L485	K370-V374 WeakPolarHBondContact O-CG2 3.45Å; K370-V374 PolarHBondContact O-N 2.93Å; K370-V374 VanDerWaalsContact O-N 3.17Å; D371-V374 PolarHBondContact O-N 3.44Å; L372-V374 VanDerWaalsContact C-N 3.34Å; L372-V374 PolarHBondContact O-N 3.07Å; V374-F377 PolarHBondContact O-N 2.78Å; V374-L378 HydrophobicContact CG1-CD1 3.72Å; V374-L378 HydrophobicContact CG1-CG 4.31Å; V374-L378 VanDerWaalsContact O-CG 3.26Å; V374-L378 WeakPolarHBondContact O-CG 3.49Å; V374-L378 PolarHBondContact O-N 3.33Å; V374-I387 HydrophobicContact CG1-CD1 3.77Å; V374-L402 HydrophobicContact CG1-CD2 4.24Å; V374-Y457 HydrophobicContact CG2-CD2 3.6Å; V374-Y457 HydrophobicContact CG2-CE2 3.81Å; V374-L485 HydrophobicContact CG2-CD1 3.45Å; V374-L485 VanDerWaalsContact CG2-CD1 3.45Å
375	Y	97.1	Very high	94.4	Very high	14 Å²	14	31 Å²	31	6%	0.055	17%	0.168	C	C	.	.	H	α-helix	trans	-66.8	-43.5	-176.2	-178.5	-120.2	0	0	0	112.3	D371 L372 F377 L378 A379 L405 V407 Y520 R523 V524	D371-Y375 PolarHBondContact O-N 3.13Å; L372-Y375 PolarHBondContact O-N 2.62Å; Y375-F377 VanDerWaalsContact C-N 3.31Å; Y375-F377 PolarHBondContact O-N 3.46Å; Y375-L378 PolarHBondContact O-N 3.01Å; Y375-A379 WeakPolarHBondContact O-CB 3.37Å; Y375-A379 PolarHBondContact O-N 3.02Å; Y375-L405 HydrophobicContact CD1-CD1 4.31Å; Y375-L405 HydrophobicContact CD1-CD2 4.37Å; Y375-L405 HydrophobicContact CD2-CB 3.91Å; Y375-L405 HydrophobicContact CD2-CD1 3.75Å; Y375-L405 HydrophobicContact CD2-CG 4.29Å; Y375-L405 HydrophobicContact CE1-CD2 4.11Å; Y375-L405 HydrophobicContact CE2-CB 3.64Å; Y375-L405 HydrophobicContact CE2-CD1 4.26Å; Y375-L405 HydrophobicContact CE2-CD2 4.34Å; Y375-L405 HydrophobicContact CE2-CG 4.3Å; Y375-L405 HydrophobicContact CG-CD1 3.79Å; Y375-V407 HydrophobicContact CD2-CG2 4.12Å; Y375-V407 HydrophobicContact CE2-CG2 3.95Å; Y375-Y520 HydrophobicContact CD1-CD1 4.04Å; Y375-Y520 HydrophobicContact CD1-CG 4.36Å; Y375-Y520 AromaticContact CE1-CD1 3.65Å; Y375-Y520 HydrophobicContact CE1-CD1 3.65Å; Y375-Y520 HydrophobicContact CE1-CG 4.35Å; Y375-R523 HydrophobicContact CE1-CB 4.27Å; Y375-V524 HydrophobicContact CD1-CG2 3.41Å; Y375-V524 VanDerWaalsContact CD1-CG2 3.41Å; Y375-V524 HydrophobicContact CE1-CG2 4.3Å; Y375-V524 HydrophobicContact CG-CG2 3.9Å
376	Y	95.3	Very high	94.5	Very high	10 Å²	10	28.5 Å²	28.5	4%	0.039	15%	0.151	C	C	.	.	H	α-helix	trans	-53	-49.2	172	169	-96.2	0	0	0	111.5	L372 L378 A379 K380 I512 D513 D516 L517 Y520	L372-Y376 VanDerWaalsContact O-CB 3.25Å; L372-Y376 WeakPolarHBondContact O-CB 2.92Å; L372-Y376 PolarHBondContact O-N 3.3Å; Y376-L378 PolarHBondContact O-N 3.17Å; Y376-A379 PolarHBondContact O-N 3.33Å; Y376-K380 HydrophobicContact CD2-CG 4.25Å; Y376-K380 HydrophobicContact CE2-CG 3.92Å; Y376-K380 WeakPolarHBondContact O-CB 3.44Å; Y376-K380 WeakPolarHBondContact O-CG 3.4Å; Y376-K380 PolarHBondContact O-N 3.45Å; Y376-I512 HydrophobicContact CD1-CG2 4.49Å; Y376-I512 HydrophobicContact CE1-CB 4.48Å; Y376-I512 HydrophobicContact CE1-CG1 4.28Å; Y376-I512 HydrophobicContact CE1-CG2 4.05Å; Y376-D513 PolarHBondContact OH-N 2.96Å; Y376-D516 HydrophobicContact CE2-CB 4.31Å; Y376-L517 HydrophobicContact CD1-CD1 4.3Å; Y376-L517 HydrophobicContact CD2-CB 4.43Å; Y376-L517 HydrophobicContact CD2-CD1 3.68Å; Y376-L517 HydrophobicContact CE2-CD1 4.44Å; Y376-L517 HydrophobicContact CG-CD1 3.6Å; Y376-Y520 AromaticContact CD2-CD2 3.7Å; Y376-Y520 HydrophobicContact CD2-CD2 3.7Å; Y376-Y520 AromaticContact CD2-CE2 3.57Å; Y376-Y520 HydrophobicContact CD2-CE2 3.57Å; Y376-Y520 HydrophobicContact CE2-CE2 4.13Å
377	F	95.8	Very high	94.7	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.009	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-47.1	179	179.5	-85.9	0	0	0	111.6	Y373 V374 Y375 A379 K380 Y381 H453 I455 L481 L483 F510	Y373-F377 VanDerWaalsContact O-CB 3.26Å; Y373-F377 WeakPolarHBondContact O-CB 3.2Å; Y373-F377 PolarHBondContact O-N 3.12Å; V374-F377 PolarHBondContact O-N 2.78Å; Y375-F377 VanDerWaalsContact C-N 3.31Å; Y375-F377 PolarHBondContact O-N 3.46Å; F377-A379 VanDerWaalsContact C-N 3.32Å; F377-A379 PolarHBondContact O-N 2.66Å; F377-K380 PolarHBondContact O-N 2.74Å; F377-Y381 AromaticContact CD2-CD2 3.63Å; F377-Y381 HydrophobicContact CD2-CD2 3.63Å; F377-Y381 HydrophobicContact CD2-CE2 4.15Å; F377-Y381 HydrophobicContact CD2-CG 4.48Å; F377-Y381 AromaticContact CE2-CD2 3.73Å; F377-Y381 HydrophobicContact CE2-CD2 3.73Å; F377-Y381 HydrophobicContact CE2-CE2 4.36Å; F377-Y381 HydrophobicContact CE2-CG 4.18Å; F377-Y381 HydrophobicContact CG-CD2 4.14Å; F377-Y381 HydrophobicContact CZ-CD2 4.33Å; F377-Y381 HydrophobicContact CZ-CG 4.42Å; F377-Y381 WeakPolarHBondContact O-CB 3.29Å; F377-Y381 WeakPolarHBondContact O-CD2 3.49Å; F377-Y381 PolarHBondContact O-N 3.46Å; F377-H453 HydrophobicContact CE1-CB 3.84Å; F377-H453 AromaticContact CE1-CG 3.72Å; F377-H453 AromaticContact CE1-ND1 3.74Å; F377-H453 HydrophobicContact CZ-CB 3.99Å; F377-H453 AromaticContact CZ-CD2 3.97Å; F377-H453 AromaticContact CZ-CG 3.72Å; F377-I455 HydrophobicContact CD1-CD1 3.61Å; F377-I455 HydrophobicContact CD1-CG1 4.43Å; F377-I455 HydrophobicContact CE1-CD1 4Å; F377-I455 HydrophobicContact CE1-CG1 4.41Å; F377-I455 HydrophobicContact CG-CD1 4.3Å; F377-L481 HydrophobicContact CE2-CD2 3.56Å; F377-L481 HydrophobicContact CZ-CD2 3.72Å; F377-L483 HydrophobicContact CD2-CD2 3.72Å; F377-L483 HydrophobicContact CE2-CD2 4.13Å; F377-L483 HydrophobicContact CG-CD2 4.1Å; F377-F510 AromaticContact CD2-CE1 3.93Å; F377-F510 HydrophobicContact CD2-CE1 3.93Å; F377-F510 HydrophobicContact CD2-CE2 4.25Å; F377-F510 AromaticContact CD2-CZ 3.64Å; F377-F510 HydrophobicContact CD2-CZ 3.64Å; F377-F510 HydrophobicContact CE2-CE1 4.39Å; F377-F510 AromaticContact CE2-CE2 3.9Å; F377-F510 HydrophobicContact CE2-CE2 3.9Å; F377-F510 AromaticContact CE2-CZ 3.65Å; F377-F510 HydrophobicContact CE2-CZ 3.65Å
378	L	95.7	Very high	94.9	Very high	13 Å²	13	22 Å²	22	7%	0.068	11%	0.114	C	C	.	.	H	α-helix	trans	-65.4	-33.6	-179.4	-68.9	172.7	0	0	0	113.1	V374 Y375 Y376 T385 I387 L402 V407 V435	V374-L378 HydrophobicContact CG1-CD1 3.72Å; V374-L378 HydrophobicContact CG1-CG 4.31Å; V374-L378 VanDerWaalsContact O-CG 3.26Å; V374-L378 WeakPolarHBondContact O-CG 3.49Å; V374-L378 PolarHBondContact O-N 3.33Å; Y375-L378 PolarHBondContact O-N 3.01Å; Y376-L378 PolarHBondContact O-N 3.17Å; L378-T385 HydrophobicContact CD2-CG2 3.69Å; L378-I387 HydrophobicContact CD1-CD1 4.29Å; L378-L402 HydrophobicContact CD1-CD1 4.21Å; L378-L402 HydrophobicContact CD1-CD2 3.67Å; L378-V407 HydrophobicContact CD1-CG1 4.32Å; L378-V435 HydrophobicContact CD1-CG2 3.99Å; L378-V435 HydrophobicContact CD2-CG2 3.6Å; L378-V435 HydrophobicContact CG-CG2 4.41Å
379	A	92.5	Very high	94.9	Very high	39 Å²	39	15.8 Å²	15.8	32%	0.322	8%	0.084	S	C	.	.	H	α-helix	trans	-70.8	-42	176.1	0	0	0	0	0	111.7	Y375 Y376 F377 Y520	Y375-A379 WeakPolarHBondContact O-CB 3.37Å; Y375-A379 PolarHBondContact O-N 3.02Å; Y376-A379 PolarHBondContact O-N 3.33Å; F377-A379 VanDerWaalsContact C-N 3.32Å; F377-A379 PolarHBondContact O-N 2.66Å; A379-Y520 HydrophobicContact CB-CD1 4.37Å; A379-Y520 HydrophobicContact CB-CE1 3.64Å
380	K	91.1	Very high	94.9	Very high	18 Å²	18	15.2 Å²	15.2	8%	0.078	9%	0.086	C	C	.	.	H	α-helix	trans	-80.6	-32.1	-177.1	-69	-54.5	-167.9	-178.9	0	115	Y376 F377 P382 D516 Y520 D596 P599	Y376-K380 HydrophobicContact CD2-CG 4.25Å; Y376-K380 HydrophobicContact CE2-CG 3.92Å; Y376-K380 WeakPolarHBondContact O-CB 3.44Å; Y376-K380 WeakPolarHBondContact O-CG 3.4Å; Y376-K380 PolarHBondContact O-N 3.45Å; F377-K380 PolarHBondContact O-N 2.74Å; K380-P382 VanDerWaalsContact C-CD 3.45Å; K380-P382 VanDerWaalsContact O-CD 3.26Å; K380-P382 WeakPolarHBondContact O-CD 3.11Å; K380-D516 WeakPolarHBondContact CE-OD2 3.31Å; K380-D516 IonicContact NZ-OD1 2.62Å; K380-D516 PolarHBondContact NZ-OD1 3.27Å; K380-D516 IonicContact NZ-OD2 3.74Å; K380-D516 PolarHBondContact NZ-OD2 3.21Å; K380-Y520 WeakPolarHBondContact CD-OH 3.26Å; K380-Y520 WeakPolarHBondContact CE-OH 3.33Å; K380-Y520 PolarHBondContact NZ-OH 3.14Å; K380-D596 VanDerWaalsContact NZ-CG 3.32Å; K380-D596 IonicContact NZ-OD1 3.7Å; K380-D596 PolarHBondContact NZ-OD1 3.35Å; K380-D596 IonicContact NZ-OD2 3.85Å; K380-P599 WeakPolarHBondContact O-CD 3.35Å
381	Y	91.8	Very high	94.7	Very high	18 Å²	18	16.9 Å²	16.9	7%	0.071	10%	0.098	C	C	.	.	S	Bend	trans	-120.5	74.8	-174.7	-54.9	-78.9	0	0	0	109.5	F377 G383 H453 F510 P599 P604	F377-Y381 AromaticContact CD2-CD2 3.63Å; F377-Y381 HydrophobicContact CD2-CD2 3.63Å; F377-Y381 HydrophobicContact CD2-CE2 4.15Å; F377-Y381 HydrophobicContact CD2-CG 4.48Å; F377-Y381 AromaticContact CE2-CD2 3.73Å; F377-Y381 HydrophobicContact CE2-CD2 3.73Å; F377-Y381 HydrophobicContact CE2-CE2 4.36Å; F377-Y381 HydrophobicContact CE2-CG 4.18Å; F377-Y381 HydrophobicContact CG-CD2 4.14Å; F377-Y381 HydrophobicContact CZ-CD2 4.33Å; F377-Y381 HydrophobicContact CZ-CG 4.42Å; F377-Y381 WeakPolarHBondContact O-CB 3.29Å; F377-Y381 WeakPolarHBondContact O-CD2 3.49Å; F377-Y381 PolarHBondContact O-N 3.46Å; Y381-G383 PolarHBondContact O-N 2.64Å; Y381-H453 PolarHBondContact O-CE1 3.07Å; Y381-F510 HydrophobicContact CD2-CZ 4.22Å; Y381-F510 HydrophobicContact CE2-CE1 4Å; Y381-F510 AromaticContact CE2-CZ 3.57Å; Y381-F510 HydrophobicContact CE2-CZ 3.57Å; Y381-F510 AromaticContact CZ-CZ 3.9Å; Y381-P599 HydrophobicContact CD1-CG 4.13Å; Y381-P599 HydrophobicContact CE1-CB 4.34Å; Y381-P599 HydrophobicContact CE1-CG 3.89Å; Y381-P604 VanDerWaalsContact OH-CD 3.25Å; Y381-P604 WeakPolarHBondContact OH-CD 3.43Å; Y381-P604 WeakPolarHBondContact OH-CG 3.3Å
382	P	90.6	Very high	94.4	Very high	86 Å²	86	18.5 Å²	18.5	56%	0.558	11%	0.106	S	C	*	.			trans	-63.5	136.2	178	27.1	-34.5	0	0	0	110.4	K380	K380-P382 VanDerWaalsContact C-CD 3.45Å; K380-P382 VanDerWaalsContact O-CD 3.26Å; K380-P382 WeakPolarHBondContact O-CD 3.11Å
383	G	91.2	Very high	94.2	Very high	6 Å²	6	21.7 Å²	21.7	6%	0.062	13%	0.13	C	C	.	.	S	Bend	trans	161.3	169.4	-175.8	0	0	0	0	0	111.2	Y381 T385 K432 N433	Y381-G383 PolarHBondContact O-N 2.64Å; G383-T385 PolarHBondContact O-N 3.4Å; G383-T385 VanDerWaalsContact O-N 3.13Å; G383-T385 PolarHBondContact O-OG1 3.01Å; G383-K432 CarbonylContact C-O 3.51Å; G383-N433 PolarHBondContact N-OD1 2.76Å; G383-N433 PolarHBondContact O-OD1 3.03Å
384	R	93.9	Very high	94.1	Very high	35 Å²	35	21.7 Å²	21.7	13%	0.132	13%	0.131	C	C	.	.			trans	-70.8	115.4	178.4	-67.9	-165.6	-170.3	87.6	-5.2	109.4	F428 E429 L431 K432 S434 N450 D452 H453	R384-F428 HydrophobicContact CB-CE2 4.23Å; R384-F428 HydrophobicContact CB-CZ 3.94Å; R384-E429 PolarHBondContact NE-O 3.33Å; R384-E429 PolarHBondContact NH2-O 2.62Å; R384-L431 PolarHBondContact NE-O 3.31Å; R384-K432 WeakPolarHBondContact CG-O 3.4Å; R384-K432 PolarHBondContact N-O 2.86Å; R384-S434 WeakPolarHBondContact CA-O 3.42Å; R384-N450 WeakPolarHBondContact CB-O 3.41Å; R384-N450 WeakPolarHBondContact CD-O 3.47Å; R384-N450 VanDerWaalsContact NH1-CB 3.32Å; R384-N450 PolarHBondContact NH1-O 3.17Å; R384-D452 PolarHBondContact N-OD2 2.89Å; R384-D452 PolarHBondContact O-N 2.91Å; R384-H453 PolarHBondContact O-N 2.91Å
385	T	95.8	Very high	94.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.6	-174.7	-57.5	0	0	0	0	110.8	L378 G383 I387 S434 V435 L436 H453 I455	L378-T385 HydrophobicContact CD2-CG2 3.69Å; G383-T385 PolarHBondContact O-N 3.4Å; G383-T385 VanDerWaalsContact O-N 3.13Å; G383-T385 PolarHBondContact O-OG1 3.01Å; T385-I387 HydrophobicContact CG2-CG1 3.99Å; T385-S434 PolarHBondContact N-O 3.22Å; T385-V435 VanDerWaalsContact O-CA 3.29Å; T385-V435 WeakPolarHBondContact O-CA 3.1Å; T385-L436 PolarHBondContact O-N 2.92Å; T385-H453 WeakPolarHBondContact CA-O 3.31Å; T385-H453 HydrophobicContact CG2-CB 3.93Å; T385-H453 PolarHBondContact OG1-ND1 3.37Å; T385-H453 VanDerWaalsContact OG1-ND1 3.09Å; T385-I455 HydrophobicContact CG2-CD1 3.73Å; T385-I455 HydrophobicContact CG2-CG1 3.9Å
386	L	95.3	Very high	94	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.9	174.1	-178.1	63	0	0	0	109.5	F388 L436 A438 I448 V451 H453 V454 I455 R472	L386-F388 HydrophobicContact CD2-CD2 4.5Å; L386-F388 HydrophobicContact CD2-CE1 4.33Å; L386-F388 HydrophobicContact CD2-CE2 3.49Å; L386-F388 VanDerWaalsContact CD2-CE2 3.49Å; L386-F388 HydrophobicContact CD2-CZ 3.41Å; L386-F388 VanDerWaalsContact CD2-CZ 3.41Å; L386-F388 HydrophobicContact CG-CD2 4.24Å; L386-F388 HydrophobicContact CG-CE2 3.68Å; L386-F388 HydrophobicContact CG-CZ 3.95Å; L386-L436 HydrophobicContact CD1-CB 3.78Å; L386-L436 HydrophobicContact CD1-CD2 3.79Å; L386-L436 HydrophobicContact CD1-CG 3.89Å; L386-L436 WeakPolarHBondContact CD1-O 3.25Å; L386-A438 HydrophobicContact CD1-CB 4.28Å; L386-I448 HydrophobicContact CD1-CD1 4.43Å; L386-I448 HydrophobicContact CD2-CD1 4.39Å; L386-V451 HydrophobicContact CB-CG1 3.97Å; L386-H453 PolarHBondContact N-O 3.34Å; L386-V454 HydrophobicContact CB-CG2 4.49Å; L386-V454 CarbonylContact O-C 3.57Å; L386-V454 VanDerWaalsContact O-CA 3.32Å; L386-V454 WeakPolarHBondContact O-CA 3.35Å; L386-I455 PolarHBondContact O-N 3.45Å; L386-R472 HydrophobicContact CD2-CB 3.63Å; L386-R472 HydrophobicContact CD2-CG 3.62Å
387	I	97.1	Very high	94.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.9	-179	-51.7	-172.8	0	0	0	109.7	V374 L378 T385 L398 L402 V435 L436 V437 A438 I455 Y457	V374-I387 HydrophobicContact CG1-CD1 3.77Å; L378-I387 HydrophobicContact CD1-CD1 4.29Å; T385-I387 HydrophobicContact CG2-CG1 3.99Å; I387-L398 HydrophobicContact CG2-CD2 3.79Å; I387-L402 HydrophobicContact CD1-CD1 4.12Å; I387-V435 HydrophobicContact CD1-CG1 3.52Å; I387-V435 HydrophobicContact CG1-CG1 3.77Å; I387-L436 PolarHBondContact N-O 2.9Å; I387-V437 HydrophobicContact CB-CG2 4.42Å; I387-V437 CarbonylContact O-C 3.49Å; I387-V437 WeakPolarHBondContact O-CA 3.49Å; I387-A438 PolarHBondContact O-N 3.44Å; I387-I455 CarbonylContact C-O 3.49Å; I387-I455 VanDerWaalsContact CA-O 3.29Å; I387-I455 WeakPolarHBondContact CA-O 3.39Å; I387-I455 HydrophobicContact CD1-CD1 4.27Å; I387-I455 HydrophobicContact CG1-CB 4.12Å; I387-I455 HydrophobicContact CG1-CD1 4.29Å; I387-I455 HydrophobicContact CG2-CB 4.28Å; I387-I455 HydrophobicContact CG2-CG2 4.42Å; I387-Y457 HydrophobicContact CG2-CG 4.48Å
388	F	96.6	Very high	94.2	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.009	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.1	178.1	-68.2	-91.8	0	0	0	112.3	L386 A438 S443 V454 I455 Y457 Q458 R469 R472	L386-F388 HydrophobicContact CD2-CD2 4.5Å; L386-F388 HydrophobicContact CD2-CE1 4.33Å; L386-F388 HydrophobicContact CD2-CE2 3.49Å; L386-F388 VanDerWaalsContact CD2-CE2 3.49Å; L386-F388 HydrophobicContact CD2-CZ 3.41Å; L386-F388 VanDerWaalsContact CD2-CZ 3.41Å; L386-F388 HydrophobicContact CG-CD2 4.24Å; L386-F388 HydrophobicContact CG-CE2 3.68Å; L386-F388 HydrophobicContact CG-CZ 3.95Å; F388-A438 WeakPolarHBondContact CA-O 3.41Å; F388-S443 WeakPolarHBondContact CD1-OG 3.46Å; F388-S443 WeakPolarHBondContact CE1-OG 3.43Å; F388-V454 HydrophobicContact CD2-CG1 3.77Å; F388-V454 HydrophobicContact CE2-CG1 3.62Å; F388-V454 HydrophobicContact CE2-CG2 4.49Å; F388-I455 PolarHBondContact N-O 2.93Å; F388-Y457 WeakPolarHBondContact O-CA 3.37Å; F388-Y457 WeakPolarHBondContact O-CB 3.43Å; F388-Y457 PolarHBondContact O-N 2.7Å; F388-Q458 PolarHBondContact O-N 2.96Å; F388-R469 HydrophobicContact CB-CG 4.44Å; F388-R469 HydrophobicContact CD1-CB 4.33Å; F388-R469 HydrophobicContact CD1-CG 3.55Å; F388-R469 HydrophobicContact CD2-CB 3.89Å; F388-R469 HydrophobicContact CD2-CG 3.96Å; F388-R469 HydrophobicContact CE1-CB 4.04Å; F388-R469 HydrophobicContact CE1-CG 3.48Å; F388-R469 VanDerWaalsContact CE1-CG 3.48Å; F388-R469 HydrophobicContact CE2-CB 3.65Å; F388-R469 HydrophobicContact CE2-CG 3.96Å; F388-R469 WeakPolarHBondContact CE2-O 3.39Å; F388-R469 HydrophobicContact CG-CB 4.22Å; F388-R469 VanDerWaalsContact CG-CD 3.5Å; F388-R469 HydrophobicContact CG-CG 3.75Å; F388-R469 HydrophobicContact CZ-CB 3.72Å; F388-R469 HydrophobicContact CZ-CG 3.72Å; F388-R472 HydrophobicContact CE2-CG 4.33Å; F388-R472 HydrophobicContact CZ-CG 3.76Å
389	A	95.3	Very high	94.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151.3	169.4	0	0	0	0	0	110.6	C394 V395 A438 S439	A389-C394 HydrophobicContact CB-CB 3.9Å; A389-V395 HydrophobicContact CB-CG2 3.94Å; A389-A438 PolarHBondContact N-O 3.09Å; A389-S439 WeakPolarHBondContact O-CA 3.28Å
390	N	92.3	Very high	94.5	Very high	44 Å²	44	31.6 Å²	31.6	24%	0.235	16%	0.164	C	C	.	.	S	Bend	trans	-81.3	-22.6	179.5	-67.2	-16.9	0	0	0	112.1	Q458 V459 R469	N390-Q458 HydrophobicContact CB-CB 4.16Å; N390-Q458 WeakPolarHBondContact ND2-CB 3.32Å; N390-V459 PolarHBondContact ND2-O 2.73Å; N390-R469 PolarHBondContact OD1-NH2 3.49Å
391	S	91.4	Very high	94.8	Very high	38 Å²	38	30.8 Å²	30.8	27%	0.266	16%	0.161	S	C	.	.	S	Bend	trans	-121.9	147.4	-178.1	74.3	0	0	0	0	113.5	S393 C394 V395	S391-S393 VanDerWaalsContact C-N 3.29Å; S391-S393 PolarHBondContact O-N 3.1Å; S391-S393 PolarHBondContact OG-OG 2.84Å; S391-C394 WeakPolarHBondContact O-CB 3.36Å; S391-C394 PolarHBondContact O-N 2.77Å; S391-C394 WeakPolarHBondContact OG-CB 3.44Å; S391-C394 PolarHBondContact OG-N 2.6Å; S391-C394 VanDerWaalsContact OG-N 3.13Å; S391-V395 PolarHBondContact O-N 3.07Å; S391-V395 VanDerWaalsContact O-N 3.11Å
392	I	92.7	Very high	95.1	Very high	38 Å²	38	30 Å²	30	20%	0.195	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-38.8	175.3	-59.6	-176.9	0	0	0	110.9	C394 V395 R396 H413 A414 E415	I392-C394 VanDerWaalsContact C-N 3.29Å; I392-C394 PolarHBondContact O-N 3.22Å; I392-V395 WeakPolarHBondContact O-CB 3.15Å; I392-V395 PolarHBondContact O-N 3.19Å; I392-R396 HydrophobicContact CG2-CG 4.49Å; I392-R396 WeakPolarHBondContact O-CG 3.11Å; I392-R396 PolarHBondContact O-N 2.84Å; I392-H413 HydrophobicContact CB-CB 4.48Å; I392-H413 HydrophobicContact CD1-CB 4.45Å; I392-H413 HydrophobicContact CG1-CB 4.06Å; I392-H413 HydrophobicContact CG2-CB 4.04Å; I392-A414 HydrophobicContact CD1-CB 4.34Å; I392-E415 HydrophobicContact CD1-CG 4.01Å; I392-E415 WeakPolarHBondContact CD1-OE1 3.41Å
393	S	93.1	Very high	95.4	Very high	83 Å²	83	29.2 Å²	29.2	58%	0.58	15%	0.154	S	C	*	.	H	α-helix	trans	-57.2	-42.9	174.5	55.4	0	0	0	0	112	S391 R396 R397	S391-S393 VanDerWaalsContact C-N 3.29Å; S391-S393 PolarHBondContact O-N 3.1Å; S391-S393 PolarHBondContact OG-OG 2.84Å; S393-R396 PolarHBondContact O-N 3.01Å; S393-R397 WeakPolarHBondContact O-CB 3.32Å; S393-R397 PolarHBondContact O-N 2.87Å
394	C	95.2	Very high	95.6	Very high	9 Å²	9	31.2 Å²	31.2	6%	0.061	16%	0.161	C	C	.	.	H	α-helix	trans	-67.6	-39.9	177.4	-173.5	0	0	0	0	111.8	A389 S391 I392 R396 R397 L398 Y457	A389-C394 HydrophobicContact CB-CB 3.9Å; S391-C394 WeakPolarHBondContact O-CB 3.36Å; S391-C394 PolarHBondContact O-N 2.77Å; S391-C394 WeakPolarHBondContact OG-CB 3.44Å; S391-C394 PolarHBondContact OG-N 2.6Å; S391-C394 VanDerWaalsContact OG-N 3.13Å; I392-C394 VanDerWaalsContact C-N 3.29Å; I392-C394 PolarHBondContact O-N 3.22Å; C394-R396 VanDerWaalsContact C-N 3.34Å; C394-R396 PolarHBondContact O-N 3.13Å; C394-R397 PolarHBondContact O-N 3.15Å; C394-L398 VanDerWaalsContact O-CB 3.22Å; C394-L398 WeakPolarHBondContact O-CB 3.26Å; C394-L398 PolarHBondContact O-N 2.85Å; C394-Y457 WeakPolarHBondContact SG-CD1 3.45Å; C394-Y457 WeakPolarHBondContact SG-CE1 3.42Å
395	V	96.2	Very high	95.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.8	-46.3	174.3	173.8	0	0	0	0	111	A389 S391 I392 R399 V437	A389-V395 HydrophobicContact CB-CG2 3.94Å; S391-V395 PolarHBondContact O-N 3.07Å; S391-V395 VanDerWaalsContact O-N 3.11Å; I392-V395 WeakPolarHBondContact O-CB 3.15Å; I392-V395 PolarHBondContact O-N 3.19Å; V395-R399 WeakPolarHBondContact O-CB 3.47Å; V395-R399 PolarHBondContact O-N 3.26Å; V395-V437 HydrophobicContact CB-CG1 4.29Å; V395-V437 HydrophobicContact CG1-CB 4.36Å; V395-V437 HydrophobicContact CG1-CG1 4.08Å; V395-V437 WeakPolarHBondContact CG1-O 3.41Å; V395-V437 HydrophobicContact CG2-CG1 4.32Å
396	R	95.7	Very high	95.6	Very high	123 Å²	123	35 Å²	35	46%	0.464	18%	0.184	S	C	.	.	H	α-helix	trans	-63.1	-50.4	179.7	-73.2	174.6	169.5	156.4	-2.4	111.7	I392 S393 C394 S400 H413 E415	I392-R396 HydrophobicContact CG2-CG 4.49Å; I392-R396 WeakPolarHBondContact O-CG 3.11Å; I392-R396 PolarHBondContact O-N 2.84Å; S393-R396 PolarHBondContact O-N 3.01Å; C394-R396 VanDerWaalsContact C-N 3.34Å; C394-R396 PolarHBondContact O-N 3.13Å; R396-S400 PolarHBondContact O-N 2.87Å; R396-H413 PolarHBondContact NH2-CE1 2.93Å; R396-E415 IonicContact CZ-OE2 2.74Å; R396-E415 VanDerWaalsContact CZ-OE2 3.25Å; R396-E415 IonicContact NH1-OE2 3.39Å; R396-E415 PolarHBondContact NH1-OE2 2.59Å; R396-E415 IonicContact NH2-OE2 3.23Å; R396-E415 PolarHBondContact NH2-OE2 3.26Å
397	R	97	Very high	95.6	Very high	43 Å²	43	36.4 Å²	36.4	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-53.6	179.3	-170.2	-160.2	67.2	89.1	2	111.7	D371 S393 C394 R399 S400 L401 Y457 E531	D371-R397 IonicContact OD1-CZ 3.15Å; D371-R397 IonicContact OD1-NH1 3.81Å; D371-R397 PolarHBondContact OD1-NH1 2.61Å; D371-R397 IonicContact OD1-NH2 3.65Å; D371-R397 PolarHBondContact OD1-NH2 3.33Å; D371-R397 IonicContact OD2-CZ 2.6Å; D371-R397 IonicContact OD2-NH1 2.94Å; D371-R397 PolarHBondContact OD2-NH1 3.21Å; D371-R397 IonicContact OD2-NH2 2.87Å; S393-R397 WeakPolarHBondContact O-CB 3.32Å; S393-R397 PolarHBondContact O-N 2.87Å; C394-R397 PolarHBondContact O-N 3.15Å; R397-R399 PolarHBondContact O-N 3.34Å; R397-S400 WeakPolarHBondContact O-CB 3.45Å; R397-S400 PolarHBondContact O-N 3.1Å; R397-S400 VanDerWaalsContact O-N 3.09Å; R397-L401 PolarHBondContact O-N 2.94Å; R397-Y457 PolarHBondContact NH2-OH 3.36Å; R397-E531 VanDerWaalsContact CG-CD 3.48Å; R397-E531 WeakPolarHBondContact CG-OE1 3.13Å; R397-E531 WeakPolarHBondContact CG-OE2 3.41Å
398	L	97.9	Very high	95.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-38.6	-176.1	-177.2	59.6	0	0	0	111.9	I387 C394 S400 L401 L402 V437 Y457	I387-L398 HydrophobicContact CG2-CD2 3.79Å; C394-L398 VanDerWaalsContact O-CB 3.22Å; C394-L398 WeakPolarHBondContact O-CB 3.26Å; C394-L398 PolarHBondContact O-N 2.85Å; L398-S400 VanDerWaalsContact C-N 3.34Å; L398-S400 PolarHBondContact O-N 3.43Å; L398-L401 HydrophobicContact CD1-CD2 4.24Å; L398-L401 PolarHBondContact O-N 3.08Å; L398-L402 HydrophobicContact CD1-CD1 4.19Å; L398-L402 HydrophobicContact CD1-CG 4.11Å; L398-L402 HydrophobicContact CG-CD1 4.04Å; L398-L402 HydrophobicContact CG-CG 4.39Å; L398-L402 WeakPolarHBondContact O-CB 3.41Å; L398-L402 VanDerWaalsContact O-CG 3.25Å; L398-L402 WeakPolarHBondContact O-CG 3.28Å; L398-L402 PolarHBondContact O-N 3.33Å; L398-V437 HydrophobicContact CB-CG1 4.28Å; L398-V437 HydrophobicContact CD2-CG1 4Å; L398-V437 HydrophobicContact CG-CG1 4.35Å; L398-V437 HydrophobicContact CG-CG2 4.43Å; L398-Y457 HydrophobicContact CD1-CE2 4.27Å; L398-Y457 HydrophobicContact CD2-CD1 4.27Å; L398-Y457 HydrophobicContact CD2-CD2 3.7Å; L398-Y457 HydrophobicContact CD2-CE2 4.14Å; L398-Y457 HydrophobicContact CD2-CG 3.78Å
399	R	97.2	Very high	95.5	Very high	83 Å²	83	40.8 Å²	40.8	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-59.8	-45.2	171.9	180	-161.9	168.8	163.5	-3.9	111.4	V395 R397 L402 S403 A409	V395-R399 WeakPolarHBondContact O-CB 3.47Å; V395-R399 PolarHBondContact O-N 3.26Å; R397-R399 PolarHBondContact O-N 3.34Å; R399-L402 PolarHBondContact O-N 3.33Å; R399-S403 WeakPolarHBondContact O-CB 3.3Å; R399-S403 PolarHBondContact O-N 3.38Å; R399-A409 HydrophobicContact CG-CB 4.46Å
400	S	96.7	Very high	95.5	Very high	36 Å²	36	42 Å²	42	25%	0.252	22%	0.223	S	C	.	.	H	α-helix	trans	-60.7	-49.8	179.8	-165.6	0	0	0	0	110.8	R396 R397 L398 L402 S403 K404	R396-S400 PolarHBondContact O-N 2.87Å; R397-S400 WeakPolarHBondContact O-CB 3.45Å; R397-S400 PolarHBondContact O-N 3.1Å; R397-S400 VanDerWaalsContact O-N 3.09Å; L398-S400 VanDerWaalsContact C-N 3.34Å; L398-S400 PolarHBondContact O-N 3.43Å; S400-L402 PolarHBondContact O-N 3.35Å; S400-S403 WeakPolarHBondContact O-CB 2.92Å; S400-S403 PolarHBondContact O-N 3.25Å; S400-K404 PolarHBondContact O-N 3.38Å; S400-K404 VanDerWaalsContact O-N 3.1Å
401	L	98	Very high	95.6	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-55.1	-52.5	176.2	178.1	68.7	0	0	0	112	D371 R397 L398 S403 K404 L405 A527 A528	D371-L401 HydrophobicContact CB-CD2 3.73Å; R397-L401 PolarHBondContact O-N 2.94Å; L398-L401 HydrophobicContact CD1-CD2 4.24Å; L398-L401 PolarHBondContact O-N 3.08Å; L401-S403 VanDerWaalsContact C-N 3.29Å; L401-S403 PolarHBondContact O-N 2.89Å; L401-K404 WeakPolarHBondContact O-CB 3.44Å; L401-K404 PolarHBondContact O-N 3.44Å; L401-K404 VanDerWaalsContact O-N 3.13Å; L401-L405 HydrophobicContact CD1-CD1 4.31Å; L401-L405 HydrophobicContact CG-CD1 4.1Å; L401-L405 WeakPolarHBondContact O-CG 3.5Å; L401-L405 PolarHBondContact O-N 3.32Å; L401-L405 VanDerWaalsContact O-N 3.11Å; L401-A527 HydrophobicContact CD1-CB 3.77Å; L401-A528 HydrophobicContact CD1-CB 4.1Å
402	L	98	Very high	95.6	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-35.9	-178.9	-71.2	176.1	0	0	0	112.3	V374 L378 I387 L398 R399 S400 K404 L405 V407 A409 V435 V437	V374-L402 HydrophobicContact CG1-CD2 4.24Å; L378-L402 HydrophobicContact CD1-CD1 4.21Å; L378-L402 HydrophobicContact CD1-CD2 3.67Å; I387-L402 HydrophobicContact CD1-CD1 4.12Å; L398-L402 HydrophobicContact CD1-CD1 4.19Å; L398-L402 HydrophobicContact CD1-CG 4.11Å; L398-L402 HydrophobicContact CG-CD1 4.04Å; L398-L402 HydrophobicContact CG-CG 4.39Å; L398-L402 WeakPolarHBondContact O-CB 3.41Å; L398-L402 VanDerWaalsContact O-CG 3.25Å; L398-L402 WeakPolarHBondContact O-CG 3.28Å; L398-L402 PolarHBondContact O-N 3.33Å; R399-L402 PolarHBondContact O-N 3.33Å; S400-L402 PolarHBondContact O-N 3.35Å; L402-K404 VanDerWaalsContact C-N 3.31Å; L402-K404 PolarHBondContact O-N 3.46Å; L402-L405 CarbonylContact O-C 3.54Å; L402-L405 PolarHBondContact O-N 3.16Å; L402-L405 VanDerWaalsContact O-N 3.13Å; L402-V407 HydrophobicContact CB-CB 4.16Å; L402-V407 HydrophobicContact CD2-CG2 4.36Å; L402-V407 WeakPolarHBondContact O-CB 3.46Å; L402-V407 PolarHBondContact O-N 3.33Å; L402-A409 HydrophobicContact CB-CB 3.62Å; L402-A409 HydrophobicContact CD1-CB 4.17Å; L402-V435 HydrophobicContact CD1-CG1 4.09Å; L402-V437 HydrophobicContact CD1-CG2 4.01Å
403	S	96.2	Very high	95.6	Very high	69 Å²	69	37.1 Å²	37.1	48%	0.483	19%	0.193	S	C	.	.	H	α-helix	trans	-64.5	-35.8	175.1	-172	0	0	0	0	112.3	R399 S400 L401 L405 N406	R399-S403 WeakPolarHBondContact O-CB 3.3Å; R399-S403 PolarHBondContact O-N 3.38Å; S400-S403 WeakPolarHBondContact O-CB 2.92Å; S400-S403 PolarHBondContact O-N 3.25Å; L401-S403 VanDerWaalsContact C-N 3.29Å; L401-S403 PolarHBondContact O-N 2.89Å; S403-L405 VanDerWaalsContact C-N 3.27Å; S403-N406 PolarHBondContact O-N 2.98Å
404	K	95	Very high	95.2	Very high	48 Å²	48	35.3 Å²	35.3	21%	0.209	18%	0.184	C	C	.	.	H	α-helix	trans	-69.6	-27.2	173.6	-68.2	-59.4	-160.2	-73.1	0	112.2	S400 L401 L402 N406 A527 I530 E534	S400-K404 PolarHBondContact O-N 3.38Å; S400-K404 VanDerWaalsContact O-N 3.1Å; L401-K404 WeakPolarHBondContact O-CB 3.44Å; L401-K404 PolarHBondContact O-N 3.44Å; L401-K404 VanDerWaalsContact O-N 3.13Å; L402-K404 VanDerWaalsContact C-N 3.31Å; L402-K404 PolarHBondContact O-N 3.46Å; K404-N406 PolarHBondContact O-N 3.39Å; K404-A527 HydrophobicContact CB-CB 4.19Å; K404-I530 HydrophobicContact CD-CG2 4.3Å; K404-I530 HydrophobicContact CG-CG2 4.46Å; K404-E534 VanDerWaalsContact CE-OE1 3.28Å; K404-E534 WeakPolarHBondContact CE-OE1 3.43Å; K404-E534 IonicContact NZ-OE1 2.72Å; K404-E534 PolarHBondContact NZ-OE1 3.49Å; K404-E534 IonicContact NZ-OE2 3.26Å; K404-E534 PolarHBondContact NZ-OE2 3.34Å
405	L	95.8	Very high	94.8	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	18.4	175.6	-68	167.4	0	0	0	113.9	Y375 L401 L402 S403 V407 R523 V524 A527 L586	Y375-L405 HydrophobicContact CD1-CD1 4.31Å; Y375-L405 HydrophobicContact CD1-CD2 4.37Å; Y375-L405 HydrophobicContact CD2-CB 3.91Å; Y375-L405 HydrophobicContact CD2-CD1 3.75Å; Y375-L405 HydrophobicContact CD2-CG 4.29Å; Y375-L405 HydrophobicContact CE1-CD2 4.11Å; Y375-L405 HydrophobicContact CE2-CB 3.64Å; Y375-L405 HydrophobicContact CE2-CD1 4.26Å; Y375-L405 HydrophobicContact CE2-CD2 4.34Å; Y375-L405 HydrophobicContact CE2-CG 4.3Å; Y375-L405 HydrophobicContact CG-CD1 3.79Å; L401-L405 HydrophobicContact CD1-CD1 4.31Å; L401-L405 HydrophobicContact CG-CD1 4.1Å; L401-L405 WeakPolarHBondContact O-CG 3.5Å; L401-L405 PolarHBondContact O-N 3.32Å; L401-L405 VanDerWaalsContact O-N 3.11Å; L402-L405 CarbonylContact O-C 3.54Å; L402-L405 PolarHBondContact O-N 3.16Å; L402-L405 VanDerWaalsContact O-N 3.13Å; S403-L405 VanDerWaalsContact C-N 3.27Å; L405-V407 HydrophobicContact CB-CG2 4.37Å; L405-V407 PolarHBondContact O-N 2.81Å; L405-R523 HydrophobicContact CD2-CB 4.17Å; L405-V524 HydrophobicContact CD1-CG2 4.19Å; L405-V524 HydrophobicContact CD2-CG2 4.45Å; L405-A527 HydrophobicContact CD1-CB 4.33Å; L405-A527 HydrophobicContact CD2-CB 3.58Å; L405-A527 HydrophobicContact CG-CB 3.68Å; L405-L586 HydrophobicContact CD2-CD1 4.49Å
406	N	94.2	Very high	94.5	Very high	114 Å²	114	41.7 Å²	41.7	61%	0.61	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	26.2	-177.1	-68.3	-30.4	0	0	0	114.7	S403 K404 F590	S403-N406 PolarHBondContact O-N 2.98Å; K404-N406 PolarHBondContact O-N 3.39Å; N406-F590 HydrophobicContact CB-CZ 4.35Å; N406-F590 WeakPolarHBondContact ND2-CD2 3.39Å; N406-F590 WeakPolarHBondContact ND2-CE2 2.82Å
407	V	95.9	Very high	94.2	Very high	28 Å²	28	40.1 Å²	40.1	17%	0.17	21%	0.214	C	C	.	.			trans	-92	135.2	174	-179.1	0	0	0	0	109.8	Y375 L378 L402 L405 A409 V435	Y375-V407 HydrophobicContact CD2-CG2 4.12Å; Y375-V407 HydrophobicContact CE2-CG2 3.95Å; L378-V407 HydrophobicContact CD1-CG1 4.32Å; L402-V407 HydrophobicContact CB-CB 4.16Å; L402-V407 HydrophobicContact CD2-CG2 4.36Å; L402-V407 WeakPolarHBondContact O-CB 3.46Å; L402-V407 PolarHBondContact O-N 3.33Å; L405-V407 HydrophobicContact CB-CG2 4.37Å; L405-V407 PolarHBondContact O-N 2.81Å; V407-A409 PolarHBondContact O-N 2.91Å; V407-V435 HydrophobicContact CG1-CB 4.19Å; V407-V435 HydrophobicContact CG1-CG2 3.51Å
408	N	95.4	Very high	93.6	Very high	86 Å²	86	38.1 Å²	38.1	46%	0.46	21%	0.206	S	C	.	.			trans	-69.4	73.9	173.4	-70.2	-41.6	0	0	0	111.6	L431 N433 V435	N408-L431 HydrophobicContact CB-CD1 4.41Å; N408-N433 PolarHBondContact ND2-O 3.44Å; N408-V435 PolarHBondContact O-N 3.47Å
409	A	96.5	Very high	93.2	Very high	9 Å²	9	45 Å²	45	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124	-174.9	0	0	0	0	0	112.9	R399 L402 V407 V435	R399-A409 HydrophobicContact CG-CB 4.46Å; L402-A409 HydrophobicContact CB-CB 3.62Å; L402-A409 HydrophobicContact CD1-CB 4.17Å; V407-A409 PolarHBondContact O-N 2.91Å; A409-V435 CarbonylContact C-O 3.55Å; A409-V435 WeakPolarHBondContact CA-O 3.23Å; A409-V435 HydrophobicContact CB-CB 4.43Å
410	F	95.6	Very high	92.8	Very high	26 Å²	26	46.5 Å²	46.5	11%	0.114	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	145.6	175	-53.5	-74.2	0	0	0	110.1	N424 K427 F428 L431 V435 L436 V437	F410-N424 HydrophobicContact CB-CB 4.19Å; F410-K427 HydrophobicContact CD1-CB 4.26Å; F410-K427 HydrophobicContact CD1-CD 4.3Å; F410-K427 HydrophobicContact CE1-CB 3.79Å; F410-K427 HydrophobicContact CE1-CD 3.73Å; F410-K427 HydrophobicContact CE1-CG 4.37Å; F410-K427 HydrophobicContact CE2-CB 4.12Å; F410-K427 HydrophobicContact CZ-CB 3.71Å; F410-K427 HydrophobicContact CZ-CD 4.35Å; F410-F428 HydrophobicContact CD2-CB 4.2Å; F410-L431 HydrophobicContact CE2-CD1 3.98Å; F410-L431 HydrophobicContact CZ-CD1 3.82Å; F410-V435 PolarHBondContact N-O 3.49Å; F410-L436 HydrophobicContact CB-CD1 3.89Å; F410-V437 PolarHBondContact O-N 2.66Å
411	G	94	Very high	92.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	147.4	177.3	0	0	0	0	0	111.7	M416 N424 V437	G411-M416 WeakPolarHBondContact O-CE 3.4Å; G411-N424 PolarHBondContact O-ND2 3.2Å; G411-V437 CarbonylContact C-O 3.53Å; G411-V437 WeakPolarHBondContact CA-O 3.47Å
412	L	91.8	Very high	92	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	115.6	172.2	-159.1	72.5	0	0	0	110.5	R421 L436 V437 A438 S439 A442 L446	L412-R421 HydrophobicContact CD1-CB 3.66Å; L412-R421 HydrophobicContact CD1-CG 3.76Å; L412-L436 HydrophobicContact CB-CD1 4.12Å; L412-L436 HydrophobicContact CD2-CD2 4.34Å; L412-V437 PolarHBondContact N-O 3.4Å; L412-A438 HydrophobicContact CB-CB 3.99Å; L412-A438 VanDerWaalsContact O-CA 3.23Å; L412-A438 WeakPolarHBondContact O-CA 3.4Å; L412-S439 PolarHBondContact O-N 3.29Å; L412-A442 HydrophobicContact CB-CB 3.98Å; L412-A442 HydrophobicContact CD2-CB 3.95Å; L412-A442 WeakPolarHBondContact CD2-O 3.37Å; L412-A442 HydrophobicContact CG-CB 3.59Å; L412-A442 WeakPolarHBondContact O-CB 3.44Å; L412-L446 HydrophobicContact CD2-CD1 3.62Å
413	H	91.6	Very high	91.6	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.065	26%	0.257	C	S	.	.			trans	-150.4	168.5	177.4	62.4	79.2	0	0	0	111.9	I392 R396 E415 M416 R421	I392-H413 HydrophobicContact CB-CB 4.48Å; I392-H413 HydrophobicContact CD1-CB 4.45Å; I392-H413 HydrophobicContact CG1-CB 4.06Å; I392-H413 HydrophobicContact CG2-CB 4.04Å; R396-H413 PolarHBondContact NH2-CE1 2.93Å; H413-E415 PolarHBondContact ND1-N 3.28Å; H413-E415 PolarHBondContact O-N 3.48Å; H413-M416 WeakPolarHBondContact CE1-CG 3.43Å; H413-M416 VanDerWaalsContact NE2-CG 3.33Å; H413-M416 WeakPolarHBondContact NE2-CG 3.49Å; H413-M416 WeakPolarHBondContact O-CB 3.41Å; H413-M416 PolarHBondContact O-N 3.48Å; H413-R421 PolarHBondContact O-NH1 3.37Å
414	A	84.8	Confident	91.4	Very high	45 Å²	45	46.4 Å²	46.4	37%	0.372	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-48.7	-173.6	0	0	0	0	0	113.5	I392 M416 V441	I392-A414 HydrophobicContact CD1-CB 4.34Å; A414-M416 PolarHBondContact O-N 2.89Å; A414-V441 HydrophobicContact CB-CB 4.44Å; A414-V441 HydrophobicContact CB-CG1 4.05Å
415	E	87.5	Confident	91.1	Very high	125 Å²	125	45.3 Å²	45.3	58%	0.584	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	1.6	178.9	-63.7	167	-145.7	0	0	115.2	I392 R396 H413	I392-E415 HydrophobicContact CD1-CG 4.01Å; I392-E415 WeakPolarHBondContact CD1-OE1 3.41Å; R396-E415 IonicContact CZ-OE2 2.74Å; R396-E415 VanDerWaalsContact CZ-OE2 3.25Å; R396-E415 IonicContact NH1-OE2 3.39Å; R396-E415 PolarHBondContact NH1-OE2 2.59Å; R396-E415 IonicContact NH2-OE2 3.23Å; R396-E415 PolarHBondContact NH2-OE2 3.26Å; H413-E415 PolarHBondContact ND1-N 3.28Å; H413-E415 PolarHBondContact O-N 3.48Å
416	M	89.2	Confident	90.7	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.089	26%	0.258	C	S	.	.	S	Bend	trans	-81.4	136.9	176.5	-67.8	-174.3	58.9	0	0	111	G411 H413 A414 Q418 K420 R421 N424	G411-M416 WeakPolarHBondContact O-CE 3.4Å; H413-M416 WeakPolarHBondContact CE1-CG 3.43Å; H413-M416 VanDerWaalsContact NE2-CG 3.33Å; H413-M416 WeakPolarHBondContact NE2-CG 3.49Å; H413-M416 WeakPolarHBondContact O-CB 3.41Å; H413-M416 PolarHBondContact O-N 3.48Å; A414-M416 PolarHBondContact O-N 2.89Å; M416-Q418 PolarHBondContact O-N 2.82Å; M416-K420 HydrophobicContact CE-CD 4.14Å; M416-K420 HydrophobicContact CE-CG 3.93Å; M416-R421 HydrophobicContact CB-CG 3.56Å; M416-R421 WeakPolarHBondContact O-CD 3.22Å; M416-N424 VanDerWaalsContact CE-ND2 3.31Å; M416-N424 WeakPolarHBondContact CE-ND2 3.27Å
417	D	89.1	Confident	90.6	Very high	91 Å²	91	49 Å²	49	49%	0.487	25%	0.245	S	C	.	.			trans	-50.9	136.6	167.8	175.7	-98.7	0	0	0	111.5	K419 K420 R421	D417-K419 VanDerWaalsContact C-N 3.33Å; D417-K419 PolarHBondContact O-N 3.34Å; D417-K419 VanDerWaalsContact OD1-CB 3.29Å; D417-K419 WeakPolarHBondContact OD1-CB 3.47Å; D417-K419 PolarHBondContact OD1-N 3.39Å; D417-K420 HydrophobicContact CB-CB 4.34Å; D417-K420 WeakPolarHBondContact O-CB 3.41Å; D417-K420 PolarHBondContact O-N 3.3Å; D417-K420 VanDerWaalsContact O-N 3.12Å; D417-K420 PolarHBondContact OD1-N 3.04Å; D417-R421 WeakPolarHBondContact O-CG 3.43Å; D417-R421 PolarHBondContact O-N 3.38Å
418	Q	86	Confident	90.5	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-35.8	-171.1	-168	60.7	38.4	0	0	112.6	R189 E190 L217 M416 K420 R421 F422	R189-Q418 VanDerWaalsContact CD-CD 3.5Å; E190-Q418 PolarHBondContact OE1-NE2 3.45Å; L217-Q418 HydrophobicContact CD2-CB 4.32Å; L217-Q418 HydrophobicContact CD2-CG 4.17Å; L217-Q418 HydrophobicContact CG-CG 4.49Å; M416-Q418 PolarHBondContact O-N 2.82Å; Q418-K420 VanDerWaalsContact C-N 3.31Å; Q418-K420 PolarHBondContact O-N 3.49Å; Q418-R421 WeakPolarHBondContact O-CB 3.42Å; Q418-R421 PolarHBondContact O-N 2.95Å; Q418-F422 HydrophobicContact CG-CD2 4.31Å; Q418-F422 HydrophobicContact CG-CE2 3.71Å; Q418-F422 HydrophobicContact CG-CZ 3.84Å; Q418-F422 WeakPolarHBondContact O-CD2 3.34Å; Q418-F422 WeakPolarHBondContact O-CG 3.5Å; Q418-F422 PolarHBondContact O-N 3.43Å; Q418-F422 VanDerWaalsContact O-N 3.1Å
419	K	87.7	Confident	90.1	Very high	146 Å²	146	47.2 Å²	47.2	64%	0.635	23%	0.232	S	C	*	.	H	α-helix	trans	-66.5	-39	177.5	-60.8	175.7	-179	170.2	0	110.4	D417 F422 T423	D417-K419 VanDerWaalsContact C-N 3.33Å; D417-K419 PolarHBondContact O-N 3.34Å; D417-K419 VanDerWaalsContact OD1-CB 3.29Å; D417-K419 WeakPolarHBondContact OD1-CB 3.47Å; D417-K419 PolarHBondContact OD1-N 3.39Å; K419-F422 PolarHBondContact O-N 2.95Å; K419-T423 WeakPolarHBondContact O-CB 3.27Å; K419-T423 PolarHBondContact O-N 3.31Å; K419-T423 PolarHBondContact O-OG1 3.33Å
420	K	90.7	Very high	89.8	Confident	114 Å²	114	54.8 Å²	54.8	50%	0.496	26%	0.258	S	S	.	.	H	α-helix	trans	-66.9	-37.7	175.8	-167.8	172.8	-174.8	169.9	0	112.2	M416 D417 Q418 T423 N424	M416-K420 HydrophobicContact CE-CD 4.14Å; M416-K420 HydrophobicContact CE-CG 3.93Å; D417-K420 HydrophobicContact CB-CB 4.34Å; D417-K420 WeakPolarHBondContact O-CB 3.41Å; D417-K420 PolarHBondContact O-N 3.3Å; D417-K420 VanDerWaalsContact O-N 3.12Å; D417-K420 PolarHBondContact OD1-N 3.04Å; Q418-K420 VanDerWaalsContact C-N 3.31Å; Q418-K420 PolarHBondContact O-N 3.49Å; K420-T423 PolarHBondContact O-N 3.12Å; K420-N424 WeakPolarHBondContact O-CB 3.36Å; K420-N424 PolarHBondContact O-N 2.95Å
421	R	89	Confident	89.6	Confident	11 Å²	11	56.3 Å²	56.3	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-57.4	-50.8	172.8	-71.4	175.7	61.3	136.6	-11	111.1	E190 L412 H413 M416 D417 Q418 T423 N424 L425	E190-R421 IonicContact OE1-CZ 3.98Å; E190-R421 IonicContact OE1-NE 2.7Å; E190-R421 PolarHBondContact OE1-NE 3.1Å; E190-R421 IonicContact OE1-NH2 3.93Å; E190-R421 PolarHBondContact OE1-NH2 3.37Å; E190-R421 IonicContact OE2-NH2 2.65Å; E190-R421 PolarHBondContact OE2-NH2 3.06Å; L412-R421 HydrophobicContact CD1-CB 3.66Å; L412-R421 HydrophobicContact CD1-CG 3.76Å; H413-R421 PolarHBondContact O-NH1 3.37Å; M416-R421 HydrophobicContact CB-CG 3.56Å; M416-R421 WeakPolarHBondContact O-CD 3.22Å; D417-R421 WeakPolarHBondContact O-CG 3.43Å; D417-R421 PolarHBondContact O-N 3.38Å; Q418-R421 WeakPolarHBondContact O-CB 3.42Å; Q418-R421 PolarHBondContact O-N 2.95Å; R421-T423 PolarHBondContact O-N 3.48Å; R421-N424 PolarHBondContact O-N 3.19Å; R421-L425 PolarHBondContact O-N 3.47Å
422	F	87.3	Confident	89.3	Confident	29 Å²	29	64.6 Å²	64.6	13%	0.127	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-44.5	176.6	-63.4	-34.2	0	0	0	112.4	E190 L193 Q418 K419 N424 L425 E426	E190-F422 HydrophobicContact CG-CD1 4.48Å; E190-F422 HydrophobicContact CG-CE1 4.09Å; L193-F422 HydrophobicContact CD2-CD1 3.93Å; L193-F422 HydrophobicContact CD2-CE1 3.71Å; L193-F422 HydrophobicContact CD2-CE2 4.36Å; L193-F422 HydrophobicContact CD2-CG 4.35Å; L193-F422 HydrophobicContact CD2-CZ 3.95Å; Q418-F422 HydrophobicContact CG-CD2 4.31Å; Q418-F422 HydrophobicContact CG-CE2 3.71Å; Q418-F422 HydrophobicContact CG-CZ 3.84Å; Q418-F422 WeakPolarHBondContact O-CD2 3.34Å; Q418-F422 WeakPolarHBondContact O-CG 3.5Å; Q418-F422 PolarHBondContact O-N 3.43Å; Q418-F422 VanDerWaalsContact O-N 3.1Å; K419-F422 PolarHBondContact O-N 2.95Å; F422-N424 VanDerWaalsContact C-N 3.32Å; F422-N424 PolarHBondContact O-N 2.88Å; F422-L425 WeakPolarHBondContact O-CB 3.44Å; F422-L425 PolarHBondContact O-N 3.5Å; F422-L425 VanDerWaalsContact O-N 3.15Å; F422-E426 WeakPolarHBondContact O-CG 3.43Å; F422-E426 PolarHBondContact O-N 3.21Å
423	T	90.6	Very high	89.3	Confident	59 Å²	59	68.4 Å²	68.4	36%	0.362	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-40.6	178	-55.7	0	0	0	0	112.4	K419 K420 R421 K427	K419-T423 WeakPolarHBondContact O-CB 3.27Å; K419-T423 PolarHBondContact O-N 3.31Å; K419-T423 PolarHBondContact O-OG1 3.33Å; K420-T423 PolarHBondContact O-N 3.12Å; R421-T423 PolarHBondContact O-N 3.48Å; T423-K427 HydrophobicContact CG2-CD 4.45Å; T423-K427 VanDerWaalsContact O-CG 3.31Å; T423-K427 WeakPolarHBondContact O-CG 3.44Å; T423-K427 PolarHBondContact O-N 3.33Å
424	N	91.7	Very high	89.5	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.037	32%	0.32	C	S	.	.	H	α-helix	trans	-67.7	-38.6	177.3	-80.1	0.7	0	0	0	111.9	F410 G411 M416 K420 R421 F422 K427 F428	F410-N424 HydrophobicContact CB-CB 4.19Å; G411-N424 PolarHBondContact O-ND2 3.2Å; M416-N424 VanDerWaalsContact CE-ND2 3.31Å; M416-N424 WeakPolarHBondContact CE-ND2 3.27Å; K420-N424 WeakPolarHBondContact O-CB 3.36Å; K420-N424 PolarHBondContact O-N 2.95Å; R421-N424 PolarHBondContact O-N 3.19Å; F422-N424 VanDerWaalsContact C-N 3.32Å; F422-N424 PolarHBondContact O-N 2.88Å; N424-K427 PolarHBondContact O-N 3.16Å; N424-F428 WeakPolarHBondContact O-CB 3.47Å; N424-F428 PolarHBondContact O-N 2.88Å
425	L	88.1	Confident	90.1	Very high	24 Å²	24	65.6 Å²	65.6	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-62.6	-47	175.8	-168.3	66.4	0	0	0	111	R421 F422 K427 F428 E429 L436 L446 I448	R421-L425 PolarHBondContact O-N 3.47Å; F422-L425 WeakPolarHBondContact O-CB 3.44Å; F422-L425 PolarHBondContact O-N 3.5Å; F422-L425 VanDerWaalsContact O-N 3.15Å; L425-K427 VanDerWaalsContact C-N 3.34Å; L425-K427 PolarHBondContact O-N 3.35Å; L425-F428 WeakPolarHBondContact O-CB 3.42Å; L425-F428 PolarHBondContact O-N 3.32Å; L425-F428 VanDerWaalsContact O-N 3.15Å; L425-E429 WeakPolarHBondContact O-CG 3.41Å; L425-E429 PolarHBondContact O-N 2.98Å; L425-L436 HydrophobicContact CD1-CD2 4.05Å; L425-L446 HydrophobicContact CD1-CD1 4.34Å; L425-L446 HydrophobicContact CD1-CD2 4.1Å; L425-L446 HydrophobicContact CD2-CD2 3.97Å; L425-I448 HydrophobicContact CD1-CD1 3.92Å; L425-I448 HydrophobicContact CD1-CG1 3.68Å
426	E	88.7	Confident	90.4	Very high	116 Å²	116	59.7 Å²	59.7	54%	0.542	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-41.4	175.9	-71.8	174.1	-174.3	0	0	112.3	F422 E429 R430	F422-E426 WeakPolarHBondContact O-CG 3.43Å; F422-E426 PolarHBondContact O-N 3.21Å; E426-E429 PolarHBondContact O-N 3.5Å; E426-R430 VanDerWaalsContact O-CB 3.27Å; E426-R430 WeakPolarHBondContact O-CB 3.24Å; E426-R430 PolarHBondContact O-N 3.11Å
427	K	92.4	Very high	90.8	Very high	79 Å²	79	58.8 Å²	58.8	34%	0.343	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.4	-74.3	176.5	-178.5	-179.5	0	111.8	F410 T423 N424 L425 L431	F410-K427 HydrophobicContact CD1-CB 4.26Å; F410-K427 HydrophobicContact CD1-CD 4.3Å; F410-K427 HydrophobicContact CE1-CB 3.79Å; F410-K427 HydrophobicContact CE1-CD 3.73Å; F410-K427 HydrophobicContact CE1-CG 4.37Å; F410-K427 HydrophobicContact CE2-CB 4.12Å; F410-K427 HydrophobicContact CZ-CB 3.71Å; F410-K427 HydrophobicContact CZ-CD 4.35Å; T423-K427 HydrophobicContact CG2-CD 4.45Å; T423-K427 VanDerWaalsContact O-CG 3.31Å; T423-K427 WeakPolarHBondContact O-CG 3.44Å; T423-K427 PolarHBondContact O-N 3.33Å; N424-K427 PolarHBondContact O-N 3.16Å; L425-K427 VanDerWaalsContact C-N 3.34Å; L425-K427 PolarHBondContact O-N 3.35Å; K427-L431 WeakPolarHBondContact O-CG 3.37Å; K427-L431 PolarHBondContact O-N 3.06Å
428	F	91.8	Very high	91	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-46.1	176.4	175.4	-109.7	0	0	0	111.6	R384 F410 N424 L425 L431 S434 L436 I448 V451	R384-F428 HydrophobicContact CB-CE2 4.23Å; R384-F428 HydrophobicContact CB-CZ 3.94Å; F410-F428 HydrophobicContact CD2-CB 4.2Å; N424-F428 WeakPolarHBondContact O-CB 3.47Å; N424-F428 PolarHBondContact O-N 2.88Å; L425-F428 WeakPolarHBondContact O-CB 3.42Å; L425-F428 PolarHBondContact O-N 3.32Å; L425-F428 VanDerWaalsContact O-N 3.15Å; F428-L431 VanDerWaalsContact O-O 3.07Å; F428-S434 WeakPolarHBondContact CD2-OG 3.43Å; F428-S434 WeakPolarHBondContact CE2-O 3.13Å; F428-S434 PolarHBondContact O-OG 3.29Å; F428-L436 HydrophobicContact CD1-CB 4.11Å; F428-L436 HydrophobicContact CD1-CD2 4.08Å; F428-L436 HydrophobicContact CD2-CB 3.61Å; F428-L436 HydrophobicContact CE1-CB 4.19Å; F428-L436 HydrophobicContact CE1-CD2 4.41Å; F428-L436 HydrophobicContact CE2-CB 3.71Å; F428-L436 HydrophobicContact CG-CB 3.82Å; F428-L436 HydrophobicContact CG-CD2 4.36Å; F428-L436 HydrophobicContact CZ-CB 4.01Å; F428-I448 HydrophobicContact CD1-CD1 4.18Å; F428-I448 HydrophobicContact CD1-CG1 4.45Å; F428-I448 HydrophobicContact CD1-CG2 3.73Å; F428-I448 HydrophobicContact CE1-CB 4.24Å; F428-I448 HydrophobicContact CE1-CD1 3.86Å; F428-I448 HydrophobicContact CE1-CG1 4.32Å; F428-I448 HydrophobicContact CE1-CG2 3.39Å; F428-V451 HydrophobicContact CE1-CG2 4.18Å; F428-V451 HydrophobicContact CZ-CG2 4.38Å
429	E	88.1	Confident	91.3	Very high	75 Å²	75	54.7 Å²	54.7	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-39.6	179	-71.8	-178.8	171.7	0	0	112.7	R384 L425 E426 I448	R384-E429 PolarHBondContact NE-O 3.33Å; R384-E429 PolarHBondContact NH2-O 2.62Å; L425-E429 WeakPolarHBondContact O-CG 3.41Å; L425-E429 PolarHBondContact O-N 2.98Å; E426-E429 PolarHBondContact O-N 3.5Å; E429-I448 HydrophobicContact CG-CG2 3.96Å
430	R	90.7	Very high	90.8	Very high	168 Å²	168	49 Å²	49	63%	0.634	23%	0.226	S	C	*	.	H	α-helix	trans	-67.3	-39.8	-179.1	-174.3	175.7	66.4	-131.1	2.4	113	E426	E426-R430 VanDerWaalsContact O-CB 3.27Å; E426-R430 WeakPolarHBondContact O-CB 3.24Å; E426-R430 PolarHBondContact O-N 3.11Å
431	L	90.6	Very high	89.7	Confident	58 Å²	58	47.2 Å²	47.2	30%	0.304	22%	0.224	S	C	.	.			trans	-84.6	133.9	-177.3	-65	175	0	0	0	110.8	R384 N408 F410 K427 F428 S434	R384-L431 PolarHBondContact NE-O 3.31Å; N408-L431 HydrophobicContact CB-CD1 4.41Å; F410-L431 HydrophobicContact CE2-CD1 3.98Å; F410-L431 HydrophobicContact CZ-CD1 3.82Å; K427-L431 WeakPolarHBondContact O-CG 3.37Å; K427-L431 PolarHBondContact O-N 3.06Å; F428-L431 VanDerWaalsContact O-O 3.07Å; L431-S434 PolarHBondContact O-OG 2.76Å
432	K	88.7	Confident	88.3	Confident	176 Å²	176	46.7 Å²	46.7	77%	0.765	22%	0.222	S	C	*	.	S	Bend	trans	-74	-38	179.9	-70.1	-177	-179.9	177.1	0	113.1	G383 R384	G383-K432 CarbonylContact C-O 3.51Å; R384-K432 WeakPolarHBondContact CG-O 3.4Å; R384-K432 PolarHBondContact N-O 2.86Å
433	N	92	Very high	86.8	Confident	80 Å²	80	45.3 Å²	45.3	43%	0.428	22%	0.217	S	C	.	.	S	Bend	trans	-112.7	86.4	176	-168	29.3	0	0	0	109.1	G383 N408	G383-N433 PolarHBondContact N-OD1 2.76Å; G383-N433 PolarHBondContact O-OD1 3.03Å; N408-N433 PolarHBondContact ND2-O 3.44Å
434	S	94.6	Very high	85.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.207	C	C	.	.			trans	-138.9	154.1	-175.5	59.6	0	0	0	0	110.2	R384 T385 F428 L431	R384-S434 WeakPolarHBondContact CA-O 3.42Å; T385-S434 PolarHBondContact N-O 3.22Å; F428-S434 WeakPolarHBondContact CD2-OG 3.43Å; F428-S434 WeakPolarHBondContact CE2-O 3.13Å; F428-S434 PolarHBondContact O-OG 3.29Å; L431-S434 PolarHBondContact O-OG 2.76Å
435	V	96.6	Very high	84.1	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.2	-179.8	-177.1	0	0	0	0	109.3	L378 T385 I387 L402 V407 N408 A409 F410 V437	L378-V435 HydrophobicContact CD1-CG2 3.99Å; L378-V435 HydrophobicContact CD2-CG2 3.6Å; L378-V435 HydrophobicContact CG-CG2 4.41Å; T385-V435 VanDerWaalsContact O-CA 3.29Å; T385-V435 WeakPolarHBondContact O-CA 3.1Å; I387-V435 HydrophobicContact CD1-CG1 3.52Å; I387-V435 HydrophobicContact CG1-CG1 3.77Å; L402-V435 HydrophobicContact CD1-CG1 4.09Å; V407-V435 HydrophobicContact CG1-CB 4.19Å; V407-V435 HydrophobicContact CG1-CG2 3.51Å; N408-V435 PolarHBondContact O-N 3.47Å; A409-V435 CarbonylContact C-O 3.55Å; A409-V435 WeakPolarHBondContact CA-O 3.23Å; A409-V435 HydrophobicContact CB-CB 4.43Å; F410-V435 PolarHBondContact N-O 3.49Å; V435-V437 HydrophobicContact CG1-CG2 4.17Å
436	L	95.5	Very high	82.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.8	170.8	-173.3	64.1	0	0	0	108.4	T385 L386 I387 F410 L412 L425 F428 L446 I448	T385-L436 PolarHBondContact O-N 2.92Å; L386-L436 HydrophobicContact CD1-CB 3.78Å; L386-L436 HydrophobicContact CD1-CD2 3.79Å; L386-L436 HydrophobicContact CD1-CG 3.89Å; L386-L436 WeakPolarHBondContact CD1-O 3.25Å; I387-L436 PolarHBondContact N-O 2.9Å; F410-L436 HydrophobicContact CB-CD1 3.89Å; L412-L436 HydrophobicContact CB-CD1 4.12Å; L412-L436 HydrophobicContact CD2-CD2 4.34Å; L425-L436 HydrophobicContact CD1-CD2 4.05Å; F428-L436 HydrophobicContact CD1-CB 4.11Å; F428-L436 HydrophobicContact CD1-CD2 4.08Å; F428-L436 HydrophobicContact CD2-CB 3.61Å; F428-L436 HydrophobicContact CE1-CB 4.19Å; F428-L436 HydrophobicContact CE1-CD2 4.41Å; F428-L436 HydrophobicContact CE2-CB 3.71Å; F428-L436 HydrophobicContact CG-CB 3.82Å; F428-L436 HydrophobicContact CG-CD2 4.36Å; F428-L436 HydrophobicContact CZ-CB 4.01Å; L436-L446 HydrophobicContact CD2-CD1 4.36Å; L436-I448 HydrophobicContact CD2-CD1 3.78Å
437	V	96.8	Very high	81.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.9	174	-170.4	0	0	0	0	107.9	I387 V395 L398 L402 F410 G411 L412 V435	I387-V437 HydrophobicContact CB-CG2 4.42Å; I387-V437 CarbonylContact O-C 3.49Å; I387-V437 WeakPolarHBondContact O-CA 3.49Å; V395-V437 HydrophobicContact CB-CG1 4.29Å; V395-V437 HydrophobicContact CG1-CB 4.36Å; V395-V437 HydrophobicContact CG1-CG1 4.08Å; V395-V437 WeakPolarHBondContact CG1-O 3.41Å; V395-V437 HydrophobicContact CG2-CG1 4.32Å; L398-V437 HydrophobicContact CB-CG1 4.28Å; L398-V437 HydrophobicContact CD2-CG1 4Å; L398-V437 HydrophobicContact CG-CG1 4.35Å; L398-V437 HydrophobicContact CG-CG2 4.43Å; L402-V437 HydrophobicContact CD1-CG2 4.01Å; F410-V437 PolarHBondContact O-N 2.66Å; G411-V437 CarbonylContact C-O 3.53Å; G411-V437 WeakPolarHBondContact CA-O 3.47Å; L412-V437 PolarHBondContact N-O 3.4Å; V435-V437 HydrophobicContact CG1-CG2 4.17Å
438	A	93.9	Very high	80.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145	-171	0	0	0	0	0	113.6	L386 I387 F388 A389 L412	L386-A438 HydrophobicContact CD1-CB 4.28Å; I387-A438 PolarHBondContact O-N 3.44Å; F388-A438 WeakPolarHBondContact CA-O 3.41Å; A389-A438 PolarHBondContact N-O 3.09Å; L412-A438 HydrophobicContact CB-CB 3.99Å; L412-A438 VanDerWaalsContact O-CA 3.23Å; L412-A438 WeakPolarHBondContact O-CA 3.4Å
439	S	91	Very high	79.4	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	160.6	164.1	72.6	0	0	0	0	110.6	A389 L412 V441 A442 S443	A389-S439 WeakPolarHBondContact O-CA 3.28Å; L412-S439 PolarHBondContact O-N 3.29Å; S439-V441 VanDerWaalsContact C-N 3.32Å; S439-V441 PolarHBondContact O-N 3.5Å; S439-A442 WeakPolarHBondContact O-CB 3.25Å; S439-A442 PolarHBondContact O-N 3.24Å; S439-S443 WeakPolarHBondContact O-CB 3.31Å; S439-S443 PolarHBondContact O-N 3.21Å; S439-S443 PolarHBondContact O-OG 2.99Å
440	D	77.2	Confident	78.9	Confident	25 Å²	25	41 Å²	41	13%	0.134	19%	0.193	C	C	.	.	H	α-helix	trans	-52.4	-49.2	178.7	-80.7	-36.8	0	0	0	112.9	A442 S443 R444 V465 R469	D440-A442 PolarHBondContact O-N 2.85Å; D440-A442 VanDerWaalsContact O-N 3.16Å; D440-S443 PolarHBondContact O-N 3.01Å; D440-S443 VanDerWaalsContact O-N 3.17Å; D440-S443 PolarHBondContact O-OG 3.25Å; D440-R444 VanDerWaalsContact O-CD 3.29Å; D440-R444 WeakPolarHBondContact O-CD 3.34Å; D440-R444 WeakPolarHBondContact O-CG 3.31Å; D440-R444 PolarHBondContact O-N 3.16Å; D440-R444 VanDerWaalsContact O-N 3.14Å; D440-V465 WeakPolarHBondContact OD1-CG1 3.33Å; D440-R469 IonicContact OD1-CZ 3.5Å; D440-R469 IonicContact OD1-NE 3.91Å; D440-R469 PolarHBondContact OD1-NE 3.42Å; D440-R469 IonicContact OD1-NH2 3.16Å; D440-R469 PolarHBondContact OD1-NH2 3.08Å; D440-R469 IonicContact OD2-CZ 2.83Å; D440-R469 IonicContact OD2-NE 3.27Å; D440-R469 IonicContact OD2-NH2 3.19Å; D440-R469 PolarHBondContact OD2-NH2 3.17Å
441	V	67.6	Low	78.9	Confident	77 Å²	77	33.5 Å²	33.5	47%	0.467	17%	0.166	S	C	.	.	H	α-helix	trans	-57.7	-33.8	-179.7	-179	0	0	0	0	111.5	A414 S439	A414-V441 HydrophobicContact CB-CB 4.44Å; A414-V441 HydrophobicContact CB-CG1 4.05Å; S439-V441 VanDerWaalsContact C-N 3.32Å; S439-V441 PolarHBondContact O-N 3.5Å
442	A	59.8	Low	78.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-82.8	-27.7	-178	0	0	0	0	0	114.2	L412 S439 D440	L412-A442 HydrophobicContact CB-CB 3.98Å; L412-A442 HydrophobicContact CD2-CB 3.95Å; L412-A442 WeakPolarHBondContact CD2-O 3.37Å; L412-A442 HydrophobicContact CG-CB 3.59Å; L412-A442 WeakPolarHBondContact O-CB 3.44Å; S439-A442 WeakPolarHBondContact O-CB 3.25Å; S439-A442 PolarHBondContact O-N 3.24Å; D440-A442 PolarHBondContact O-N 2.85Å; D440-A442 VanDerWaalsContact O-N 3.16Å
443	S	56.7	Low	79.2	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-102.2	-10.7	-169.4	47.4	0	0	0	0	114.7	F388 S439 D440 L446	F388-S443 WeakPolarHBondContact CD1-OG 3.46Å; F388-S443 WeakPolarHBondContact CE1-OG 3.43Å; S439-S443 WeakPolarHBondContact O-CB 3.31Å; S439-S443 PolarHBondContact O-N 3.21Å; S439-S443 PolarHBondContact O-OG 2.99Å; D440-S443 PolarHBondContact O-N 3.01Å; D440-S443 VanDerWaalsContact O-N 3.17Å; D440-S443 PolarHBondContact O-OG 3.25Å; S443-L446 WeakPolarHBondContact O-CB 3.45Å; S443-L446 WeakPolarHBondContact O-CG 3.36Å; S443-L446 PolarHBondContact O-N 2.99Å
444	R	65.6	Low	79.4	Confident	41 Å²	41	20.7 Å²	20.7	16%	0.155	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	141	174.6	-76.6	162.6	-169.2	-156	4.6	111.5	T188 H273 D440 L446	T188-R444 HydrophobicContact CG2-CB 3.71Å; T188-R444 WeakPolarHBondContact CG2-O 3.43Å; T188-R444 PolarHBondContact OG1-O 3.17Å; H273-R444 PolarHBondContact CE1-NH1 2.85Å; D440-R444 VanDerWaalsContact O-CD 3.29Å; D440-R444 WeakPolarHBondContact O-CD 3.34Å; D440-R444 WeakPolarHBondContact O-CG 3.31Å; D440-R444 PolarHBondContact O-N 3.16Å; D440-R444 VanDerWaalsContact O-N 3.14Å; R444-L446 PolarHBondContact O-N 3.07Å
445	G	58.8	Low	79.5	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.01	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	1.2	-179.3	0	0	0	0	0	116.2	L191 Q194 E264 D447	L191-G445 WeakPolarHBondContact CB-O 3.32Å; L191-G445 WeakPolarHBondContact CD1-O 3.45Å; Q194-G445 PolarHBondContact OE1-O 3.36Å; E264-G445 WeakPolarHBondContact OE1-CA 3.36Å; G445-D447 PolarHBondContact O-N 3.42Å; G445-D447 VanDerWaalsContact O-N 3.12Å
446	L	63.5	Low	79.6	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.021	11%	0.105	C	C	.	.			trans	-67.2	110	174.7	-69.6	-176.9	0	0	0	111.3	E190 L412 L425 L436 S443 R444 I448 R472	E190-L446 HydrophobicContact CB-CD2 3.42Å; E190-L446 VanDerWaalsContact CB-CD2 3.42Å; E190-L446 HydrophobicContact CG-CD2 3.7Å; L412-L446 HydrophobicContact CD2-CD1 3.62Å; L425-L446 HydrophobicContact CD1-CD1 4.34Å; L425-L446 HydrophobicContact CD1-CD2 4.1Å; L425-L446 HydrophobicContact CD2-CD2 3.97Å; L436-L446 HydrophobicContact CD2-CD1 4.36Å; S443-L446 WeakPolarHBondContact O-CB 3.45Å; S443-L446 WeakPolarHBondContact O-CG 3.36Å; S443-L446 PolarHBondContact O-N 2.99Å; R444-L446 PolarHBondContact O-N 3.07Å; L446-I448 VanDerWaalsContact C-N 3.31Å; L446-I448 HydrophobicContact CB-CD1 4Å; L446-I448 HydrophobicContact CB-CG1 4.07Å; L446-I448 HydrophobicContact CD1-CD1 3.75Å; L446-I448 HydrophobicContact CD1-CG1 4.46Å; L446-I448 HydrophobicContact CG-CD1 4.46Å; L446-I448 PolarHBondContact O-N 3.2Å; L446-R472 VanDerWaalsContact O-CD 3.26Å; L446-R472 WeakPolarHBondContact O-CD 3.29Å; L446-R472 PolarHBondContact O-NH1 3.3Å
447	D	62.4	Low	79.7	Confident	34 Å²	34	20.9 Å²	20.9	18%	0.182	11%	0.106	C	C	.	.			trans	-85.7	77.5	158.1	-174.4	22.4	0	0	0	111	Q194 H198 G445 K449 R475	Q194-D447 HydrophobicContact CG-CB 3.93Å; Q194-D447 PolarHBondContact NE2-OD2 2.93Å; Q194-D447 VanDerWaalsContact NE2-OD2 3.13Å; H198-D447 IonicContact CE1-OD2 3.08Å; G445-D447 PolarHBondContact O-N 3.42Å; G445-D447 VanDerWaalsContact O-N 3.12Å; D447-K449 PolarHBondContact O-N 3.36Å; D447-R475 IonicContact OD1-CZ 2.89Å; D447-R475 IonicContact OD1-NH1 3.78Å; D447-R475 PolarHBondContact OD1-NH1 3.44Å
448	I	69.3	Low	79.6	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.01	11%	0.113	C	C	.	.			trans	-80.6	113.4	167.9	-56.6	151.6	0	0	0	107.8	L386 L425 F428 E429 L436 L446 V451	L386-I448 HydrophobicContact CD1-CD1 4.43Å; L386-I448 HydrophobicContact CD2-CD1 4.39Å; L425-I448 HydrophobicContact CD1-CD1 3.92Å; L425-I448 HydrophobicContact CD1-CG1 3.68Å; F428-I448 HydrophobicContact CD1-CD1 4.18Å; F428-I448 HydrophobicContact CD1-CG1 4.45Å; F428-I448 HydrophobicContact CD1-CG2 3.73Å; F428-I448 HydrophobicContact CE1-CB 4.24Å; F428-I448 HydrophobicContact CE1-CD1 3.86Å; F428-I448 HydrophobicContact CE1-CG1 4.32Å; F428-I448 HydrophobicContact CE1-CG2 3.39Å; E429-I448 HydrophobicContact CG-CG2 3.96Å; L436-I448 HydrophobicContact CD2-CD1 3.78Å; L446-I448 VanDerWaalsContact C-N 3.31Å; L446-I448 HydrophobicContact CB-CD1 4Å; L446-I448 HydrophobicContact CB-CG1 4.07Å; L446-I448 HydrophobicContact CD1-CD1 3.75Å; L446-I448 HydrophobicContact CD1-CG1 4.46Å; L446-I448 HydrophobicContact CG-CD1 4.46Å; L446-I448 PolarHBondContact O-N 3.2Å; I448-V451 HydrophobicContact CB-CG2 3.7Å; I448-V451 HydrophobicContact CG2-CG2 3.65Å
449	K	68.8	Low	79.7	Confident	114 Å²	114	22.2 Å²	22.2	50%	0.496	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	139.7	173.4	-65.3	178.7	-177.7	174.3	0	109.3	D447	D447-K449 PolarHBondContact O-N 3.36Å
450	N	77.1	Confident	79.8	Confident	74 Å²	74	22 Å²	22	40%	0.396	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	40.8	170.7	-47.6	-52.3	0	0	0	115	R384 K478	R384-N450 WeakPolarHBondContact CB-O 3.41Å; R384-N450 WeakPolarHBondContact CD-O 3.47Å; R384-N450 VanDerWaalsContact NH1-CB 3.32Å; R384-N450 PolarHBondContact NH1-O 3.17Å; N450-K478 PolarHBondContact OD1-NZ 3.47Å
451	V	89.9	Confident	80.3	Confident	9 Å²	9	26 Å²	26	6%	0.055	13%	0.127	C	C	.	.			trans	-76.8	120.4	162.6	-178	0	0	0	0	108.6	L386 F428 I448 H453 V454 T473	L386-V451 HydrophobicContact CB-CG1 3.97Å; F428-V451 HydrophobicContact CE1-CG2 4.18Å; F428-V451 HydrophobicContact CZ-CG2 4.38Å; I448-V451 HydrophobicContact CB-CG2 3.7Å; I448-V451 HydrophobicContact CG2-CG2 3.65Å; V451-H453 WeakPolarHBondContact CG1-O 3.45Å; V451-V454 HydrophobicContact CG1-CG2 4.25Å; V451-T473 WeakPolarHBondContact O-CB 3.45Å; V451-T473 PolarHBondContact O-OG1 3.49Å
452	D	92	Very high	81.1	Confident	40 Å²	40	24.7 Å²	24.7	21%	0.214	12%	0.119	C	C	.	.			trans	-84.1	-38	178	-67	-74.2	0	0	0	111.4	R384 T473 L481 K602 Y603	R384-D452 PolarHBondContact N-OD2 2.89Å; R384-D452 PolarHBondContact O-N 2.91Å; D452-T473 PolarHBondContact O-OG1 3.19Å; D452-T473 VanDerWaalsContact O-OG1 3.09Å; D452-L481 PolarHBondContact O-N 3.17Å; D452-L481 VanDerWaalsContact O-N 3.16Å; D452-K602 IonicContact OD1-NZ 2.77Å; D452-K602 PolarHBondContact OD1-NZ 3.42Å; D452-K602 VanDerWaalsContact OD1-NZ 3.16Å; D452-Y603 PolarHBondContact O-OH 3.16Å
453	H	94.9	Very high	82.4	Confident	5 Å²	5	25 Å²	25	2%	0.023	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.1	-172.6	-41.6	127.3	0	0	0	111.8	F377 Y381 R384 T385 L386 V451 L481 Y603	F377-H453 HydrophobicContact CE1-CB 3.84Å; F377-H453 AromaticContact CE1-CG 3.72Å; F377-H453 AromaticContact CE1-ND1 3.74Å; F377-H453 HydrophobicContact CZ-CB 3.99Å; F377-H453 AromaticContact CZ-CD2 3.97Å; F377-H453 AromaticContact CZ-CG 3.72Å; Y381-H453 PolarHBondContact O-CE1 3.07Å; R384-H453 PolarHBondContact O-N 2.91Å; T385-H453 WeakPolarHBondContact CA-O 3.31Å; T385-H453 HydrophobicContact CG2-CB 3.93Å; T385-H453 PolarHBondContact OG1-ND1 3.37Å; T385-H453 VanDerWaalsContact OG1-ND1 3.09Å; L386-H453 PolarHBondContact N-O 3.34Å; V451-H453 WeakPolarHBondContact CG1-O 3.45Å; H453-L481 CarbonylContact C-O 3.59Å; H453-L481 WeakPolarHBondContact CA-O 3.45Å; H453-Y603 AromaticContact CD2-CE1 3.6Å; H453-Y603 AromaticContact CD2-CZ 3.82Å; H453-Y603 PolarHBondContact CD2-OH 2.87Å; H453-Y603 AromaticContact NE2-CE1 3.48Å; H453-Y603 WeakPolarHBondContact NE2-CE1 3.38Å; H453-Y603 AromaticContact NE2-CZ 3.8Å; H453-Y603 PolarHBondContact NE2-OH 3.15Å
454	V	95.3	Very high	83.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125	167.4	169.4	0	0	0	0	108.3	L386 F388 V451 R472 T473 L481 S482 L483	L386-V454 HydrophobicContact CB-CG2 4.49Å; L386-V454 CarbonylContact O-C 3.57Å; L386-V454 VanDerWaalsContact O-CA 3.32Å; L386-V454 WeakPolarHBondContact O-CA 3.35Å; F388-V454 HydrophobicContact CD2-CG1 3.77Å; F388-V454 HydrophobicContact CE2-CG1 3.62Å; F388-V454 HydrophobicContact CE2-CG2 4.49Å; V451-V454 HydrophobicContact CG1-CG2 4.25Å; V454-R472 HydrophobicContact CG2-CB 4Å; V454-T473 HydrophobicContact CB-CG2 4.26Å; V454-T473 HydrophobicContact CG2-CG2 3.77Å; V454-L481 PolarHBondContact N-O 3.45Å; V454-S482 CarbonylContact O-C 3.52Å; V454-S482 WeakPolarHBondContact O-CA 3.33Å; V454-L483 PolarHBondContact O-N 3.5Å
455	I	97.4	Very high	84.6	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.6	173.4	-55.4	177.8	0	0	0	109	F377 T385 L386 I387 F388 Y457 L483 L485	F377-I455 HydrophobicContact CD1-CD1 3.61Å; F377-I455 HydrophobicContact CD1-CG1 4.43Å; F377-I455 HydrophobicContact CE1-CD1 4Å; F377-I455 HydrophobicContact CE1-CG1 4.41Å; F377-I455 HydrophobicContact CG-CD1 4.3Å; T385-I455 HydrophobicContact CG2-CD1 3.73Å; T385-I455 HydrophobicContact CG2-CG1 3.9Å; L386-I455 PolarHBondContact O-N 3.45Å; I387-I455 CarbonylContact C-O 3.49Å; I387-I455 VanDerWaalsContact CA-O 3.29Å; I387-I455 WeakPolarHBondContact CA-O 3.39Å; I387-I455 HydrophobicContact CD1-CD1 4.27Å; I387-I455 HydrophobicContact CG1-CB 4.12Å; I387-I455 HydrophobicContact CG1-CD1 4.29Å; I387-I455 HydrophobicContact CG2-CB 4.28Å; I387-I455 HydrophobicContact CG2-CG2 4.42Å; F388-I455 PolarHBondContact N-O 2.93Å; I455-Y457 PolarHBondContact O-N 3.33Å; I455-L483 CarbonylContact C-O 3.55Å; I455-L483 VanDerWaalsContact CA-O 3.27Å; I455-L483 WeakPolarHBondContact CA-O 3.4Å; I455-L483 HydrophobicContact CG1-CB 4.46Å; I455-L485 HydrophobicContact CG2-CD1 4.14Å; I455-L485 HydrophobicContact CG2-CG 4.16Å
456	H	97.3	Very high	86.1	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	89.7	168.2	-54.1	-106.2	0	0	0	107.7	Q458 P460 Y466 R469 S470 S482 L483 M484 L485	H456-Q458 PolarHBondContact O-N 3.33Å; H456-P460 WeakPolarHBondContact ND1-CG 3.2Å; H456-Y466 AromaticContact CE1-CD2 3.53Å; H456-Y466 AromaticContact CE1-CE2 3.87Å; H456-Y466 AromaticContact NE2-CD2 3.81Å; H456-Y466 AromaticContact NE2-CE2 3.64Å; H456-R469 WeakPolarHBondContact CE1-CB 3.31Å; H456-R469 VanDerWaalsContact ND1-CD 3.35Å; H456-R469 WeakPolarHBondContact ND1-CD 3.49Å; H456-S470 PolarHBondContact CE1-OG 2.84Å; H456-S470 PolarHBondContact NE2-OG 3.48Å; H456-S482 PolarHBondContact NE2-OG 3.45Å; H456-L483 PolarHBondContact N-O 3.24Å; H456-M484 HydrophobicContact CB-CB 4.27Å; H456-M484 HydrophobicContact CB-CG 4.09Å; H456-L485 PolarHBondContact O-N 3.03Å
457	Y	97.7	Very high	87.2	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.016	12%	0.116	C	C	.	.	S	Bend	trans	-63.4	-31.2	176.5	-173.5	-94.3	0	0	0	111.4	L367 K370 D371 V374 I387 F388 C394 R397 L398 I455 L485	L367-Y457 WeakPolarHBondContact CD1-OH 2.95Å; K370-Y457 HydrophobicContact CB-CE2 4.37Å; K370-Y457 HydrophobicContact CD-CE1 4.24Å; K370-Y457 HydrophobicContact CD-CE2 4.15Å; K370-Y457 WeakPolarHBondContact CE-O 3.26Å; K370-Y457 HydrophobicContact CG-CD2 4.37Å; K370-Y457 HydrophobicContact CG-CE2 3.73Å; K370-Y457 PolarHBondContact NZ-O 2.99Å; D371-Y457 PolarHBondContact OD1-OH 3.01Å; V374-Y457 HydrophobicContact CG2-CD2 3.6Å; V374-Y457 HydrophobicContact CG2-CE2 3.81Å; I387-Y457 HydrophobicContact CG2-CG 4.48Å; F388-Y457 WeakPolarHBondContact O-CA 3.37Å; F388-Y457 WeakPolarHBondContact O-CB 3.43Å; F388-Y457 PolarHBondContact O-N 2.7Å; C394-Y457 WeakPolarHBondContact SG-CD1 3.45Å; C394-Y457 WeakPolarHBondContact SG-CE1 3.42Å; R397-Y457 PolarHBondContact NH2-OH 3.36Å; L398-Y457 HydrophobicContact CD1-CE2 4.27Å; L398-Y457 HydrophobicContact CD2-CD1 4.27Å; L398-Y457 HydrophobicContact CD2-CD2 3.7Å; L398-Y457 HydrophobicContact CD2-CE2 4.14Å; L398-Y457 HydrophobicContact CD2-CG 3.78Å; I455-Y457 PolarHBondContact O-N 3.33Å; Y457-L485 HydrophobicContact CD2-CD1 4.01Å; Y457-L485 HydrophobicContact CE2-CD1 4.44Å
458	Q	95.8	Very high	88.1	Confident	29 Å²	29	22.1 Å²	22.1	14%	0.136	11%	0.109	C	C	.	.	S	Bend	trans	-126.6	138.3	165.4	-70.5	169.6	-61.3	0	0	108.9	F388 N390 H456 R469	F388-Q458 PolarHBondContact O-N 2.96Å; N390-Q458 HydrophobicContact CB-CB 4.16Å; N390-Q458 WeakPolarHBondContact ND2-CB 3.32Å; H456-Q458 PolarHBondContact O-N 3.33Å; Q458-R469 PolarHBondContact O-NH1 3.15Å
459	V	95.7	Very high	89	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.109	C	C	.	.			trans	-62.6	133	-177.2	177.6	0	0	0	0	110	N390 M484 V486 D490 I497	N390-V459 PolarHBondContact ND2-O 2.73Å; V459-M484 HydrophobicContact CB-SD 4.37Å; V459-M484 HydrophobicContact CG1-SD 3.86Å; V459-M484 HydrophobicContact CG2-CG 3.79Å; V459-M484 HydrophobicContact CG2-SD 3.85Å; V459-V486 HydrophobicContact CG2-CB 4.4Å; V459-V486 HydrophobicContact CG2-CG1 4.44Å; V459-V486 HydrophobicContact CG2-CG2 4Å; V459-D490 HydrophobicContact CB-CB 3.67Å; V459-D490 HydrophobicContact CG2-CB 3.48Å; V459-D490 VanDerWaalsContact CG2-CB 3.48Å; V459-D490 PolarHBondContact N-OD2 3.24Å; V459-D490 VanDerWaalsContact N-OD2 3.16Å; V459-I497 HydrophobicContact CG1-CD1 3.61Å
460	P	92.4	Very high	90	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.			trans	-56	144.4	175.5	-25.4	34.9	0	0	0	111.9	H456 V462 V465 Y466 S493 I497	H456-P460 WeakPolarHBondContact ND1-CG 3.2Å; P460-V462 VanDerWaalsContact C-N 3.33Å; P460-V462 PolarHBondContact O-N 2.99Å; P460-V465 HydrophobicContact CB-CB 4.1Å; P460-V465 HydrophobicContact CB-CG1 3.92Å; P460-Y466 HydrophobicContact CG-CD2 4.16Å; P460-Y466 HydrophobicContact CG-CG 4.5Å; P460-S493 WeakPolarHBondContact O-CB 3.27Å; P460-I497 HydrophobicContact CB-CD1 4.08Å; P460-I497 HydrophobicContact CG-CD1 4.26Å; P460-I497 WeakPolarHBondContact O-CD1 3.32Å
461	K	88.2	Confident	90.4	Very high	111 Å²	111	13.7 Å²	13.7	48%	0.483	7%	0.07	S	C	.	.	S	Bend	trans	-72.3	-28.7	-179	-61.7	-57.2	-175	-172.1	0	113.2
462	V	84.9	Confident	90.2	Very high	48 Å²	48	13.6 Å²	13.6	29%	0.291	7%	0.069	S	C	.	.	S	Bend	trans	-133.6	155.2	-179.4	-59.8	0	0	0	0	111.1	P460 E464 V465 Y466	P460-V462 VanDerWaalsContact C-N 3.33Å; P460-V462 PolarHBondContact O-N 2.99Å; V462-E464 VanDerWaalsContact C-N 3.34Å; V462-E464 PolarHBondContact O-N 3.17Å; V462-V465 HydrophobicContact CG2-CB 3.97Å; V462-V465 HydrophobicContact CG2-CG2 3.45Å; V462-V465 VanDerWaalsContact CG2-CG2 3.45Å; V462-V465 PolarHBondContact O-N 3.28Å; V462-Y466 PolarHBondContact O-N 3.34Å
463	S	85.9	Confident	90.1	Very high	6 Å²	6	11.9 Å²	11.9	4%	0.042	6%	0.06	C	C	.	.	H	α-helix	trans	-66	-35	-172.2	-57.5	0	0	0	0	113	V465 Y466 V467 T500	S463-V465 PolarHBondContact O-N 2.58Å; S463-Y466 WeakPolarHBondContact O-CA 3.21Å; S463-Y466 VanDerWaalsContact O-CB 3.28Å; S463-Y466 WeakPolarHBondContact O-CB 3.46Å; S463-Y466 PolarHBondContact O-N 3.06Å; S463-Y466 VanDerWaalsContact O-N 3.08Å; S463-V467 PolarHBondContact O-N 3.49Å; S463-T500 WeakPolarHBondContact OG-CB 3.16Å; S463-T500 PolarHBondContact OG-OG1 3.3Å; S463-T500 VanDerWaalsContact OG-OG1 3.08Å
464	E	82.7	Confident	89.6	Confident	4 Å²	4	12 Å²	12	2%	0.019	6%	0.062	C	C	.	.	H	α-helix	trans	-67.8	-40.8	-178.1	-59.9	79.2	178.4	0	0	109.4	T304 F307 H309 V462 Y466 V467 H468	T304-E464 HydrophobicContact CG2-CB 4.02Å; T304-E464 HydrophobicContact CG2-CG 4.2Å; F307-E464 HydrophobicContact CB-CG 3.52Å; F307-E464 WeakPolarHBondContact CB-OE1 3.14Å; F307-E464 HydrophobicContact CD1-CG 4.24Å; F307-E464 HydrophobicContact CG-CG 4Å; H309-E464 IonicContact CE1-OE1 3.14Å; H309-E464 PolarHBondContact CE1-OE1 3.28Å; H309-E464 IonicContact CE1-OE2 3.55Å; H309-E464 PolarHBondContact CE1-OE2 3Å; H309-E464 IonicContact CG-OE1 2.76Å; H309-E464 VanDerWaalsContact ND1-CD 3.33Å; H309-E464 IonicContact ND1-OE1 2.76Å; H309-E464 PolarHBondContact ND1-OE1 3.02Å; H309-E464 IonicContact ND1-OE2 3.77Å; H309-E464 PolarHBondContact ND1-OE2 3.34Å; H309-E464 VanDerWaalsContact ND1-OE2 3.15Å; H309-E464 IonicContact NE2-OE1 3.28Å; V462-E464 VanDerWaalsContact C-N 3.34Å; V462-E464 PolarHBondContact O-N 3.17Å; E464-Y466 VanDerWaalsContact C-N 3.29Å; E464-Y466 PolarHBondContact O-N 3.45Å; E464-V467 WeakPolarHBondContact O-CB 3.29Å; E464-V467 PolarHBondContact O-N 3.45Å; E464-V467 VanDerWaalsContact O-N 3.16Å; E464-H468 VanDerWaalsContact C-CD2 3.5Å; E464-H468 PolarHBondContact O-CD2 3.05Å; E464-H468 PolarHBondContact O-N 2.84Å
465	V	86	Confident	88.9	Confident	9 Å²	9	13.6 Å²	13.6	6%	0.055	7%	0.068	C	C	.	.	H	α-helix	trans	-60.4	-40.9	171.4	175.6	0	0	0	0	110.4	D440 P460 V462 S463 V467 H468 R469	D440-V465 WeakPolarHBondContact OD1-CG1 3.33Å; P460-V465 HydrophobicContact CB-CB 4.1Å; P460-V465 HydrophobicContact CB-CG1 3.92Å; V462-V465 HydrophobicContact CG2-CB 3.97Å; V462-V465 HydrophobicContact CG2-CG2 3.45Å; V462-V465 VanDerWaalsContact CG2-CG2 3.45Å; V462-V465 PolarHBondContact O-N 3.28Å; S463-V465 PolarHBondContact O-N 2.58Å; V465-V467 PolarHBondContact O-N 2.72Å; V465-H468 PolarHBondContact O-N 3.05Å; V465-R469 HydrophobicContact CG1-CG 4.06Å; V465-R469 WeakPolarHBondContact O-CB 3.32Å; V465-R469 WeakPolarHBondContact O-CG 3.05Å; V465-R469 PolarHBondContact O-N 2.65Å
466	Y	89.9	Confident	87.7	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.4	-44.3	174.5	175	-86.5	0	0	0	112.4	L353 T359 H456 P460 V462 S463 E464 R469 S470 M484 I497 I501 F507	L353-Y466 HydrophobicContact CD1-CE1 4.04Å; L353-Y466 HydrophobicContact CD2-CD1 4.35Å; L353-Y466 HydrophobicContact CD2-CE1 4Å; T359-Y466 WeakPolarHBondContact CG2-OH 3.38Å; H456-Y466 AromaticContact CE1-CD2 3.53Å; H456-Y466 AromaticContact CE1-CE2 3.87Å; H456-Y466 AromaticContact NE2-CD2 3.81Å; H456-Y466 AromaticContact NE2-CE2 3.64Å; P460-Y466 HydrophobicContact CG-CD2 4.16Å; P460-Y466 HydrophobicContact CG-CG 4.5Å; V462-Y466 PolarHBondContact O-N 3.34Å; S463-Y466 WeakPolarHBondContact O-CA 3.21Å; S463-Y466 VanDerWaalsContact O-CB 3.28Å; S463-Y466 WeakPolarHBondContact O-CB 3.46Å; S463-Y466 PolarHBondContact O-N 3.06Å; S463-Y466 VanDerWaalsContact O-N 3.08Å; E464-Y466 VanDerWaalsContact C-N 3.29Å; E464-Y466 PolarHBondContact O-N 3.45Å; Y466-R469 PolarHBondContact O-N 3.49Å; Y466-S470 VanDerWaalsContact O-CB 3.28Å; Y466-S470 WeakPolarHBondContact O-CB 3.45Å; Y466-S470 PolarHBondContact O-N 3.45Å; Y466-S470 PolarHBondContact O-OG 2.62Å; Y466-M484 HydrophobicContact CD2-SD 4.29Å; Y466-M484 HydrophobicContact CE2-CE 4.29Å; Y466-M484 HydrophobicContact CE2-SD 4.16Å; Y466-I497 HydrophobicContact CD1-CG2 4.14Å; Y466-I497 HydrophobicContact CD2-CD1 4.42Å; Y466-I497 HydrophobicContact CD2-CG2 4.14Å; Y466-I497 HydrophobicContact CG-CD1 4.5Å; Y466-I497 HydrophobicContact CG-CG2 3.89Å; Y466-I501 HydrophobicContact CD1-CD1 3.24Å; Y466-I501 HydrophobicContact CE1-CD1 3.89Å; Y466-I501 HydrophobicContact CE1-CG2 4.21Å; Y466-I501 HydrophobicContact CG-CD1 4.05Å; Y466-F507 HydrophobicContact CE1-CE1 4.5Å; Y466-F507 HydrophobicContact CE1-CZ 4.22Å; Y466-F507 AromaticContact CZ-CZ 3.91Å; Y466-F507 WeakPolarHBondContact OH-CE1 3.45Å
467	V	86.8	Confident	86.6	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-49.2	176.3	171.9	0	0	0	0	110.4	T304 F307 G352 L353 S463 E464 V465 R469 S470 G471 I501	T304-V467 HydrophobicContact CG2-CB 4.27Å; T304-V467 HydrophobicContact CG2-CG1 4.12Å; F307-V467 HydrophobicContact CE1-CG2 4.09Å; F307-V467 HydrophobicContact CZ-CG2 3.92Å; G352-V467 WeakPolarHBondContact O-CG1 3.26Å; L353-V467 HydrophobicContact CD2-CB 4.47Å; L353-V467 HydrophobicContact CD2-CG2 4.22Å; S463-V467 PolarHBondContact O-N 3.49Å; E464-V467 WeakPolarHBondContact O-CB 3.29Å; E464-V467 PolarHBondContact O-N 3.45Å; E464-V467 VanDerWaalsContact O-N 3.16Å; V465-V467 PolarHBondContact O-N 2.72Å; V467-R469 PolarHBondContact O-N 2.9Å; V467-S470 PolarHBondContact O-N 3.19Å; V467-G471 PolarHBondContact O-N 2.95Å; V467-I501 HydrophobicContact CG2-CD1 3.76Å
468	H	82	Confident	85.9	Confident	8 Å²	8	29.9 Å²	29.9	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-65.3	-36.6	-179.5	-62.2	-66	0	0	0	113.5	D266 R267 E464 V465 R472	D266-H468 IonicContact OD2-CE1 2.73Å; D266-H468 IonicContact OD2-NE2 3.37Å; R267-H468 PolarHBondContact NE-CD2 3.12Å; R267-H468 PolarHBondContact NE-NE2 3Å; R267-H468 PolarHBondContact NH2-CD2 3.32Å; R267-H468 PolarHBondContact NH2-NE2 3.29Å; E464-H468 VanDerWaalsContact C-CD2 3.5Å; E464-H468 PolarHBondContact O-CD2 3.05Å; E464-H468 PolarHBondContact O-N 2.84Å; V465-H468 PolarHBondContact O-N 3.05Å; H468-R472 PolarHBondContact O-NE 3.43Å; H468-R472 PolarHBondContact O-NH2 3.35Å
469	R	89.2	Confident	85.5	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-69.4	-51.2	177.1	-73.8	-172.8	-177.1	-176.8	4.8	111.4	F388 N390 D440 H456 Q458 V465 Y466 V467 G471 R472	F388-R469 HydrophobicContact CB-CG 4.44Å; F388-R469 HydrophobicContact CD1-CB 4.33Å; F388-R469 HydrophobicContact CD1-CG 3.55Å; F388-R469 HydrophobicContact CD2-CB 3.89Å; F388-R469 HydrophobicContact CD2-CG 3.96Å; F388-R469 HydrophobicContact CE1-CB 4.04Å; F388-R469 HydrophobicContact CE1-CG 3.48Å; F388-R469 VanDerWaalsContact CE1-CG 3.48Å; F388-R469 HydrophobicContact CE2-CB 3.65Å; F388-R469 HydrophobicContact CE2-CG 3.96Å; F388-R469 WeakPolarHBondContact CE2-O 3.39Å; F388-R469 HydrophobicContact CG-CB 4.22Å; F388-R469 VanDerWaalsContact CG-CD 3.5Å; F388-R469 HydrophobicContact CG-CG 3.75Å; F388-R469 HydrophobicContact CZ-CB 3.72Å; F388-R469 HydrophobicContact CZ-CG 3.72Å; N390-R469 PolarHBondContact OD1-NH2 3.49Å; D440-R469 IonicContact OD1-CZ 3.5Å; D440-R469 IonicContact OD1-NE 3.91Å; D440-R469 PolarHBondContact OD1-NE 3.42Å; D440-R469 IonicContact OD1-NH2 3.16Å; D440-R469 PolarHBondContact OD1-NH2 3.08Å; D440-R469 IonicContact OD2-CZ 2.83Å; D440-R469 IonicContact OD2-NE 3.27Å; D440-R469 IonicContact OD2-NH2 3.19Å; D440-R469 PolarHBondContact OD2-NH2 3.17Å; H456-R469 WeakPolarHBondContact CE1-CB 3.31Å; H456-R469 VanDerWaalsContact ND1-CD 3.35Å; H456-R469 WeakPolarHBondContact ND1-CD 3.49Å; Q458-R469 PolarHBondContact O-NH1 3.15Å; V465-R469 HydrophobicContact CG1-CG 4.06Å; V465-R469 WeakPolarHBondContact O-CB 3.32Å; V465-R469 WeakPolarHBondContact O-CG 3.05Å; V465-R469 PolarHBondContact O-N 2.65Å; Y466-R469 PolarHBondContact O-N 3.49Å; V467-R469 PolarHBondContact O-N 2.9Å; R469-G471 VanDerWaalsContact C-N 3.26Å; R469-G471 PolarHBondContact O-N 3.42Å; R469-R472 WeakPolarHBondContact O-CB 3.27Å; R469-R472 VanDerWaalsContact O-CG 3.32Å; R469-R472 WeakPolarHBondContact O-CG 3.32Å; R469-R472 PolarHBondContact O-N 2.88Å; R469-R472 VanDerWaalsContact O-N 3.14Å
470	S	89.3	Confident	85.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-33.8	-179.7	-60.6	0	0	0	0	111.8	H456 Y466 V467 R472 T473 S482	H456-S470 PolarHBondContact CE1-OG 2.84Å; H456-S470 PolarHBondContact NE2-OG 3.48Å; Y466-S470 VanDerWaalsContact O-CB 3.28Å; Y466-S470 WeakPolarHBondContact O-CB 3.45Å; Y466-S470 PolarHBondContact O-N 3.45Å; Y466-S470 PolarHBondContact O-OG 2.62Å; V467-S470 PolarHBondContact O-N 3.19Å; S470-R472 PolarHBondContact O-N 3.39Å; S470-T473 PolarHBondContact O-N 3.13Å; S470-S482 PolarHBondContact OG-OG 2.95Å
471	G	84.9	Confident	85.3	Confident	8 Å²	8	33.6 Å²	33.6	8%	0.082	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	5.3	174	0	0	0	0	0	116	T154 V467 R469 T473 R475	T154-G471 WeakPolarHBondContact OG1-CA 3.14Å; T154-G471 PolarHBondContact OG1-O 3.03Å; V467-G471 PolarHBondContact O-N 2.95Å; R469-G471 VanDerWaalsContact C-N 3.26Å; R469-G471 PolarHBondContact O-N 3.42Å; G471-T473 VanDerWaalsContact C-N 3.34Å; G471-R475 PolarHBondContact O-NE 3.3Å; G471-R475 PolarHBondContact O-NH2 2.89Å; G471-R475 VanDerWaalsContact O-NH2 3.14Å
472	R	86.5	Confident	85.6	Confident	8 Å²	8	28.3 Å²	28.3	3%	0.03	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-20.4	168.5	-59.7	-56.3	128	172.2	5.8	112.8	E264 L386 F388 L446 V454 H468 R469 S470	E264-R472 IonicContact OE1-NH2 2.86Å; L386-R472 HydrophobicContact CD2-CB 3.63Å; L386-R472 HydrophobicContact CD2-CG 3.62Å; F388-R472 HydrophobicContact CE2-CG 4.33Å; F388-R472 HydrophobicContact CZ-CG 3.76Å; L446-R472 VanDerWaalsContact O-CD 3.26Å; L446-R472 WeakPolarHBondContact O-CD 3.29Å; L446-R472 PolarHBondContact O-NH1 3.3Å; V454-R472 HydrophobicContact CG2-CB 4Å; H468-R472 PolarHBondContact O-NE 3.43Å; H468-R472 PolarHBondContact O-NH2 3.35Å; R469-R472 WeakPolarHBondContact O-CB 3.27Å; R469-R472 VanDerWaalsContact O-CG 3.32Å; R469-R472 WeakPolarHBondContact O-CG 3.32Å; R469-R472 PolarHBondContact O-N 2.88Å; R469-R472 VanDerWaalsContact O-N 3.14Å; S470-R472 PolarHBondContact O-N 3.39Å
473	T	88.9	Confident	86.2	Confident	4 Å²	4	26.1 Å²	26.1	3%	0.025	14%	0.136	C	C	.	.	S	Bend	trans	-109.3	-178.7	168.7	-169.7	0	0	0	0	110.8	L357 V451 D452 V454 S470 G471 R475 G480	L357-T473 HydrophobicContact CD1-CG2 3.42Å; L357-T473 VanDerWaalsContact CD1-CG2 3.42Å; V451-T473 WeakPolarHBondContact O-CB 3.45Å; V451-T473 PolarHBondContact O-OG1 3.49Å; D452-T473 PolarHBondContact O-OG1 3.19Å; D452-T473 VanDerWaalsContact O-OG1 3.09Å; V454-T473 HydrophobicContact CB-CG2 4.26Å; V454-T473 HydrophobicContact CG2-CG2 3.77Å; S470-T473 PolarHBondContact O-N 3.13Å; G471-T473 VanDerWaalsContact C-N 3.34Å; T473-R475 VanDerWaalsContact C-N 3.29Å; T473-R475 PolarHBondContact O-N 3.38Å; T473-G480 WeakPolarHBondContact OG1-CA 3.39Å
474	A	84.9	Confident	86.7	Confident	7 Å²	7	25.9 Å²	25.9	6%	0.058	13%	0.134	C	C	.	.	S	Bend	trans	58.4	32.7	-178.8	0	0	0	0	0	115.1	A354 L357 K478	A354-A474 HydrophobicContact CB-CB 4.3Å; L357-A474 HydrophobicContact CB-CB 3.83Å; L357-A474 HydrophobicContact CD1-CB 3.81Å; L357-A474 HydrophobicContact CG-CB 4.46Å; A474-K478 CarbonylContact C-O 3.24Å; A474-K478 VanDerWaalsContact CA-O 3.22Å; A474-K478 WeakPolarHBondContact CA-O 3.43Å
475	R	80.6	Confident	87.4	Confident	33 Å²	33	25.7 Å²	25.7	13%	0.125	13%	0.133	C	C	.	.			trans	-83	151.5	179.1	-64.3	-175	175.2	-155.6	-0.8	112.1	D447 G471 T473 S477 K478	D447-R475 IonicContact OD1-CZ 2.89Å; D447-R475 IonicContact OD1-NH1 3.78Å; D447-R475 PolarHBondContact OD1-NH1 3.44Å; G471-R475 PolarHBondContact O-NE 3.3Å; G471-R475 PolarHBondContact O-NH2 2.89Å; G471-R475 VanDerWaalsContact O-NH2 3.14Å; T473-R475 VanDerWaalsContact C-N 3.29Å; T473-R475 PolarHBondContact O-N 3.38Å; R475-S477 VanDerWaalsContact C-N 3.32Å; R475-S477 PolarHBondContact O-N 3.25Å; R475-K478 VanDerWaalsContact O-CB 3.31Å; R475-K478 WeakPolarHBondContact O-CB 3.39Å; R475-K478 PolarHBondContact O-N 3.24Å
476	Q	72.8	Confident	87.9	Confident	134 Å²	134	25.3 Å²	25.3	63%	0.626	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	47.3	174.8	-60	177	-14.5	0	0	112.8	K478	Q476-K478 PolarHBondContact O-N 2.67Å
477	S	73.8	Confident	88	Confident	110 Å²	110	26.5 Å²	26.5	77%	0.769	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	7.6	-179.5	-47.5	0	0	0	0	115.5	R475	R475-S477 VanDerWaalsContact C-N 3.32Å; R475-S477 PolarHBondContact O-N 3.25Å
478	K	81.9	Confident	88.3	Confident	103 Å²	103	34.7 Å²	34.7	45%	0.448	17%	0.173	S	C	.	.			trans	-71.9	151.2	170.1	-64	-173.8	-179.7	-174.6	0	110	T356 N450 A474 R475 Q476	T356-K478 WeakPolarHBondContact CB-O 3.31Å; T356-K478 PolarHBondContact OG1-O 3.31Å; N450-K478 PolarHBondContact OD1-NZ 3.47Å; A474-K478 CarbonylContact C-O 3.24Å; A474-K478 VanDerWaalsContact CA-O 3.22Å; A474-K478 WeakPolarHBondContact CA-O 3.43Å; R475-K478 VanDerWaalsContact O-CB 3.31Å; R475-K478 WeakPolarHBondContact O-CB 3.39Å; R475-K478 PolarHBondContact O-N 3.24Å; Q476-K478 PolarHBondContact O-N 2.67Å
479	Q	87.3	Confident	88.7	Confident	106 Å²	106	40.8 Å²	40.8	50%	0.495	20%	0.201	S	C	.	.			trans	-76	140.4	170.3	-61.8	-64.3	-42.3	0	0	109.6	T356	T356-Q479 PolarHBondContact O-OE1 3.13Å; T356-Q479 VanDerWaalsContact O-OE1 3.12Å
480	G	90.4	Very high	88.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	153	176.5	0	0	0	0	0	111.5	T356 T358 T473	T356-G480 PolarHBondContact O-N 3.49Å; T358-G480 PolarHBondContact N-O 3.47Å; T473-G480 WeakPolarHBondContact OG1-CA 3.39Å
481	L	93.9	Very high	89	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.9	177.3	177.4	65.2	0	0	0	110.6	T358 F377 D452 H453 V454 F510 Y603	T358-L481 HydrophobicContact CG2-CD1 3.71Å; T358-L481 WeakPolarHBondContact O-CA 3.25Å; F377-L481 HydrophobicContact CE2-CD2 3.56Å; F377-L481 HydrophobicContact CZ-CD2 3.72Å; D452-L481 PolarHBondContact O-N 3.17Å; D452-L481 VanDerWaalsContact O-N 3.16Å; H453-L481 CarbonylContact C-O 3.59Å; H453-L481 WeakPolarHBondContact CA-O 3.45Å; V454-L481 PolarHBondContact N-O 3.45Å; L481-F510 HydrophobicContact CD2-CD2 4.38Å; L481-F510 HydrophobicContact CD2-CE2 3.73Å; L481-Y603 HydrophobicContact CB-CD1 4.25Å; L481-Y603 HydrophobicContact CB-CE1 3.74Å; L481-Y603 HydrophobicContact CB-CE2 4.31Å; L481-Y603 HydrophobicContact CD2-CD1 3.66Å; L481-Y603 HydrophobicContact CD2-CE1 3.7Å; L481-Y603 HydrophobicContact CG-CD1 4.49Å; L481-Y603 HydrophobicContact CG-CE1 4.36Å
482	S	94.8	Very high	89.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.4	168.5	-176.4	0	0	0	0	109.2	T358 T359 S360 V454 H456 S470	T358-S482 PolarHBondContact O-N 3.03Å; T359-S482 WeakPolarHBondContact CA-O 3.32Å; S360-S482 PolarHBondContact N-O 3.31Å; V454-S482 CarbonylContact O-C 3.52Å; V454-S482 WeakPolarHBondContact O-CA 3.33Å; H456-S482 PolarHBondContact NE2-OG 3.45Å; S470-S482 PolarHBondContact OG-OG 2.95Å
483	L	96.8	Very high	89.6	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.7	179.6	175.6	61.1	0	0	0	109.9	S360 L362 F377 V454 I455 H456 L485 F510	S360-L483 WeakPolarHBondContact O-CA 3.46Å; S360-L483 WeakPolarHBondContact OG-CD1 3.1Å; L362-L483 HydrophobicContact CD1-CD1 4.05Å; L362-L483 HydrophobicContact CD1-CD2 4.21Å; L362-L483 HydrophobicContact CG-CD1 4.05Å; F377-L483 HydrophobicContact CD2-CD2 3.72Å; F377-L483 HydrophobicContact CE2-CD2 4.13Å; F377-L483 HydrophobicContact CG-CD2 4.1Å; V454-L483 PolarHBondContact O-N 3.5Å; I455-L483 CarbonylContact C-O 3.55Å; I455-L483 VanDerWaalsContact CA-O 3.27Å; I455-L483 WeakPolarHBondContact CA-O 3.4Å; I455-L483 HydrophobicContact CG1-CB 4.46Å; H456-L483 PolarHBondContact N-O 3.24Å; L483-L485 HydrophobicContact CD2-CD2 4.42Å; L483-L485 HydrophobicContact CG-CD2 4.3Å; L483-F510 HydrophobicContact CD1-CB 3.65Å; L483-F510 HydrophobicContact CD1-CD2 4.2Å; L483-F510 HydrophobicContact CD1-CG 3.94Å
484	M	96.9	Very high	89.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.4	179.7	-178.2	167.5	47.8	0	0	112.1	S360 C361 L362 H456 V459 Y466 V486 Y494 F507	S360-M484 PolarHBondContact O-N 3.48Å; C361-M484 CarbonylContact C-O 3.51Å; C361-M484 WeakPolarHBondContact CA-O 3.2Å; C361-M484 HydrophobicContact CB-CB 4.33Å; C361-M484 HydrophobicContact CB-CE 4.49Å; C361-M484 WeakPolarHBondContact CB-O 2.94Å; L362-M484 PolarHBondContact N-O 3.17Å; H456-M484 HydrophobicContact CB-CB 4.27Å; H456-M484 HydrophobicContact CB-CG 4.09Å; V459-M484 HydrophobicContact CB-SD 4.37Å; V459-M484 HydrophobicContact CG1-SD 3.86Å; V459-M484 HydrophobicContact CG2-CG 3.79Å; V459-M484 HydrophobicContact CG2-SD 3.85Å; Y466-M484 HydrophobicContact CD2-SD 4.29Å; Y466-M484 HydrophobicContact CE2-CE 4.29Å; Y466-M484 HydrophobicContact CE2-SD 4.16Å; M484-V486 HydrophobicContact CG-CG2 4.01Å; M484-Y494 HydrophobicContact CE-CD2 3.32Å; M484-Y494 HydrophobicContact CE-CE2 3.4Å; M484-Y494 HydrophobicContact SD-CD2 4.04Å; M484-F507 HydrophobicContact CE-CD2 3.64Å; M484-F507 HydrophobicContact CE-CE2 3.69Å; M484-F507 HydrophobicContact CE-CG 4.43Å
485	L	97.6	Very high	90.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	113.1	176.9	-55.4	-175.7	0	0	0	110	L362 K370 V374 I455 H456 Y457 L483	L362-L485 HydrophobicContact CB-CD2 3.81Å; L362-L485 HydrophobicContact CD1-CD2 3.87Å; L362-L485 HydrophobicContact CG-CD2 4.39Å; K370-L485 HydrophobicContact CD-CB 4.47Å; K370-L485 WeakPolarHBondContact CE-O 3.32Å; K370-L485 HydrophobicContact CG-CB 4.11Å; K370-L485 HydrophobicContact CG-CD1 3.82Å; V374-L485 HydrophobicContact CG2-CD1 3.45Å; V374-L485 VanDerWaalsContact CG2-CD1 3.45Å; I455-L485 HydrophobicContact CG2-CD1 4.14Å; I455-L485 HydrophobicContact CG2-CG 4.16Å; H456-L485 PolarHBondContact O-N 3.03Å; Y457-L485 HydrophobicContact CD2-CD1 4.01Å; Y457-L485 HydrophobicContact CE2-CD1 4.44Å; L483-L485 HydrophobicContact CD2-CD2 4.42Å; L483-L485 HydrophobicContact CG-CD2 4.3Å
486	V	96.4	Very high	90.5	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.4	-172.8	-171.9	0	0	0	0	109.6	C361 L362 F363 C364 V459 M484 D490 Y494	C361-V486 HydrophobicContact CB-CG2 4.45Å; L362-V486 PolarHBondContact O-N 3.39Å; F363-V486 CarbonylContact C-O 3.56Å; F363-V486 WeakPolarHBondContact CA-O 3.22Å; F363-V486 HydrophobicContact CD1-CB 3.82Å; F363-V486 HydrophobicContact CD1-CG1 3.98Å; F363-V486 HydrophobicContact CE1-CB 4.03Å; F363-V486 HydrophobicContact CE1-CG1 3.94Å; F363-V486 HydrophobicContact CE1-CG2 4.4Å; C364-V486 PolarHBondContact N-O 3.39Å; V459-V486 HydrophobicContact CG2-CB 4.4Å; V459-V486 HydrophobicContact CG2-CG1 4.44Å; V459-V486 HydrophobicContact CG2-CG2 4Å; M484-V486 HydrophobicContact CG-CG2 4.01Å; V486-D490 HydrophobicContact CG1-CB 4.29Å; V486-Y494 HydrophobicContact CG1-CD1 4.35Å; V486-Y494 HydrophobicContact CG1-CD2 4.32Å; V486-Y494 HydrophobicContact CG1-CG 3.95Å; V486-Y494 HydrophobicContact CG2-CD2 3.5Å; V486-Y494 VanDerWaalsContact CG2-CD2 3.5Å; V486-Y494 HydrophobicContact CG2-CE2 3.88Å; V486-Y494 HydrophobicContact CG2-CG 4Å
487	D	93.1	Very high	91.4	Very high	24 Å²	24	48.2 Å²	48.2	13%	0.128	23%	0.233	C	C	.	.			trans	-102.1	-176	172.1	64.1	26.4	0	0	0	111.5	K370 Q489 D490 V491	K370-D487 IonicContact NZ-OD2 3.94Å; K370-D487 PolarHBondContact NZ-OD2 3.27Å; D487-Q489 VanDerWaalsContact C-N 3.31Å; D487-Q489 VanDerWaalsContact CG-CG 3.45Å; D487-Q489 PolarHBondContact O-N 3.15Å; D487-Q489 WeakPolarHBondContact OD1-CG 3.41Å; D487-Q489 PolarHBondContact OD1-N 3.25Å; D487-Q489 VanDerWaalsContact OD1-N 3.09Å; D487-Q489 PolarHBondContact OD2-NE2 3.43Å; D487-D490 PolarHBondContact O-N 3.34Å; D487-D490 VanDerWaalsContact OD1-CB 3.26Å; D487-D490 WeakPolarHBondContact OD1-CB 3.36Å; D487-D490 PolarHBondContact OD1-N 3Å; D487-V491 WeakPolarHBondContact O-CG2 3.36Å; D487-V491 PolarHBondContact O-N 3.1Å
488	K	91.4	Very high	92.2	Very high	173 Å²	173	43 Å²	43	75%	0.752	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.6	-178.4	-65.3	176.9	-177	169.1	0	113.8
489	Q	91	Very high	92.4	Very high	136 Å²	136	44.8 Å²	44.8	64%	0.636	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-24.8	-179.4	54.6	179.9	-0.9	0	0	111.7	D487	D487-Q489 VanDerWaalsContact C-N 3.31Å; D487-Q489 VanDerWaalsContact CG-CG 3.45Å; D487-Q489 PolarHBondContact O-N 3.15Å; D487-Q489 WeakPolarHBondContact OD1-CG 3.41Å; D487-Q489 PolarHBondContact OD1-N 3.25Å; D487-Q489 VanDerWaalsContact OD1-N 3.09Å; D487-Q489 PolarHBondContact OD2-NE2 3.43Å
490	D	93.2	Very high	92.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-14	-175.3	-75.6	-21.7	0	0	0	114.1	K370 V459 V486 D487 L492 S493 Y494	K370-D490 IonicContact NZ-OD2 3.08Å; K370-D490 PolarHBondContact NZ-OD2 3.47Å; V459-D490 HydrophobicContact CB-CB 3.67Å; V459-D490 HydrophobicContact CG2-CB 3.48Å; V459-D490 VanDerWaalsContact CG2-CB 3.48Å; V459-D490 PolarHBondContact N-OD2 3.24Å; V459-D490 VanDerWaalsContact N-OD2 3.16Å; V486-D490 HydrophobicContact CG1-CB 4.29Å; D487-D490 PolarHBondContact O-N 3.34Å; D487-D490 VanDerWaalsContact OD1-CB 3.26Å; D487-D490 WeakPolarHBondContact OD1-CB 3.36Å; D487-D490 PolarHBondContact OD1-N 3Å; D490-L492 VanDerWaalsContact C-N 3.29Å; D490-L492 PolarHBondContact O-N 2.84Å; D490-L492 VanDerWaalsContact O-N 3.12Å; D490-S493 PolarHBondContact O-N 3.4Å; D490-Y494 WeakPolarHBondContact O-CB 3.49Å; D490-Y494 PolarHBondContact O-N 3.15Å
491	V	92	Very high	92	Very high	39 Å²	39	42.5 Å²	42.5	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-52.1	-40.6	-172.8	178.2	0	0	0	0	113.8	D487 R495 A620	D487-V491 WeakPolarHBondContact O-CG2 3.36Å; D487-V491 PolarHBondContact O-N 3.1Å; V491-R495 VanDerWaalsContact O-CG 3.31Å; V491-R495 WeakPolarHBondContact O-CG 3.5Å; V491-R495 PolarHBondContact O-N 2.84Å; V491-A620 HydrophobicContact CG1-CB 4.34Å
492	L	90.9	Very high	91.7	Very high	112 Å²	112	44.2 Å²	44.2	59%	0.586	20%	0.202	S	C	*	.	H	α-helix	trans	-69.1	-43.5	-179.2	-69.9	179.5	0	0	0	112.2	D490 R496	D490-L492 VanDerWaalsContact C-N 3.29Å; D490-L492 PolarHBondContact O-N 2.84Å; D490-L492 VanDerWaalsContact O-N 3.12Å; L492-R496 WeakPolarHBondContact O-CG 3.32Å; L492-R496 PolarHBondContact O-N 3Å
493	S	92.2	Very high	91.2	Very high	11 Å²	11	50.4 Å²	50.4	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-43.7	176.5	-71.7	0	0	0	0	110.8	P460 D490 R495 R496 I497	P460-S493 WeakPolarHBondContact O-CB 3.27Å; D490-S493 PolarHBondContact O-N 3.4Å; S493-R495 PolarHBondContact O-N 3.23Å; S493-R496 WeakPolarHBondContact O-CB 3.3Å; S493-R496 PolarHBondContact O-N 2.96Å; S493-R496 VanDerWaalsContact O-N 3.11Å; S493-I497 WeakPolarHBondContact O-CG1 3.49Å; S493-I497 PolarHBondContact O-N 3.05Å
494	Y	94.8	Very high	90.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-54.7	-49.9	175	171	-102.8	0	0	0	112	C361 F363 M484 V486 D490 R496 I497 C498 D506 F507 A620	C361-Y494 HydrophobicContact CB-CE2 4.41Å; F363-Y494 HydrophobicContact CE1-CD1 4.49Å; F363-Y494 HydrophobicContact CE1-CE1 4.1Å; F363-Y494 AromaticContact CZ-CE1 3.98Å; F363-Y494 HydrophobicContact CZ-CE1 3.98Å; F363-Y494 AromaticContact CZ-CZ 4Å; M484-Y494 HydrophobicContact CE-CD2 3.32Å; M484-Y494 HydrophobicContact CE-CE2 3.4Å; M484-Y494 HydrophobicContact SD-CD2 4.04Å; V486-Y494 HydrophobicContact CG1-CD1 4.35Å; V486-Y494 HydrophobicContact CG1-CD2 4.32Å; V486-Y494 HydrophobicContact CG1-CG 3.95Å; V486-Y494 HydrophobicContact CG2-CD2 3.5Å; V486-Y494 VanDerWaalsContact CG2-CD2 3.5Å; V486-Y494 HydrophobicContact CG2-CE2 3.88Å; V486-Y494 HydrophobicContact CG2-CG 4Å; D490-Y494 WeakPolarHBondContact O-CB 3.49Å; D490-Y494 PolarHBondContact O-N 3.15Å; Y494-R496 VanDerWaalsContact C-N 3.3Å; Y494-R496 PolarHBondContact O-N 2.82Å; Y494-I497 WeakPolarHBondContact O-CB 3.32Å; Y494-I497 PolarHBondContact O-N 3.35Å; Y494-I497 VanDerWaalsContact O-N 3.16Å; Y494-C498 PolarHBondContact O-N 2.96Å; Y494-C498 PolarHBondContact O-SG 3.47Å; Y494-D506 WeakPolarHBondContact CE1-OD1 3.41Å; Y494-D506 WeakPolarHBondContact OH-CA 3.49Å; Y494-D506 WeakPolarHBondContact OH-CB 3.41Å; Y494-D506 PolarHBondContact OH-OD1 2.99Å; Y494-F507 AromaticContact CE2-CD2 3.8Å; Y494-F507 HydrophobicContact CE2-CD2 3.8Å; Y494-F507 HydrophobicContact CE2-CE2 4.44Å; Y494-F507 PolarHBondContact OH-N 3.34Å; Y494-A620 HydrophobicContact CD1-CB 4.32Å; Y494-A620 HydrophobicContact CE1-CB 4.16Å
495	R	91.2	Very high	90.1	Very high	49 Å²	49	58.9 Å²	58.9	19%	0.185	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-34.9	177.7	-74.5	176.8	-177.3	166	4.7	113.4	V491 S493 R499 A620	V491-R495 VanDerWaalsContact O-CG 3.31Å; V491-R495 WeakPolarHBondContact O-CG 3.5Å; V491-R495 PolarHBondContact O-N 2.84Å; S493-R495 PolarHBondContact O-N 3.23Å; R495-R499 WeakPolarHBondContact O-CG 3.47Å; R495-R499 PolarHBondContact O-N 3.02Å; R495-A620 HydrophobicContact CG-CB 4.2Å; R495-A620 PolarHBondContact NE-O 3.27Å; R495-A620 PolarHBondContact NH2-O 2.87Å
496	R	89.2	Confident	89.7	Confident	142 Å²	142	60.8 Å²	60.8	54%	0.536	28%	0.284	S	S	.	.	H	α-helix	trans	-65.1	-45.8	175.7	-71.3	174.2	-171.1	172.1	1.9	110.3	L492 S493 Y494 R499 T500	L492-R496 WeakPolarHBondContact O-CG 3.32Å; L492-R496 PolarHBondContact O-N 3Å; S493-R496 WeakPolarHBondContact O-CB 3.3Å; S493-R496 PolarHBondContact O-N 2.96Å; S493-R496 VanDerWaalsContact O-N 3.11Å; Y494-R496 VanDerWaalsContact C-N 3.3Å; Y494-R496 PolarHBondContact O-N 2.82Å; R496-R499 PolarHBondContact O-N 3.42Å; R496-T500 PolarHBondContact O-N 2.97Å; R496-T500 PolarHBondContact O-OG1 3.41Å
497	I	90.4	Very high	89.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-48.6	176.6	-65.6	169.2	0	0	0	110.7	V459 P460 Y466 S493 Y494 R499 T500 I501 F507	V459-I497 HydrophobicContact CG1-CD1 3.61Å; P460-I497 HydrophobicContact CB-CD1 4.08Å; P460-I497 HydrophobicContact CG-CD1 4.26Å; P460-I497 WeakPolarHBondContact O-CD1 3.32Å; Y466-I497 HydrophobicContact CD1-CG2 4.14Å; Y466-I497 HydrophobicContact CD2-CD1 4.42Å; Y466-I497 HydrophobicContact CD2-CG2 4.14Å; Y466-I497 HydrophobicContact CG-CD1 4.5Å; Y466-I497 HydrophobicContact CG-CG2 3.89Å; S493-I497 WeakPolarHBondContact O-CG1 3.49Å; S493-I497 PolarHBondContact O-N 3.05Å; Y494-I497 WeakPolarHBondContact O-CB 3.32Å; Y494-I497 PolarHBondContact O-N 3.35Å; Y494-I497 VanDerWaalsContact O-N 3.16Å; I497-R499 VanDerWaalsContact C-N 3.28Å; I497-R499 PolarHBondContact O-N 3.45Å; I497-T500 PolarHBondContact O-N 2.95Å; I497-T500 VanDerWaalsContact O-N 3.14Å; I497-I501 HydrophobicContact CG2-CD1 3.88Å; I497-I501 HydrophobicContact CG2-CG1 4.37Å; I497-I501 WeakPolarHBondContact O-CB 3.22Å; I497-I501 PolarHBondContact O-N 3.35Å; I497-F507 HydrophobicContact CG2-CE2 4.01Å; I497-F507 HydrophobicContact CG2-CZ 4.09Å
498	C	90.5	Very high	89.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-56.8	-40.3	178.5	-66	0	0	0	0	112.7	Y494 N502 D503 G504 R505 I621	Y494-C498 PolarHBondContact O-N 2.96Å; Y494-C498 PolarHBondContact O-SG 3.47Å; C498-N502 CarbonylContact O-C 3.53Å; C498-N502 VanDerWaalsContact O-C 3.24Å; C498-N502 WeakPolarHBondContact O-CA 3.46Å; C498-N502 PolarHBondContact O-N 3.25Å; C498-D503 PolarHBondContact O-N 3.32Å; C498-G504 WeakPolarHBondContact O-CA 3.43Å; C498-G504 PolarHBondContact O-N 3.12Å; C498-R505 WeakPolarHBondContact CB-O 3.41Å; C498-I621 HydrophobicContact CB-CD1 3.86Å
499	R	87.4	Confident	89.4	Confident	142 Å²	142	56.8 Å²	56.8	54%	0.536	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-38.7	178.1	-73.2	178.3	-164.2	151.7	3.4	113.1	R495 R496 I497	R495-R499 WeakPolarHBondContact O-CG 3.47Å; R495-R499 PolarHBondContact O-N 3.02Å; R496-R499 PolarHBondContact O-N 3.42Å; I497-R499 VanDerWaalsContact C-N 3.28Å; I497-R499 PolarHBondContact O-N 3.45Å
500	T	84	Confident	89.5	Confident	47 Å²	47	50.9 Å²	50.9	29%	0.288	25%	0.248	S	C	.	.	H	α-helix	trans	-79.4	-41	-178.9	-53.7	0	0	0	0	112.1	F307 S463 R496 I497	F307-T500 HydrophobicContact CD1-CG2 3.79Å; F307-T500 HydrophobicContact CE1-CG2 3.88Å; S463-T500 WeakPolarHBondContact OG-CB 3.16Å; S463-T500 PolarHBondContact OG-OG1 3.3Å; S463-T500 VanDerWaalsContact OG-OG1 3.08Å; R496-T500 PolarHBondContact O-N 2.97Å; R496-T500 PolarHBondContact O-OG1 3.41Å; I497-T500 PolarHBondContact O-N 2.95Å; I497-T500 VanDerWaalsContact O-N 3.14Å
501	I	85.3	Confident	89.4	Confident	11 Å²	11	52.4 Å²	52.4	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-105.9	-27.9	-163.8	-58.7	-171.8	0	0	0	112.8	L353 Y466 V467 I497 F507	L353-I501 HydrophobicContact CD1-CG2 3.62Å; L353-I501 HydrophobicContact CG-CG2 4.15Å; Y466-I501 HydrophobicContact CD1-CD1 3.24Å; Y466-I501 HydrophobicContact CE1-CD1 3.89Å; Y466-I501 HydrophobicContact CE1-CG2 4.21Å; Y466-I501 HydrophobicContact CG-CD1 4.05Å; V467-I501 HydrophobicContact CG2-CD1 3.76Å; I497-I501 HydrophobicContact CG2-CD1 3.88Å; I497-I501 HydrophobicContact CG2-CG1 4.37Å; I497-I501 WeakPolarHBondContact O-CB 3.22Å; I497-I501 PolarHBondContact O-N 3.35Å; I501-F507 HydrophobicContact CG2-CZ 4.4Å
502	N	86.1	Confident	89.2	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.203	26%	0.255	C	S	.	.	S	Bend	trans	-127.1	34.2	-171	-163.1	39	0	0	0	112.1	C498 G504 R505 D506 F507	C498-N502 CarbonylContact O-C 3.53Å; C498-N502 VanDerWaalsContact O-C 3.24Å; C498-N502 WeakPolarHBondContact O-CA 3.46Å; C498-N502 PolarHBondContact O-N 3.25Å; N502-G504 PolarHBondContact O-N 3Å; N502-R505 PolarHBondContact ND2-O 3.04Å; N502-R505 WeakPolarHBondContact O-CB 3.22Å; N502-R505 PolarHBondContact O-N 3.26Å; N502-D506 VanDerWaalsContact ND2-C 3.3Å; N502-D506 PolarHBondContact ND2-O 3.11Å; N502-F507 HydrophobicContact CB-CE1 4.3Å; N502-F507 HydrophobicContact CB-CZ 4.22Å
503	D	84.4	Confident	89.1	Confident	130 Å²	130	50.7 Å²	50.7	70%	0.695	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	31.4	178.1	-50.8	-41.1	0	0	0	114.5	C498 R505	C498-D503 PolarHBondContact O-N 3.32Å; D503-R505 VanDerWaalsContact C-N 3.26Å; D503-R505 PolarHBondContact O-N 3.37Å; D503-R505 IonicContact OD2-NH2 2.65Å; D503-R505 PolarHBondContact OD2-NH2 3.19Å
504	G	83.3	Confident	88.8	Confident	23 Å²	23	53.6 Å²	53.6	24%	0.237	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	19.2	-176.5	0	0	0	0	0	114.4	C498 N502 I621	C498-G504 WeakPolarHBondContact O-CA 3.43Å; C498-G504 PolarHBondContact O-N 3.12Å; N502-G504 PolarHBondContact O-N 3Å; G504-I621 WeakPolarHBondContact O-CD1 3.48Å
505	R	87.4	Confident	88.5	Confident	156 Å²	156	61.2 Å²	61.2	59%	0.589	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-101	154.9	170.6	-65.2	178.8	-73.8	178.8	-5.7	110.9	C498 N502 D503	C498-R505 WeakPolarHBondContact CB-O 3.41Å; N502-R505 PolarHBondContact ND2-O 3.04Å; N502-R505 WeakPolarHBondContact O-CB 3.22Å; N502-R505 PolarHBondContact O-N 3.26Å; D503-R505 VanDerWaalsContact C-N 3.26Å; D503-R505 PolarHBondContact O-N 3.37Å; D503-R505 IonicContact OD2-NH2 2.65Å; D503-R505 PolarHBondContact OD2-NH2 3.19Å
506	D	89.6	Confident	88.2	Confident	40 Å²	40	60.1 Å²	60.1	21%	0.214	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-69.6	148	172.6	-76.4	-44.9	0	0	0	111	Y494 N502 S619 A620	Y494-D506 WeakPolarHBondContact CE1-OD1 3.41Å; Y494-D506 WeakPolarHBondContact OH-CA 3.49Å; Y494-D506 WeakPolarHBondContact OH-CB 3.41Å; Y494-D506 PolarHBondContact OH-OD1 2.99Å; N502-D506 VanDerWaalsContact ND2-C 3.3Å; N502-D506 PolarHBondContact ND2-O 3.11Å; D506-S619 WeakPolarHBondContact OD2-CA 3.36Å; D506-S619 WeakPolarHBondContact OD2-CB 3.14Å; D506-S619 PolarHBondContact OD2-OG 3.06Å; D506-A620 PolarHBondContact OD2-N 3.4Å
507	F	90.4	Very high	88.3	Confident	10 Å²	10	54 Å²	54	4%	0.044	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-66.2	157.5	171.6	-70.2	-87.3	0	0	0	110.4	T359 C361 Y466 M484 Y494 I497 I501 N502	T359-F507 HydrophobicContact CG2-CE1 4.45Å; T359-F507 WeakPolarHBondContact OG1-CD1 3.49Å; C361-F507 HydrophobicContact CB-CB 4.16Å; Y466-F507 HydrophobicContact CE1-CE1 4.5Å; Y466-F507 HydrophobicContact CE1-CZ 4.22Å; Y466-F507 AromaticContact CZ-CZ 3.91Å; Y466-F507 WeakPolarHBondContact OH-CE1 3.45Å; M484-F507 HydrophobicContact CE-CD2 3.64Å; M484-F507 HydrophobicContact CE-CE2 3.69Å; M484-F507 HydrophobicContact CE-CG 4.43Å; Y494-F507 AromaticContact CE2-CD2 3.8Å; Y494-F507 HydrophobicContact CE2-CD2 3.8Å; Y494-F507 HydrophobicContact CE2-CE2 4.44Å; Y494-F507 PolarHBondContact OH-N 3.34Å; I497-F507 HydrophobicContact CG2-CE2 4.01Å; I497-F507 HydrophobicContact CG2-CZ 4.09Å; I501-F507 HydrophobicContact CG2-CZ 4.4Å; N502-F507 HydrophobicContact CB-CE1 4.3Å; N502-F507 HydrophobicContact CB-CZ 4.22Å
508	S	91.1	Very high	88.3	Confident	60 Å²	60	61.4 Å²	61.4	42%	0.42	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	138.3	175.2	70.3	0	0	0	0	110.9	T359 S360 C361	T359-S508 PolarHBondContact O-OG 2.97Å; S360-S508 CarbonylContact C-O 3.42Å; S360-S508 WeakPolarHBondContact CA-O 3.2Å; S360-S508 WeakPolarHBondContact CB-O 3.48Å; C361-S508 PolarHBondContact N-O 3.15Å
509	L	92.9	Very high	88.3	Confident	45 Å²	45	65.2 Å²	65.2	24%	0.236	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.1	176	-69.2	169.2	0	0	0	109.7	C361 F363 P609 T611 P617	C361-L509 WeakPolarHBondContact O-CA 3.13Å; F363-L509 HydrophobicContact CD2-CD2 3.74Å; F363-L509 HydrophobicContact CE2-CD2 3.73Å; L509-P609 HydrophobicContact CB-CB 4.19Å; L509-T611 HydrophobicContact CD1-CG2 3.71Å; L509-P617 HydrophobicContact CD1-CG 3.84Å
510	F	93.2	Very high	88.5	Confident	13 Å²	13	58.4 Å²	58.4	6%	0.057	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-71.5	129.5	173.3	-170.6	-94.5	0	0	0	109.9	C361 L362 F377 Y381 L481 L483 I512	C361-F510 PolarHBondContact O-N 3.11Å; L362-F510 HydrophobicContact CD1-CB 4.26Å; L362-F510 HydrophobicContact CD1-CD1 4.3Å; L362-F510 HydrophobicContact CD2-CB 3.9Å; L362-F510 WeakPolarHBondContact CD2-O 3.5Å; L362-F510 HydrophobicContact CG-CB 3.84Å; F377-F510 AromaticContact CD2-CE1 3.93Å; F377-F510 HydrophobicContact CD2-CE1 3.93Å; F377-F510 HydrophobicContact CD2-CE2 4.25Å; F377-F510 AromaticContact CD2-CZ 3.64Å; F377-F510 HydrophobicContact CD2-CZ 3.64Å; F377-F510 HydrophobicContact CE2-CE1 4.39Å; F377-F510 AromaticContact CE2-CE2 3.9Å; F377-F510 HydrophobicContact CE2-CE2 3.9Å; F377-F510 AromaticContact CE2-CZ 3.65Å; F377-F510 HydrophobicContact CE2-CZ 3.65Å; Y381-F510 HydrophobicContact CD2-CZ 4.22Å; Y381-F510 HydrophobicContact CE2-CE1 4Å; Y381-F510 AromaticContact CE2-CZ 3.57Å; Y381-F510 HydrophobicContact CE2-CZ 3.57Å; Y381-F510 AromaticContact CZ-CZ 3.9Å; L481-F510 HydrophobicContact CD2-CD2 4.38Å; L481-F510 HydrophobicContact CD2-CE2 3.73Å; L483-F510 HydrophobicContact CD1-CB 3.65Å; L483-F510 HydrophobicContact CD1-CD2 4.2Å; L483-F510 HydrophobicContact CD1-CG 3.94Å; F510-I512 HydrophobicContact CD1-CG1 4.31Å
511	P	90.4	Very high	89.1	Confident	33 Å²	33	58.3 Å²	58.3	21%	0.214	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-74.4	134.7	-178.4	30.8	-35.3	0	0	0	111.3	P604	P511-P604 HydrophobicContact CG-CB 4.21Å; P511-P604 HydrophobicContact CG-CG 3.77Å; P511-P604 WeakPolarHBondContact CG-O 3.16Å
512	I	88.7	Confident	89.5	Confident	34 Å²	34	60.6 Å²	60.6	17%	0.174	31%	0.306	C	S	.	.			trans	-125.5	129.8	175.7	-61.4	-178.1	0	0	0	108.9	L362 Y373 Y376 F510 K514 L517	L362-I512 HydrophobicContact CD1-CD1 3.79Å; L362-I512 HydrophobicContact CD1-CG1 4.49Å; L362-I512 HydrophobicContact CD2-CD1 3.53Å; L362-I512 HydrophobicContact CD2-CG1 4Å; L362-I512 HydrophobicContact CG-CD1 4.3Å; Y373-I512 HydrophobicContact CD1-CD1 3.43Å; Y373-I512 VanDerWaalsContact CD1-CD1 3.43Å; Y373-I512 HydrophobicContact CE1-CD1 3.34Å; Y373-I512 HydrophobicContact CE2-CD1 4.49Å; Y373-I512 HydrophobicContact CG-CD1 4.07Å; Y376-I512 HydrophobicContact CD1-CG2 4.49Å; Y376-I512 HydrophobicContact CE1-CB 4.48Å; Y376-I512 HydrophobicContact CE1-CG1 4.28Å; Y376-I512 HydrophobicContact CE1-CG2 4.05Å; F510-I512 HydrophobicContact CD1-CG1 4.31Å; I512-K514 PolarHBondContact O-N 2.89Å; I512-L517 HydrophobicContact CG2-CB 4.12Å; I512-L517 HydrophobicContact CG2-CD1 4.15Å; I512-L517 HydrophobicContact CG2-CD2 4.06Å; I512-L517 HydrophobicContact CG2-CG 4.34Å
513	D	89.2	Confident	89.9	Confident	80 Å²	80	59.3 Å²	59.3	43%	0.428	30%	0.299	S	S	.	.			trans	-80.5	114.3	168.4	-175.6	-26.3	0	0	0	109.1	Y376 Q515 D516 L517	Y376-D513 PolarHBondContact OH-N 2.96Å; D513-Q515 PolarHBondContact O-N 3.26Å; D513-Q515 PolarHBondContact OD1-N 3.05Å; D513-D516 HydrophobicContact CB-CB 3.69Å; D513-D516 PolarHBondContact O-N 3.31Å; D513-D516 PolarHBondContact OD1-N 3.07Å; D513-L517 VanDerWaalsContact O-CB 3.28Å; D513-L517 WeakPolarHBondContact O-CB 3.43Å; D513-L517 PolarHBondContact O-N 3.4Å
514	K	85.1	Confident	90.5	Very high	73 Å²	73	53.4 Å²	53.4	32%	0.317	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-38	-179.9	-79.2	-177.3	164	176.9	0	113.1	I512 D516 K518 F610 D612	I512-K514 PolarHBondContact O-N 2.89Å; K514-D516 VanDerWaalsContact C-N 3.3Å; K514-K518 WeakPolarHBondContact O-CG 3.42Å; K514-K518 PolarHBondContact O-N 3.2Å; K514-F610 HydrophobicContact CD-CE1 3.82Å; K514-D612 VanDerWaalsContact CE-OD1 3.26Å; K514-D612 WeakPolarHBondContact CE-OD1 3.2Å; K514-D612 VanDerWaalsContact CE-OD2 3.32Å; K514-D612 WeakPolarHBondContact CE-OD2 3.48Å; K514-D612 VanDerWaalsContact NZ-CG 3.29Å; K514-D612 IonicContact NZ-OD1 3.85Å; K514-D612 PolarHBondContact NZ-OD1 3.27Å; K514-D612 IonicContact NZ-OD2 3.72Å
515	Q	88	Confident	91.1	Very high	160 Å²	160	57.8 Å²	57.8	75%	0.748	28%	0.281	S	S	*	.	H	α-helix	trans	-69.2	-39.8	-178.4	-63.4	-173.8	7.4	0	0	109.8	D513	D513-Q515 PolarHBondContact O-N 3.26Å; D513-Q515 PolarHBondContact OD1-N 3.05Å
516	D	86.5	Confident	91.6	Very high	26 Å²	26	51.1 Å²	51.1	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-71.6	-39.5	178.5	-147.1	10.9	0	0	0	112.1	Y376 K380 D513 K514 K518 K519 Y520	Y376-D516 HydrophobicContact CE2-CB 4.31Å; K380-D516 WeakPolarHBondContact CE-OD2 3.31Å; K380-D516 IonicContact NZ-OD1 2.62Å; K380-D516 PolarHBondContact NZ-OD1 3.27Å; K380-D516 IonicContact NZ-OD2 3.74Å; K380-D516 PolarHBondContact NZ-OD2 3.21Å; D513-D516 HydrophobicContact CB-CB 3.69Å; D513-D516 PolarHBondContact O-N 3.31Å; D513-D516 PolarHBondContact OD1-N 3.07Å; K514-D516 VanDerWaalsContact C-N 3.3Å; D516-K518 PolarHBondContact O-N 3.3Å; D516-K519 WeakPolarHBondContact O-CB 3.49Å; D516-K519 WeakPolarHBondContact O-CG 3.36Å; D516-K519 PolarHBondContact O-N 2.95Å; D516-K519 VanDerWaalsContact O-N 3.16Å; D516-K519 WeakPolarHBondContact OD1-CD 3.43Å; D516-K519 WeakPolarHBondContact OD1-CE 3.3Å; D516-K519 IonicContact OD1-NZ 2.76Å; D516-K519 PolarHBondContact OD1-NZ 3.01Å; D516-Y520 WeakPolarHBondContact O-CD2 3.45Å; D516-Y520 WeakPolarHBondContact O-CE2 3.23Å
517	L	90.9	Very high	91.9	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-56.5	-37.4	176.2	-172	70.3	0	0	0	112.3	L372 Y373 Y376 I512 D513 K519 Y520	L372-L517 HydrophobicContact CD1-CD1 4.22Å; L372-L517 HydrophobicContact CD2-CD1 4.1Å; L372-L517 HydrophobicContact CD2-CD2 4.01Å; L372-L517 HydrophobicContact CD2-CG 3.94Å; L372-L517 HydrophobicContact CG-CD1 3.83Å; L372-L517 HydrophobicContact CG-CG 4.22Å; Y373-L517 HydrophobicContact CD1-CD1 4.25Å; Y373-L517 HydrophobicContact CD1-CD2 4.43Å; Y373-L517 HydrophobicContact CE1-CD2 3.95Å; Y376-L517 HydrophobicContact CD1-CD1 4.3Å; Y376-L517 HydrophobicContact CD2-CB 4.43Å; Y376-L517 HydrophobicContact CD2-CD1 3.68Å; Y376-L517 HydrophobicContact CE2-CD1 4.44Å; Y376-L517 HydrophobicContact CG-CD1 3.6Å; I512-L517 HydrophobicContact CG2-CB 4.12Å; I512-L517 HydrophobicContact CG2-CD1 4.15Å; I512-L517 HydrophobicContact CG2-CD2 4.06Å; I512-L517 HydrophobicContact CG2-CG 4.34Å; D513-L517 VanDerWaalsContact O-CB 3.28Å; D513-L517 WeakPolarHBondContact O-CB 3.43Å; D513-L517 PolarHBondContact O-N 3.4Å; L517-K519 PolarHBondContact O-N 3.4Å; L517-Y520 PolarHBondContact O-N 2.85Å
518	K	91.1	Very high	92.2	Very high	155 Å²	155	50 Å²	50	67%	0.674	26%	0.255	S	S	*	.	H	α-helix	trans	-57.2	-31.7	-179.3	-75.2	176.8	-177.9	-175.1	0	112.8	K514 D516 Y520 V521	K514-K518 WeakPolarHBondContact O-CG 3.42Å; K514-K518 PolarHBondContact O-N 3.2Å; D516-K518 PolarHBondContact O-N 3.3Å; K518-Y520 PolarHBondContact O-N 3.21Å; K518-V521 PolarHBondContact O-N 3.39Å
519	K	89.1	Confident	92.5	Very high	79 Å²	79	50.7 Å²	50.7	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-24.9	178.7	-58.6	175.8	-177.7	167.3	0	113.2	D516 L517 D596	D516-K519 WeakPolarHBondContact O-CB 3.49Å; D516-K519 WeakPolarHBondContact O-CG 3.36Å; D516-K519 PolarHBondContact O-N 2.95Å; D516-K519 VanDerWaalsContact O-N 3.16Å; D516-K519 WeakPolarHBondContact OD1-CD 3.43Å; D516-K519 WeakPolarHBondContact OD1-CE 3.3Å; D516-K519 IonicContact OD1-NZ 2.76Å; D516-K519 PolarHBondContact OD1-NZ 3.01Å; L517-K519 PolarHBondContact O-N 3.4Å; K519-D596 IonicContact NZ-OD1 3.72Å
520	Y	93.2	Very high	92.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-100.9	-9.9	-175.4	-53.4	-78.7	0	0	0	113.4	Y375 Y376 A379 K380 D516 L517 K518 V522 R523 V524 D596	Y375-Y520 HydrophobicContact CD1-CD1 4.04Å; Y375-Y520 HydrophobicContact CD1-CG 4.36Å; Y375-Y520 AromaticContact CE1-CD1 3.65Å; Y375-Y520 HydrophobicContact CE1-CD1 3.65Å; Y375-Y520 HydrophobicContact CE1-CG 4.35Å; Y376-Y520 AromaticContact CD2-CD2 3.7Å; Y376-Y520 HydrophobicContact CD2-CD2 3.7Å; Y376-Y520 AromaticContact CD2-CE2 3.57Å; Y376-Y520 HydrophobicContact CD2-CE2 3.57Å; Y376-Y520 HydrophobicContact CE2-CE2 4.13Å; A379-Y520 HydrophobicContact CB-CD1 4.37Å; A379-Y520 HydrophobicContact CB-CE1 3.64Å; K380-Y520 WeakPolarHBondContact CD-OH 3.26Å; K380-Y520 WeakPolarHBondContact CE-OH 3.33Å; K380-Y520 PolarHBondContact NZ-OH 3.14Å; D516-Y520 WeakPolarHBondContact O-CD2 3.45Å; D516-Y520 WeakPolarHBondContact O-CE2 3.23Å; L517-Y520 PolarHBondContact O-N 2.85Å; K518-Y520 PolarHBondContact O-N 3.21Å; Y520-V522 PolarHBondContact O-N 3.1Å; Y520-R523 PolarHBondContact O-N 3.47Å; Y520-V524 WeakPolarHBondContact O-CG2 3.24Å; Y520-V524 PolarHBondContact O-N 3.32Å; Y520-V524 VanDerWaalsContact O-N 3.09Å; Y520-D596 VanDerWaalsContact OH-CG 3.26Å; Y520-D596 PolarHBondContact OH-OD1 3.05Å; Y520-D596 PolarHBondContact OH-OD2 3.3Å
521	V	94.5	Very high	92.8	Very high	44 Å²	44	48.7 Å²	48.7	27%	0.267	24%	0.242	S	C	.	.	H	α-helix	trans	-59.8	-52	-174.4	174.3	0	0	0	0	111	L372 K518 V524 Q525	L372-V521 HydrophobicContact CD1-CG2 4.21Å; L372-V521 HydrophobicContact CD2-CG2 3.82Å; K518-V521 PolarHBondContact O-N 3.39Å; V521-V524 PolarHBondContact O-N 3.39Å; V521-Q525 HydrophobicContact CG1-CG 4.45Å; V521-Q525 WeakPolarHBondContact O-CG 3.48Å; V521-Q525 PolarHBondContact O-N 3.41Å
522	V	94.7	Very high	93.1	Very high	59 Å²	59	49.7 Å²	49.7	36%	0.358	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-45	-176.3	-178	0	0	0	0	110.9	Y520 V524 Q525 L526 E589	Y520-V522 PolarHBondContact O-N 3.1Å; V522-V524 VanDerWaalsContact C-N 3.35Å; V522-V524 PolarHBondContact O-N 2.66Å; V522-Q525 PolarHBondContact O-N 3.02Å; V522-L526 HydrophobicContact CG1-CD1 3.95Å; V522-L526 HydrophobicContact CG1-CG 4.3Å; V522-L526 WeakPolarHBondContact O-CG 3.43Å; V522-L526 PolarHBondContact O-N 3.37Å; V522-E589 HydrophobicContact CG1-CG 4.05Å; V522-E589 WeakPolarHBondContact CG1-OE1 3.32Å
523	R	94.5	Very high	93.4	Very high	12 Å²	12	49.2 Å²	49.2	5%	0.045	25%	0.25	C	S	.	.	H	α-helix	trans	-54	-49.1	176	-67.9	175.4	178.9	-179.8	-5.4	112.1	Y375 L405 Y520 A527 L586 E589	Y375-R523 HydrophobicContact CE1-CB 4.27Å; L405-R523 HydrophobicContact CD2-CB 4.17Å; Y520-R523 PolarHBondContact O-N 3.47Å; R523-A527 WeakPolarHBondContact O-CB 3.5Å; R523-A527 PolarHBondContact O-N 3.46Å; R523-L586 HydrophobicContact CB-CD1 4.08Å; R523-L586 HydrophobicContact CG-CD1 4.37Å; R523-L586 WeakPolarHBondContact O-CD1 3.22Å; R523-E589 HydrophobicContact CG-CB 3.69Å; R523-E589 HydrophobicContact CG-CG 4.38Å; R523-E589 PolarHBondContact NE-O 3.15Å; R523-E589 VanDerWaalsContact NE-O 3.09Å; R523-E589 PolarHBondContact NH2-O 2.86Å
524	V	96.4	Very high	93.5	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-69.4	-39.2	-178	175.5	0	0	0	0	111.4	D371 L372 Y375 L405 Y520 V521 V522 A527 A528	D371-V524 HydrophobicContact CB-CG1 3.95Å; L372-V524 HydrophobicContact CB-CG1 4.46Å; L372-V524 HydrophobicContact CD1-CB 4.35Å; L372-V524 HydrophobicContact CD1-CG2 4.03Å; Y375-V524 HydrophobicContact CD1-CG2 3.41Å; Y375-V524 VanDerWaalsContact CD1-CG2 3.41Å; Y375-V524 HydrophobicContact CE1-CG2 4.3Å; Y375-V524 HydrophobicContact CG-CG2 3.9Å; L405-V524 HydrophobicContact CD1-CG2 4.19Å; L405-V524 HydrophobicContact CD2-CG2 4.45Å; Y520-V524 WeakPolarHBondContact O-CG2 3.24Å; Y520-V524 PolarHBondContact O-N 3.32Å; Y520-V524 VanDerWaalsContact O-N 3.09Å; V521-V524 PolarHBondContact O-N 3.39Å; V522-V524 VanDerWaalsContact C-N 3.35Å; V522-V524 PolarHBondContact O-N 2.66Å; V524-A527 PolarHBondContact O-N 3.26Å; V524-A528 WeakPolarHBondContact O-CB 3.29Å; V524-A528 PolarHBondContact O-N 3.42Å
525	Q	96.7	Very high	93.8	Very high	115 Å²	115	50.2 Å²	50.2	54%	0.537	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-48.3	176.1	-75.7	175.5	-18.5	0	0	111.9	V521 V522 A528 E529	V521-Q525 HydrophobicContact CG1-CG 4.45Å; V521-Q525 WeakPolarHBondContact O-CG 3.48Å; V521-Q525 PolarHBondContact O-N 3.41Å; V522-Q525 PolarHBondContact O-N 3.02Å; Q525-A528 PolarHBondContact O-N 3.09Å; Q525-E529 PolarHBondContact O-N 3.28Å
526	L	96.9	Very high	93.9	Very high	17 Å²	17	49.9 Å²	49.9	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-46.7	177.5	-68.9	173.5	0	0	0	111.5	V522 A528 E529 I530 L582 R585 L586 E589	V522-L526 HydrophobicContact CG1-CD1 3.95Å; V522-L526 HydrophobicContact CG1-CG 4.3Å; V522-L526 WeakPolarHBondContact O-CG 3.43Å; V522-L526 PolarHBondContact O-N 3.37Å; L526-A528 VanDerWaalsContact C-N 3.33Å; L526-A528 PolarHBondContact O-N 2.79Å; L526-E529 PolarHBondContact O-N 2.9Å; L526-I530 WeakPolarHBondContact O-CD1 3.38Å; L526-I530 VanDerWaalsContact O-CG1 3.27Å; L526-I530 WeakPolarHBondContact O-CG1 3.49Å; L526-I530 PolarHBondContact O-N 3.15Å; L526-L582 HydrophobicContact CD2-CD2 3.73Å; L526-R585 HydrophobicContact CD1-CB 3.89Å; L526-R585 HydrophobicContact CD2-CB 4.33Å; L526-L586 HydrophobicContact CB-CB 4.28Å; L526-L586 HydrophobicContact CB-CD1 4.28Å; L526-L586 HydrophobicContact CD1-CB 4.28Å; L526-E589 HydrophobicContact CD1-CG 4.02Å
527	A	97.2	Very high	94	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-37.4	178.7	0	0	0	0	0	112.6	L401 K404 L405 R523 V524 E531 L586	L401-A527 HydrophobicContact CD1-CB 3.77Å; K404-A527 HydrophobicContact CB-CB 4.19Å; L405-A527 HydrophobicContact CD1-CB 4.33Å; L405-A527 HydrophobicContact CD2-CB 3.58Å; L405-A527 HydrophobicContact CG-CB 3.68Å; R523-A527 WeakPolarHBondContact O-CB 3.5Å; R523-A527 PolarHBondContact O-N 3.46Å; V524-A527 PolarHBondContact O-N 3.26Å; A527-E531 WeakPolarHBondContact O-CB 3.37Å; A527-E531 PolarHBondContact O-N 3.28Å; A527-L586 HydrophobicContact CB-CD2 4.03Å
528	A	96.9	Very high	93.8	Very high	26 Å²	26	56.9 Å²	56.9	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-39	176.2	0	0	0	0	0	112.3	L401 V524 Q525 L526 E531 A532	L401-A528 HydrophobicContact CD1-CB 4.1Å; V524-A528 WeakPolarHBondContact O-CB 3.29Å; V524-A528 PolarHBondContact O-N 3.42Å; Q525-A528 PolarHBondContact O-N 3.09Å; L526-A528 VanDerWaalsContact C-N 3.33Å; L526-A528 PolarHBondContact O-N 2.79Å; A528-E531 PolarHBondContact O-N 3.09Å; A528-A532 WeakPolarHBondContact O-CB 3.24Å; A528-A532 PolarHBondContact O-N 2.92Å
529	E	96.8	Very high	93.6	Very high	74 Å²	74	51.6 Å²	51.6	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-44.9	174.4	-169.9	179.5	158.5	0	0	111.1	Q525 L526 A532 I533 R578 L582	Q525-E529 PolarHBondContact O-N 3.28Å; L526-E529 PolarHBondContact O-N 2.9Å; E529-A532 PolarHBondContact O-N 3.3Å; E529-I533 HydrophobicContact CG-CD1 4.2Å; E529-I533 WeakPolarHBondContact O-CG1 3.47Å; E529-I533 PolarHBondContact O-N 2.99Å; E529-R578 IonicContact OE1-CZ 2.73Å; E529-R578 IonicContact OE1-NE 2.71Å; E529-R578 PolarHBondContact OE1-NE 2.99Å; E529-R578 IonicContact OE1-NH2 3.93Å; E529-R578 PolarHBondContact OE1-NH2 3.45Å; E529-R578 IonicContact OE2-NH2 3.8Å; E529-L582 HydrophobicContact CB-CD1 4.17Å; E529-L582 HydrophobicContact CG-CD1 3.71Å
530	I	97	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-50.1	175.4	-66.6	161.2	0	0	0	110.7	K404 L526 A532 I533 E534 V579 L582 E583 L586	K404-I530 HydrophobicContact CD-CG2 4.3Å; K404-I530 HydrophobicContact CG-CG2 4.46Å; L526-I530 WeakPolarHBondContact O-CD1 3.38Å; L526-I530 VanDerWaalsContact O-CG1 3.27Å; L526-I530 WeakPolarHBondContact O-CG1 3.49Å; L526-I530 PolarHBondContact O-N 3.15Å; I530-A532 VanDerWaalsContact C-N 3.31Å; I530-A532 PolarHBondContact O-N 3.38Å; I530-I533 PolarHBondContact O-N 3.22Å; I530-E534 HydrophobicContact CG2-CG 4.36Å; I530-E534 WeakPolarHBondContact O-CG 3.18Å; I530-E534 PolarHBondContact O-N 2.87Å; I530-V579 HydrophobicContact CG2-CG1 4.1Å; I530-L582 HydrophobicContact CD1-CB 3.81Å; I530-L582 HydrophobicContact CG1-CB 3.5Å; I530-L582 VanDerWaalsContact CG1-CB 3.5Å; I530-L582 HydrophobicContact CG1-CD1 4Å; I530-L582 HydrophobicContact CG1-CG 4.41Å; I530-E583 HydrophobicContact CD1-CG 3.85Å; I530-L586 HydrophobicContact CD1-CD2 4.08Å
531	E	96.3	Very high	93	Very high	17 Å²	17	56 Å²	56	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-41.1	-178.8	-166.8	-81.4	153.5	0	0	111.8	R397 A527 A528 E534 H535	R397-E531 VanDerWaalsContact CG-CD 3.48Å; R397-E531 WeakPolarHBondContact CG-OE1 3.13Å; R397-E531 WeakPolarHBondContact CG-OE2 3.41Å; A527-E531 WeakPolarHBondContact O-CB 3.37Å; A527-E531 PolarHBondContact O-N 3.28Å; A528-E531 PolarHBondContact O-N 3.09Å; E531-E534 PolarHBondContact O-N 2.97Å; E531-H535 WeakPolarHBondContact O-CB 3.22Å; E531-H535 PolarHBondContact O-N 3.11Å
532	A	95.3	Very high	92.4	Very high	54 Å²	54	56.6 Å²	56.6	45%	0.446	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-42.1	177.5	0	0	0	0	0	112.4	A528 E529 I530 R536	A528-A532 WeakPolarHBondContact O-CB 3.24Å; A528-A532 PolarHBondContact O-N 2.92Å; E529-A532 PolarHBondContact O-N 3.3Å; I530-A532 VanDerWaalsContact C-N 3.31Å; I530-A532 PolarHBondContact O-N 3.38Å; A532-R536 WeakPolarHBondContact O-CB 3.44Å; A532-R536 PolarHBondContact O-N 3.4Å
533	I	94.4	Very high	91.9	Very high	24 Å²	24	60 Å²	60	12%	0.123	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-48.7	176.9	-66.1	165.8	0	0	0	110.6	E529 I530 H535 R536 V537 L575 R578 V579 L582	E529-I533 HydrophobicContact CG-CD1 4.2Å; E529-I533 WeakPolarHBondContact O-CG1 3.47Å; E529-I533 PolarHBondContact O-N 2.99Å; I530-I533 PolarHBondContact O-N 3.22Å; I533-H535 VanDerWaalsContact C-N 3.32Å; I533-H535 PolarHBondContact O-N 3.2Å; I533-R536 PolarHBondContact O-N 2.72Å; I533-V537 HydrophobicContact CG2-CG2 4.49Å; I533-V537 WeakPolarHBondContact O-CG2 3.43Å; I533-V537 PolarHBondContact O-N 2.96Å; I533-L575 HydrophobicContact CG2-CB 4.17Å; I533-L575 HydrophobicContact CG2-CD2 4.01Å; I533-R578 HydrophobicContact CD1-CG 3.95Å; I533-V579 HydrophobicContact CB-CG2 3.97Å; I533-V579 HydrophobicContact CD1-CG2 4.33Å; I533-V579 HydrophobicContact CG2-CG2 3.52Å; I533-L582 HydrophobicContact CD1-CD1 3.9Å
534	E	92.7	Very high	91.3	Very high	62 Å²	62	62.6 Å²	62.6	29%	0.29	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-43.1	178.1	-74.1	-175	151.6	0	0	111.9	K404 I530 E531 V537 K538	K404-E534 VanDerWaalsContact CE-OE1 3.28Å; K404-E534 WeakPolarHBondContact CE-OE1 3.43Å; K404-E534 IonicContact NZ-OE1 2.72Å; K404-E534 PolarHBondContact NZ-OE1 3.49Å; K404-E534 IonicContact NZ-OE2 3.26Å; K404-E534 PolarHBondContact NZ-OE2 3.34Å; I530-E534 HydrophobicContact CG2-CG 4.36Å; I530-E534 WeakPolarHBondContact O-CG 3.18Å; I530-E534 PolarHBondContact O-N 2.87Å; E531-E534 PolarHBondContact O-N 2.97Å; E534-V537 PolarHBondContact O-N 2.87Å; E534-K538 VanDerWaalsContact O-CB 3.32Å; E534-K538 WeakPolarHBondContact O-CB 3.22Å; E534-K538 PolarHBondContact O-N 3.23Å
535	H	91.4	Very high	90.8	Very high	111 Å²	111	65.3 Å²	65.3	51%	0.514	33%	0.33	S	S	.	.	H	α-helix	trans	-61.4	-44.5	177	-179.9	-90.4	0	0	0	111.4	E531 I533 K538 S539	E531-H535 WeakPolarHBondContact O-CB 3.22Å; E531-H535 PolarHBondContact O-N 3.11Å; I533-H535 VanDerWaalsContact C-N 3.32Å; I533-H535 PolarHBondContact O-N 3.2Å; H535-K538 PolarHBondContact O-N 3.11Å; H535-S539 WeakPolarHBondContact O-CB 3.41Å; H535-S539 PolarHBondContact O-N 3.22Å
536	R	89.7	Confident	90.2	Very high	154 Å²	154	65.9 Å²	65.9	58%	0.581	33%	0.327	S	S	*	.	H	α-helix	trans	-59.3	-49.9	176.1	-177.4	178	177.4	171.2	0.9	111.6	A532 I533 K538 S539 E540	A532-R536 WeakPolarHBondContact O-CB 3.44Å; A532-R536 PolarHBondContact O-N 3.4Å; I533-R536 PolarHBondContact O-N 2.72Å; R536-K538 VanDerWaalsContact C-N 3.3Å; R536-K538 PolarHBondContact O-N 2.87Å; R536-S539 PolarHBondContact O-N 2.97Å; R536-E540 WeakPolarHBondContact CG-OE1 3.49Å; R536-E540 IonicContact NE-OE1 3.87Å; R536-E540 PolarHBondContact NE-OE1 3.46Å; R536-E540 VanDerWaalsContact NE-OE1 3.14Å; R536-E540 WeakPolarHBondContact O-CG 3.33Å; R536-E540 PolarHBondContact O-N 2.83Å
537	V	88.6	Confident	89.6	Confident	32 Å²	32	70.2 Å²	70.2	19%	0.194	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-41.5	178.3	172.2	0	0	0	0	111.3	I533 E534 K541 L575	I533-V537 HydrophobicContact CG2-CG2 4.49Å; I533-V537 WeakPolarHBondContact O-CG2 3.43Å; I533-V537 PolarHBondContact O-N 2.96Å; E534-V537 PolarHBondContact O-N 2.87Å; V537-K541 HydrophobicContact CG1-CD 4.38Å; V537-K541 WeakPolarHBondContact O-CG 3.47Å; V537-K541 PolarHBondContact O-N 2.64Å; V537-K541 VanDerWaalsContact O-N 3.09Å; V537-L575 HydrophobicContact CG2-CB 4.46Å; V537-L575 HydrophobicContact CG2-CD1 3.87Å
538	K	87.3	Confident	88.9	Confident	154 Å²	154	74.9 Å²	74.9	67%	0.67	36%	0.363	S	S	*	.	H	α-helix	trans	-66.7	-42.7	178.1	-171.4	178.2	-179.9	-179.3	0	111.9	E534 H535 R536 K541 A542	E534-K538 VanDerWaalsContact O-CB 3.32Å; E534-K538 WeakPolarHBondContact O-CB 3.22Å; E534-K538 PolarHBondContact O-N 3.23Å; H535-K538 PolarHBondContact O-N 3.11Å; R536-K538 VanDerWaalsContact C-N 3.3Å; R536-K538 PolarHBondContact O-N 2.87Å; K538-K541 PolarHBondContact O-N 2.87Å; K538-A542 WeakPolarHBondContact O-CB 3.49Å; K538-A542 PolarHBondContact O-N 3.24Å
539	S	85.2	Confident	88.4	Confident	45 Å²	45	78.1 Å²	78.1	32%	0.315	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-44	178.1	-173.2	0	0	0	0	111.7	H535 R536 A542 K543	H535-S539 WeakPolarHBondContact O-CB 3.41Å; H535-S539 PolarHBondContact O-N 3.22Å; R536-S539 PolarHBondContact O-N 2.97Å; S539-A542 PolarHBondContact O-N 3.03Å; S539-K543 WeakPolarHBondContact O-CG 3.39Å; S539-K543 PolarHBondContact O-N 2.83Å
540	E	85.6	Confident	87.9	Confident	67 Å²	67	76.2 Å²	76.2	31%	0.313	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-41.6	176.4	-72.6	171.9	-171.8	0	0	112.1	R536 K543 K544	R536-E540 WeakPolarHBondContact CG-OE1 3.49Å; R536-E540 IonicContact NE-OE1 3.87Å; R536-E540 PolarHBondContact NE-OE1 3.46Å; R536-E540 VanDerWaalsContact NE-OE1 3.14Å; R536-E540 WeakPolarHBondContact O-CG 3.33Å; R536-E540 PolarHBondContact O-N 2.83Å; E540-K543 PolarHBondContact O-N 3.3Å; E540-K544 WeakPolarHBondContact O-CG 3.44Å; E540-K544 PolarHBondContact O-N 3.36Å
541	K	84	Confident	87.5	Confident	105 Å²	105	76.7 Å²	76.7	46%	0.457	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-44.2	174.3	-76.6	179.6	179.9	-177.1	0	112.2	V537 K538 K544 S545	V537-K541 HydrophobicContact CG1-CD 4.38Å; V537-K541 WeakPolarHBondContact O-CG 3.47Å; V537-K541 PolarHBondContact O-N 2.64Å; V537-K541 VanDerWaalsContact O-N 3.09Å; K538-K541 PolarHBondContact O-N 2.87Å; K541-K544 PolarHBondContact O-N 3.15Å; K541-S545 WeakPolarHBondContact O-CB 3.39Å; K541-S545 PolarHBondContact O-N 3.25Å
542	A	83.9	Confident	87	Confident	56 Å²	56	82 Å²	82	46%	0.463	40%	0.4	S	S	.	.	H	α-helix	trans	-62.5	-44.6	178.5	0	0	0	0	0	111.3	K538 S539 S545 W546	K538-A542 WeakPolarHBondContact O-CB 3.49Å; K538-A542 PolarHBondContact O-N 3.24Å; S539-A542 PolarHBondContact O-N 3.03Å; A542-S545 PolarHBondContact O-N 3.23Å; A542-W546 WeakPolarHBondContact O-CB 3.32Å; A542-W546 PolarHBondContact O-N 3.47Å
543	K	83.2	Confident	86.7	Confident	131 Å²	131	87.5 Å²	87.5	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-59.3	-49.9	174.6	-72.7	178.3	-177.4	-177	0	111.8	S539 E540 S545 W546 F547	S539-K543 WeakPolarHBondContact O-CG 3.39Å; S539-K543 PolarHBondContact O-N 2.83Å; E540-K543 PolarHBondContact O-N 3.3Å; K543-S545 VanDerWaalsContact C-N 3.31Å; K543-S545 PolarHBondContact O-N 3.12Å; K543-W546 PolarHBondContact O-N 3.44Å; K543-F547 VanDerWaalsContact O-CD2 3.22Å; K543-F547 WeakPolarHBondContact O-CD2 3.49Å; K543-F547 PolarHBondContact O-N 3.38Å
544	K	82.9	Confident	86.6	Confident	65 Å²	65	89.2 Å²	89.2	28%	0.283	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-42	177.2	-72.8	-165.9	-179.4	-159.5	0	112	E540 K541 R548 N563 N568	E540-K544 WeakPolarHBondContact O-CG 3.44Å; E540-K544 PolarHBondContact O-N 3.36Å; K541-K544 PolarHBondContact O-N 3.15Å; K544-R548 WeakPolarHBondContact O-CB 3.35Å; K544-R548 PolarHBondContact O-N 2.99Å; K544-N563 PolarHBondContact NZ-O 2.8Å; K544-N568 PolarHBondContact NZ-ND2 2.81Å; K544-N568 VanDerWaalsContact NZ-ND2 3.16Å
545	S	84.2	Confident	86.3	Confident	63 Å²	63	93.6 Å²	93.6	44%	0.441	46%	0.46	S	S	.	.	H	α-helix	trans	-63.9	-41.1	176.5	-170.9	0	0	0	0	112.3	K541 A542 K543 N549	K541-S545 WeakPolarHBondContact O-CB 3.39Å; K541-S545 PolarHBondContact O-N 3.25Å; A542-S545 PolarHBondContact O-N 3.23Å; K543-S545 VanDerWaalsContact C-N 3.31Å; K543-S545 PolarHBondContact O-N 3.12Å; S545-N549 VanDerWaalsContact O-CG 3.26Å; S545-N549 PolarHBondContact O-N 2.89Å; S545-N549 VanDerWaalsContact O-N 3.08Å; S545-N549 PolarHBondContact O-OD1 3.47Å
546	W	85.6	Confident	86.1	Confident	127 Å²	127	93.5 Å²	93.5	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-48.6	177.8	179.8	85.1	0	0	0	111.4	A542 K543 R548 N549 A550	A542-W546 WeakPolarHBondContact O-CB 3.32Å; A542-W546 PolarHBondContact O-N 3.47Å; K543-W546 PolarHBondContact O-N 3.44Å; W546-R548 VanDerWaalsContact C-N 3.33Å; W546-R548 PolarHBondContact O-N 3.02Å; W546-N549 PolarHBondContact O-N 2.83Å; W546-A550 WeakPolarHBondContact O-CB 3.41Å; W546-A550 PolarHBondContact O-N 3.06Å
547	F	84.2	Confident	85.5	Confident	107 Å²	107	92.3 Å²	92.3	47%	0.469	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-42.2	176.9	-84.4	-72.3	0	0	0	112.5	K543 N549 A550 A551 W558	K543-F547 VanDerWaalsContact O-CD2 3.22Å; K543-F547 WeakPolarHBondContact O-CD2 3.49Å; K543-F547 PolarHBondContact O-N 3.38Å; F547-N549 VanDerWaalsContact C-N 3.33Å; F547-N549 PolarHBondContact O-N 3.07Å; F547-A550 PolarHBondContact O-N 3.21Å; F547-A551 WeakPolarHBondContact O-CB 3.38Å; F547-A551 PolarHBondContact O-N 3.19Å; F547-W558 HydrophobicContact CB-CH2 3.55Å; F547-W558 HydrophobicContact CB-CZ2 4.33Å; F547-W558 HydrophobicContact CB-CZ3 3.84Å; F547-W558 HydrophobicContact CG-CH2 4.33Å
548	R	82.1	Confident	84.9	Confident	99 Å²	99	94.7 Å²	94.7	37%	0.374	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-40.7	176.7	-170.4	177.9	-169.8	-166.4	2.1	112.2	K544 W546 K552 W558 D560	K544-R548 WeakPolarHBondContact O-CB 3.35Å; K544-R548 PolarHBondContact O-N 2.99Å; W546-R548 VanDerWaalsContact C-N 3.33Å; W546-R548 PolarHBondContact O-N 3.02Å; R548-K552 WeakPolarHBondContact O-CG 3.21Å; R548-K552 PolarHBondContact O-N 3.08Å; R548-W558 HydrophobicContact CG-CG 4.42Å; R548-D560 IonicContact CZ-OD1 2.66Å; R548-D560 IonicContact CZ-OD2 3.49Å; R548-D560 VanDerWaalsContact CZ-OD2 3.23Å; R548-D560 IonicContact NE-OD1 3.84Å; R548-D560 PolarHBondContact NE-OD1 2.81Å; R548-D560 IonicContact NE-OD2 3.32Å; R548-D560 PolarHBondContact NE-OD2 3.38Å; R548-D560 IonicContact NH2-OD1 2.99Å; R548-D560 IonicContact NH2-OD2 2.62Å; R548-D560 PolarHBondContact NH2-OD2 2.9Å
549	N	85.2	Confident	84.1	Confident	93 Å²	93	91 Å²	91	50%	0.497	47%	0.468	S	S	.	.	H	α-helix	trans	-69.8	-43	177.7	-70.3	-6.2	0	0	0	111.5	S545 W546 F547 A551 K552 E553	S545-N549 VanDerWaalsContact O-CG 3.26Å; S545-N549 PolarHBondContact O-N 2.89Å; S545-N549 VanDerWaalsContact O-N 3.08Å; S545-N549 PolarHBondContact O-OD1 3.47Å; W546-N549 PolarHBondContact O-N 2.83Å; F547-N549 VanDerWaalsContact C-N 3.33Å; F547-N549 PolarHBondContact O-N 3.07Å; N549-A551 PolarHBondContact O-N 3.38Å; N549-K552 PolarHBondContact O-N 2.94Å; N549-E553 WeakPolarHBondContact O-CB 3.3Å; N549-E553 PolarHBondContact O-N 3.3Å
550	A	88.1	Confident	83.2	Confident	35 Å²	35	92 Å²	92	29%	0.289	47%	0.47	S	S	.	.	H	α-helix	trans	-64.1	-38.9	177.3	0	0	0	0	0	112.5	W546 F547 E553 A554	W546-A550 WeakPolarHBondContact O-CB 3.41Å; W546-A550 PolarHBondContact O-N 3.06Å; F547-A550 PolarHBondContact O-N 3.21Å; A550-E553 PolarHBondContact O-N 2.8Å; A550-A554 WeakPolarHBondContact O-CB 3.14Å; A550-A554 PolarHBondContact O-N 3.25Å
551	A	87.4	Confident	81.8	Confident	10 Å²	10	96.6 Å²	96.6	8%	0.083	49%	0.491	C	S	.	.	H	α-helix	trans	-64.1	-42.3	175.1	0	0	0	0	0	111.7	F547 N549 A554 D555 L556 W558	F547-A551 WeakPolarHBondContact O-CB 3.38Å; F547-A551 PolarHBondContact O-N 3.19Å; N549-A551 PolarHBondContact O-N 3.38Å; A551-A554 CarbonylContact O-C 3.5Å; A551-A554 PolarHBondContact O-N 3.03Å; A551-D555 PolarHBondContact O-N 3.48Å; A551-L556 HydrophobicContact CB-CB 4.37Å; A551-L556 PolarHBondContact O-N 3.46Å; A551-W558 HydrophobicContact CB-CB 3.99Å; A551-W558 HydrophobicContact CB-CD2 4.24Å; A551-W558 HydrophobicContact CB-CE3 3.62Å; A551-W558 HydrophobicContact CB-CG 4.42Å; A551-W558 HydrophobicContact CB-CZ3 4.48Å
552	K	86.5	Confident	80.5	Confident	127 Å²	127	98.9 Å²	98.9	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-63.4	-41.4	174.2	-75	179.1	178.5	-172.5	0	112.9	R548 N549 A554 D555	R548-K552 WeakPolarHBondContact O-CG 3.21Å; R548-K552 PolarHBondContact O-N 3.08Å; N549-K552 PolarHBondContact O-N 2.94Å; K552-A554 VanDerWaalsContact C-N 3.26Å; K552-A554 PolarHBondContact O-N 3.5Å; K552-D555 PolarHBondContact O-N 2.84Å
553	E	89.6	Confident	79	Confident	171 Å²	171	100 Å²	100	80%	0.799	50%	0.502	S	S	*	.	H	α-helix	trans	-68.3	-27.9	177.7	-172.2	174.4	-175.9	0	0	112.4	N549 A550 D555	N549-E553 WeakPolarHBondContact O-CB 3.3Å; N549-E553 PolarHBondContact O-N 3.3Å; A550-E553 PolarHBondContact O-N 2.8Å; E553-D555 VanDerWaalsContact C-N 3.34Å
554	A	90.5	Very high	77.8	Confident	60 Å²	60	97.7 Å²	97.7	50%	0.496	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	7.4	175.3	0	0	0	0	0	114	A550 A551 K552 L556	A550-A554 WeakPolarHBondContact O-CB 3.14Å; A550-A554 PolarHBondContact O-N 3.25Å; A551-A554 CarbonylContact O-C 3.5Å; A551-A554 PolarHBondContact O-N 3.03Å; K552-A554 VanDerWaalsContact C-N 3.26Å; K552-A554 PolarHBondContact O-N 3.5Å; A554-L556 HydrophobicContact CB-CD1 3.92Å; A554-L556 HydrophobicContact CB-CG 3.96Å; A554-L556 PolarHBondContact O-N 3.18Å; A554-L556 VanDerWaalsContact O-N 3.09Å
555	D	86.3	Confident	76.7	Confident	153 Å²	153	97.4 Å²	97.4	82%	0.818	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	30.1	-173.1	-66.6	-42.8	0	0	0	113.8	A551 K552 E553	A551-D555 PolarHBondContact O-N 3.48Å; K552-D555 PolarHBondContact O-N 2.84Å; E553-D555 VanDerWaalsContact C-N 3.34Å
556	L	87.4	Confident	75.6	Confident	110 Å²	110	102.3 Å²	102.3	58%	0.576	52%	0.519	S	S	*	.			trans	-88.1	133.1	177.5	-69.3	172.1	0	0	0	110.1	A551 A554 W558	A551-L556 HydrophobicContact CB-CB 4.37Å; A551-L556 PolarHBondContact O-N 3.46Å; A554-L556 HydrophobicContact CB-CD1 3.92Å; A554-L556 HydrophobicContact CB-CG 3.96Å; A554-L556 PolarHBondContact O-N 3.18Å; A554-L556 VanDerWaalsContact O-N 3.09Å; L556-W558 PolarHBondContact O-N 2.82Å; L556-W558 VanDerWaalsContact O-N 3.13Å
557	P	78.2	Confident	74.6	Confident	129 Å²	129	103.1 Å²	103.1	84%	0.838	53%	0.528	S	S	*	.			trans	-61.6	119.8	172.6	24.2	-30.5	0	0	0	109.3
558	W	74.7	Confident	74.1	Confident	81 Å²	81	100.8 Å²	100.8	31%	0.307	52%	0.52	S	S	.	.			trans	-107.6	109.3	175	-178.3	-85	0	0	0	108.6	F547 R548 A551 L556 D560 N563	F547-W558 HydrophobicContact CB-CH2 3.55Å; F547-W558 HydrophobicContact CB-CZ2 4.33Å; F547-W558 HydrophobicContact CB-CZ3 3.84Å; F547-W558 HydrophobicContact CG-CH2 4.33Å; R548-W558 HydrophobicContact CG-CG 4.42Å; A551-W558 HydrophobicContact CB-CB 3.99Å; A551-W558 HydrophobicContact CB-CD2 4.24Å; A551-W558 HydrophobicContact CB-CE3 3.62Å; A551-W558 HydrophobicContact CB-CG 4.42Å; A551-W558 HydrophobicContact CB-CZ3 4.48Å; L556-W558 PolarHBondContact O-N 2.82Å; L556-W558 VanDerWaalsContact O-N 3.13Å; W558-D560 VanDerWaalsContact CD1-OD1 3.26Å; W558-D560 PolarHBondContact NE1-OD1 2.83Å; W558-D560 PolarHBondContact O-N 3Å; W558-N563 HydrophobicContact CZ2-CB 4.5Å; W558-N563 WeakPolarHBondContact CZ2-ND2 3.19Å
559	D	70.8	Confident	73.8	Confident	78 Å²	78	98.7 Å²	98.7	42%	0.417	52%	0.521	S	S	.	.			trans	-80.1	109.7	174.2	-161.8	-16.2	0	0	0	109.9	E561 E562	D559-E561 PolarHBondContact O-N 3.31Å; D559-E561 WeakPolarHBondContact OD1-CB 3.39Å; D559-E561 PolarHBondContact OD1-N 3.03Å; D559-E562 HydrophobicContact CB-CB 4.38Å; D559-E562 HydrophobicContact CB-CG 4.49Å
560	D	65.9	Low	73.6	Confident	66 Å²	66	100.7 Å²	100.7	35%	0.353	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-27.2	174.8	-77.9	-42.7	0	0	0	110.9	R548 W558 T564	R548-D560 IonicContact CZ-OD1 2.66Å; R548-D560 IonicContact CZ-OD2 3.49Å; R548-D560 VanDerWaalsContact CZ-OD2 3.23Å; R548-D560 IonicContact NE-OD1 3.84Å; R548-D560 PolarHBondContact NE-OD1 2.81Å; R548-D560 IonicContact NE-OD2 3.32Å; R548-D560 PolarHBondContact NE-OD2 3.38Å; R548-D560 IonicContact NH2-OD1 2.99Å; R548-D560 IonicContact NH2-OD2 2.62Å; R548-D560 PolarHBondContact NH2-OD2 2.9Å; W558-D560 VanDerWaalsContact CD1-OD1 3.26Å; W558-D560 PolarHBondContact NE1-OD1 2.83Å; W558-D560 PolarHBondContact O-N 3Å; D560-T564 PolarHBondContact O-N 3.25Å; D560-T564 PolarHBondContact O-OG1 3.35Å
561	E	57.9	Low	73.5	Confident	162 Å²	162	102.3 Å²	102.3	76%	0.757	53%	0.534	S	S	*	.	H	α-helix	trans	-75	-46.5	-175.4	-63	-168.8	168.1	0	0	112.1	D559 N563 T564	D559-E561 PolarHBondContact O-N 3.31Å; D559-E561 WeakPolarHBondContact OD1-CB 3.39Å; D559-E561 PolarHBondContact OD1-N 3.03Å; E561-N563 PolarHBondContact O-N 3.18Å; E561-T564 PolarHBondContact O-N 2.85Å
562	E	56	Low	73.2	Confident	154 Å²	154	104.6 Å²	104.6	72%	0.72	54%	0.54	S	S	*	.	H	α-helix	trans	-61.3	-30.4	177.9	-77.8	-166.9	162.3	0	0	112.9	D559	D559-E562 HydrophobicContact CB-CB 4.38Å; D559-E562 HydrophobicContact CB-CG 4.49Å
563	N	52.5	Low	73.2	Confident	79 Å²	79	105.5 Å²	105.5	42%	0.422	54%	0.544	S	S	.	.	H	α-helix	trans	-96.9	-9.1	-176.3	-95.5	-41.7	0	0	0	115	K544 W558 E561 N568	K544-N563 PolarHBondContact NZ-O 2.8Å; W558-N563 HydrophobicContact CZ2-CB 4.5Å; W558-N563 WeakPolarHBondContact CZ2-ND2 3.19Å; E561-N563 PolarHBondContact O-N 3.18Å; N563-N568 PolarHBondContact O-ND2 3.09Å
564	T	58.5	Low	73.2	Confident	83 Å²	83	104 Å²	104	51%	0.509	54%	0.537	S	S	.	.	S	Bend	trans	-105.9	50.6	167	46.6	0	0	0	0	111.2	D560 E561 E566	D560-T564 PolarHBondContact O-N 3.25Å; D560-T564 PolarHBondContact O-OG1 3.35Å; E561-T564 PolarHBondContact O-N 2.85Å; T564-E566 PolarHBondContact O-N 2.88Å
565	T	59.2	Low	73.2	Confident	59 Å²	59	102.8 Å²	102.8	36%	0.362	52%	0.522	S	S	.	.			trans	-43.9	138.6	165.8	52	0	0	0	0	111.1	Q567 N568 S569	T565-Q567 PolarHBondContact O-N 3.04Å; T565-N568 WeakPolarHBondContact O-CB 3.4Å; T565-N568 PolarHBondContact O-N 3.26Å; T565-N568 PolarHBondContact OG1-ND2 3.37Å; T565-S569 PolarHBondContact O-N 2.94Å
566	E	61	Low	73.4	Confident	166 Å²	166	103.2 Å²	103.2	78%	0.776	51%	0.512	S	S	*	.	H	α-helix	trans	-48.3	-37.3	176.5	-71.2	-175.9	148.5	0	0	111.5	T564 N568 S569 E570	T564-E566 PolarHBondContact O-N 2.88Å; E566-N568 VanDerWaalsContact C-N 3.34Å; E566-N568 PolarHBondContact O-N 3.18Å; E566-S569 WeakPolarHBondContact O-CA 3.24Å; E566-S569 WeakPolarHBondContact O-CB 3.44Å; E566-S569 PolarHBondContact O-N 3.45Å; E566-S569 PolarHBondContact O-OG 2.86Å; E566-E570 PolarHBondContact O-N 3.31Å
567	Q	64.7	Low	73.7	Confident	143 Å²	143	100.5 Å²	100.5	67%	0.668	51%	0.505	S	S	*	.	H	α-helix	trans	-51.2	-44.9	172.2	-65.4	179.9	-8.3	0	0	113.3	T565 S569 E570 V571	T565-Q567 PolarHBondContact O-N 3.04Å; Q567-S569 VanDerWaalsContact C-N 3.29Å; Q567-S569 PolarHBondContact O-N 3.42Å; Q567-E570 PolarHBondContact O-N 3.27Å; Q567-V571 VanDerWaalsContact O-CG2 3.26Å; Q567-V571 WeakPolarHBondContact O-CG2 3.28Å; Q567-V571 PolarHBondContact O-N 3.4Å
568	N	73.1	Confident	74.4	Confident	58 Å²	58	98.8 Å²	98.8	31%	0.31	48%	0.482	S	S	.	.	H	α-helix	trans	-66	-33.5	177.4	-81	-35.1	0	0	0	112.3	K544 N563 T565 E566 R572	K544-N568 PolarHBondContact NZ-ND2 2.81Å; K544-N568 VanDerWaalsContact NZ-ND2 3.16Å; N563-N568 PolarHBondContact O-ND2 3.09Å; T565-N568 WeakPolarHBondContact O-CB 3.4Å; T565-N568 PolarHBondContact O-N 3.26Å; T565-N568 PolarHBondContact OG1-ND2 3.37Å; E566-N568 VanDerWaalsContact C-N 3.34Å; E566-N568 PolarHBondContact O-N 3.18Å; N568-R572 WeakPolarHBondContact O-CB 3.35Å; N568-R572 WeakPolarHBondContact O-CD 3.43Å; N568-R572 VanDerWaalsContact O-CG 3.24Å; N568-R572 WeakPolarHBondContact O-CG 3.32Å; N568-R572 PolarHBondContact O-N 3.31Å
569	S	75.7	Confident	75.3	Confident	56 Å²	56	95.7 Å²	95.7	39%	0.392	47%	0.472	S	S	.	.	H	α-helix	trans	-70.3	-39.7	177.4	87.7	0	0	0	0	111	T565 E566 Q567 R572 K573	T565-S569 PolarHBondContact O-N 2.94Å; E566-S569 WeakPolarHBondContact O-CA 3.24Å; E566-S569 WeakPolarHBondContact O-CB 3.44Å; E566-S569 PolarHBondContact O-N 3.45Å; E566-S569 PolarHBondContact O-OG 2.86Å; Q567-S569 VanDerWaalsContact C-N 3.29Å; Q567-S569 PolarHBondContact O-N 3.42Å; S569-R572 PolarHBondContact O-N 3.28Å; S569-K573 WeakPolarHBondContact O-CG 3.5Å; S569-K573 PolarHBondContact O-N 3.43Å
570	E	82.4	Confident	76.5	Confident	134 Å²	134	94.7 Å²	94.7	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-69.3	-47.6	-179.2	-166.7	159.4	-150.8	0	0	111.3	E566 Q567 R572 K573 E574	E566-E570 PolarHBondContact O-N 3.31Å; Q567-E570 PolarHBondContact O-N 3.27Å; E570-R572 PolarHBondContact O-N 2.77Å; E570-K573 WeakPolarHBondContact O-CB 3.26Å; E570-K573 PolarHBondContact O-N 2.8Å; E570-E574 PolarHBondContact O-N 3.08Å
571	V	84.5	Confident	77.9	Confident	70 Å²	70	95.1 Å²	95.1	42%	0.424	47%	0.473	S	S	.	.	H	α-helix	trans	-56	-39.5	173	172.1	0	0	0	0	111.3	Q567 E574 L575	Q567-V571 VanDerWaalsContact O-CG2 3.26Å; Q567-V571 WeakPolarHBondContact O-CG2 3.28Å; Q567-V571 PolarHBondContact O-N 3.4Å; V571-E574 PolarHBondContact O-N 3.33Å; V571-L575 HydrophobicContact CG1-CD1 4.1Å; V571-L575 HydrophobicContact CG1-CG 4.43Å; V571-L575 WeakPolarHBondContact O-CB 3.33Å; V571-L575 VanDerWaalsContact O-CG 3.27Å; V571-L575 WeakPolarHBondContact O-CG 3.43Å; V571-L575 PolarHBondContact O-N 2.94Å
572	R	82.7	Confident	79.7	Confident	57 Å²	57	87.4 Å²	87.4	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-68.7	-36.1	176.7	-76.8	171.3	175	-177.4	-0	112.9	N568 S569 E570 R576	N568-R572 WeakPolarHBondContact O-CB 3.35Å; N568-R572 WeakPolarHBondContact O-CD 3.43Å; N568-R572 VanDerWaalsContact O-CG 3.24Å; N568-R572 WeakPolarHBondContact O-CG 3.32Å; N568-R572 PolarHBondContact O-N 3.31Å; S569-R572 PolarHBondContact O-N 3.28Å; E570-R572 PolarHBondContact O-N 2.77Å; R572-R576 VanDerWaalsContact O-CG 3.31Å; R572-R576 WeakPolarHBondContact O-CG 3.49Å; R572-R576 PolarHBondContact O-N 3.34Å; R572-R576 VanDerWaalsContact O-N 3.17Å
573	K	85.8	Confident	81.5	Confident	146 Å²	146	84 Å²	84	64%	0.635	42%	0.421	S	S	*	.	H	α-helix	trans	-67	-44.3	175.1	-73.6	175.1	-176.7	174.5	0	109.9	S569 E570 R576 A577	S569-K573 WeakPolarHBondContact O-CG 3.5Å; S569-K573 PolarHBondContact O-N 3.43Å; E570-K573 WeakPolarHBondContact O-CB 3.26Å; E570-K573 PolarHBondContact O-N 2.8Å; K573-R576 PolarHBondContact O-N 2.85Å; K573-A577 PolarHBondContact O-N 3.33Å
574	E	90.1	Very high	83.5	Confident	139 Å²	139	86.7 Å²	86.7	65%	0.65	43%	0.431	S	S	*	.	H	α-helix	trans	-60.6	-47.7	176.8	-171.8	-177.8	-176.7	0	0	111.9	E570 V571 R576 A577 R578	E570-E574 PolarHBondContact O-N 3.08Å; V571-E574 PolarHBondContact O-N 3.33Å; E574-R576 VanDerWaalsContact C-N 3.32Å; E574-R576 PolarHBondContact O-N 2.92Å; E574-A577 PolarHBondContact O-N 3.34Å; E574-R578 WeakPolarHBondContact O-CB 3.38Å; E574-R578 PolarHBondContact O-N 3.34Å
575	L	90.5	Very high	85.2	Confident	35 Å²	35	89.6 Å²	89.6	18%	0.183	43%	0.433	C	S	.	.	H	α-helix	trans	-61.6	-38	177.1	-71.6	175.1	0	0	0	112.5	I533 V537 V571 R578 V579	I533-L575 HydrophobicContact CG2-CB 4.17Å; I533-L575 HydrophobicContact CG2-CD2 4.01Å; V537-L575 HydrophobicContact CG2-CB 4.46Å; V537-L575 HydrophobicContact CG2-CD1 3.87Å; V571-L575 HydrophobicContact CG1-CD1 4.1Å; V571-L575 HydrophobicContact CG1-CG 4.43Å; V571-L575 WeakPolarHBondContact O-CB 3.33Å; V571-L575 VanDerWaalsContact O-CG 3.27Å; V571-L575 WeakPolarHBondContact O-CG 3.43Å; V571-L575 PolarHBondContact O-N 2.94Å; L575-R578 PolarHBondContact O-N 3.16Å; L575-V579 WeakPolarHBondContact O-CG2 3.44Å; L575-V579 PolarHBondContact O-N 3.26Å
576	R	90.3	Very high	86.9	Confident	162 Å²	162	87.1 Å²	87.1	61%	0.611	42%	0.417	S	S	*	.	H	α-helix	trans	-67.2	-42.5	174.6	-73.8	-179.3	-144.7	176.5	6.4	112	R572 K573 E574 R578 V579 S580	R572-R576 VanDerWaalsContact O-CG 3.31Å; R572-R576 WeakPolarHBondContact O-CG 3.49Å; R572-R576 PolarHBondContact O-N 3.34Å; R572-R576 VanDerWaalsContact O-N 3.17Å; K573-R576 PolarHBondContact O-N 2.85Å; E574-R576 VanDerWaalsContact C-N 3.32Å; E574-R576 PolarHBondContact O-N 2.92Å; R576-R578 VanDerWaalsContact C-N 3.29Å; R576-R578 PolarHBondContact O-N 2.97Å; R576-V579 PolarHBondContact O-N 3.02Å; R576-S580 PolarHBondContact O-N 3.46Å
577	A	92.5	Very high	88.4	Confident	53 Å²	53	83.2 Å²	83.2	44%	0.438	40%	0.401	S	S	.	.	H	α-helix	trans	-60.9	-42.4	175.2	0	0	0	0	0	110.7	K573 E574 S580 I581	K573-A577 PolarHBondContact O-N 3.33Å; E574-A577 PolarHBondContact O-N 3.34Å; A577-S580 WeakPolarHBondContact O-CB 3.43Å; A577-S580 PolarHBondContact O-N 2.89Å; A577-I581 WeakPolarHBondContact O-CG1 3.45Å; A577-I581 PolarHBondContact O-N 3.34Å
578	R	93.3	Very high	89.6	Confident	93 Å²	93	77.8 Å²	77.8	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-61.1	-46.9	175.5	-178	59.9	180	-174	1.8	112.4	E529 I533 E574 L575 R576 S580 I581 L582	E529-R578 IonicContact OE1-CZ 2.73Å; E529-R578 IonicContact OE1-NE 2.71Å; E529-R578 PolarHBondContact OE1-NE 2.99Å; E529-R578 IonicContact OE1-NH2 3.93Å; E529-R578 PolarHBondContact OE1-NH2 3.45Å; E529-R578 IonicContact OE2-NH2 3.8Å; I533-R578 HydrophobicContact CD1-CG 3.95Å; E574-R578 WeakPolarHBondContact O-CB 3.38Å; E574-R578 PolarHBondContact O-N 3.34Å; L575-R578 PolarHBondContact O-N 3.16Å; R576-R578 VanDerWaalsContact C-N 3.29Å; R576-R578 PolarHBondContact O-N 2.97Å; R578-S580 VanDerWaalsContact C-N 3.33Å; R578-S580 PolarHBondContact O-N 3.24Å; R578-I581 PolarHBondContact O-N 3.05Å; R578-L582 HydrophobicContact CG-CD1 4.16Å; R578-L582 WeakPolarHBondContact O-CG 3.38Å; R578-L582 PolarHBondContact O-N 2.9Å
579	V	94.3	Very high	90.4	Very high	17 Å²	17	77.1 Å²	77.1	10%	0.103	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-45.8	175.8	168.1	0	0	0	0	110.8	I530 I533 L575 R576 I581 L582 E583	I530-V579 HydrophobicContact CG2-CG1 4.1Å; I533-V579 HydrophobicContact CB-CG2 3.97Å; I533-V579 HydrophobicContact CD1-CG2 4.33Å; I533-V579 HydrophobicContact CG2-CG2 3.52Å; L575-V579 WeakPolarHBondContact O-CG2 3.44Å; L575-V579 PolarHBondContact O-N 3.26Å; R576-V579 PolarHBondContact O-N 3.02Å; V579-I581 VanDerWaalsContact C-N 3.35Å; V579-I581 PolarHBondContact O-N 2.79Å; V579-L582 PolarHBondContact O-N 2.8Å; V579-L582 VanDerWaalsContact O-N 3.16Å; V579-E583 HydrophobicContact CG1-CG 4.2Å; V579-E583 WeakPolarHBondContact O-CG 3.32Å; V579-E583 PolarHBondContact O-N 2.91Å
580	S	94.8	Very high	91	Very high	57 Å²	57	75.8 Å²	75.8	40%	0.399	37%	0.366	S	S	.	.	H	α-helix	trans	-57.8	-44.3	177.4	-176.3	0	0	0	0	112.5	R576 A577 R578 L582 E583 Q584	R576-S580 PolarHBondContact O-N 3.46Å; A577-S580 WeakPolarHBondContact O-CB 3.43Å; A577-S580 PolarHBondContact O-N 2.89Å; R578-S580 VanDerWaalsContact C-N 3.33Å; R578-S580 PolarHBondContact O-N 3.24Å; S580-L582 PolarHBondContact O-N 3.38Å; S580-E583 PolarHBondContact O-N 3.02Å; S580-Q584 WeakPolarHBondContact O-CG 3.25Å; S580-Q584 PolarHBondContact O-N 2.91Å
581	I	95.8	Very high	91	Very high	74 Å²	74	78.5 Å²	78.5	38%	0.379	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-43.7	176.4	-66.6	165.8	0	0	0	111.2	A577 R578 V579 Q584 R585	A577-I581 WeakPolarHBondContact O-CG1 3.45Å; A577-I581 PolarHBondContact O-N 3.34Å; R578-I581 PolarHBondContact O-N 3.05Å; V579-I581 VanDerWaalsContact C-N 3.35Å; V579-I581 PolarHBondContact O-N 2.79Å; I581-Q584 PolarHBondContact O-N 2.87Å; I581-R585 WeakPolarHBondContact O-CG 3.39Å; I581-R585 PolarHBondContact O-N 3.49Å
582	L	95.7	Very high	90.3	Very high	1 Å²	1	82.1 Å²	82.1	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-66.9	-39.2	179.3	-67.9	170.4	0	0	0	111.8	L526 E529 I530 I533 R578 V579 S580 Q584 R585 L586	L526-L582 HydrophobicContact CD2-CD2 3.73Å; E529-L582 HydrophobicContact CB-CD1 4.17Å; E529-L582 HydrophobicContact CG-CD1 3.71Å; I530-L582 HydrophobicContact CD1-CB 3.81Å; I530-L582 HydrophobicContact CG1-CB 3.5Å; I530-L582 VanDerWaalsContact CG1-CB 3.5Å; I530-L582 HydrophobicContact CG1-CD1 4Å; I530-L582 HydrophobicContact CG1-CG 4.41Å; I533-L582 HydrophobicContact CD1-CD1 3.9Å; R578-L582 HydrophobicContact CG-CD1 4.16Å; R578-L582 WeakPolarHBondContact O-CG 3.38Å; R578-L582 PolarHBondContact O-N 2.9Å; V579-L582 PolarHBondContact O-N 2.8Å; V579-L582 VanDerWaalsContact O-N 3.16Å; S580-L582 PolarHBondContact O-N 3.38Å; L582-Q584 VanDerWaalsContact C-N 3.34Å; L582-R585 PolarHBondContact O-N 3.28Å; L582-L586 WeakPolarHBondContact O-CB 3.3Å; L582-L586 PolarHBondContact O-N 3.28Å
583	E	94.6	Very high	89.3	Confident	83 Å²	83	82.4 Å²	82.4	39%	0.388	39%	0.388	S	S	.	.	H	α-helix	trans	-63	-40.6	175.4	-75.1	-178.9	156.6	0	0	111.5	I530 V579 S580 L586 L587	I530-E583 HydrophobicContact CD1-CG 3.85Å; V579-E583 HydrophobicContact CG1-CG 4.2Å; V579-E583 WeakPolarHBondContact O-CG 3.32Å; V579-E583 PolarHBondContact O-N 2.91Å; S580-E583 PolarHBondContact O-N 3.02Å; E583-L586 PolarHBondContact O-N 2.77Å; E583-L587 WeakPolarHBondContact O-CB 3.19Å; E583-L587 PolarHBondContact O-N 2.7Å
584	Q	94.3	Very high	87.8	Confident	134 Å²	134	82 Å²	82	63%	0.626	39%	0.393	S	S	*	.	H	α-helix	trans	-63.3	-42.5	173.9	-73.4	-179.6	-8	0	0	112.3	S580 I581 L582 L587 G588	S580-Q584 WeakPolarHBondContact O-CG 3.25Å; S580-Q584 PolarHBondContact O-N 2.91Å; I581-Q584 PolarHBondContact O-N 2.87Å; L582-Q584 VanDerWaalsContact C-N 3.34Å; Q584-L587 PolarHBondContact O-N 3.13Å; Q584-G588 PolarHBondContact O-N 2.84Å
585	R	94.4	Very high	85.8	Confident	145 Å²	145	85 Å²	85	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-45.7	174.9	-71.2	178.5	-176.4	-165.5	-1.8	111.5	L526 I581 L582 L587 G588 E589	L526-R585 HydrophobicContact CD1-CB 3.89Å; L526-R585 HydrophobicContact CD2-CB 4.33Å; I581-R585 WeakPolarHBondContact O-CG 3.39Å; I581-R585 PolarHBondContact O-N 3.49Å; L582-R585 PolarHBondContact O-N 3.28Å; R585-L587 VanDerWaalsContact C-N 3.29Å; R585-L587 PolarHBondContact O-N 3.27Å; R585-G588 WeakPolarHBondContact O-CA 3.1Å; R585-G588 PolarHBondContact O-N 2.79Å; R585-G588 VanDerWaalsContact O-N 3.1Å; R585-E589 PolarHBondContact O-N 3.4Å
586	L	93.9	Very high	84.1	Confident	7 Å²	7	86 Å²	86	4%	0.037	41%	0.41	C	S	.	.	H	α-helix	trans	-62.5	-38	178.1	-178.9	59.9	0	0	0	111.5	L405 R523 L526 A527 I530 L582 E583 G588 E589 F590	L405-L586 HydrophobicContact CD2-CD1 4.49Å; R523-L586 HydrophobicContact CB-CD1 4.08Å; R523-L586 HydrophobicContact CG-CD1 4.37Å; R523-L586 WeakPolarHBondContact O-CD1 3.22Å; L526-L586 HydrophobicContact CB-CB 4.28Å; L526-L586 HydrophobicContact CB-CD1 4.28Å; L526-L586 HydrophobicContact CD1-CB 4.28Å; A527-L586 HydrophobicContact CB-CD2 4.03Å; I530-L586 HydrophobicContact CD1-CD2 4.08Å; L582-L586 WeakPolarHBondContact O-CB 3.3Å; L582-L586 PolarHBondContact O-N 3.28Å; E583-L586 PolarHBondContact O-N 2.77Å; L586-G588 VanDerWaalsContact C-N 3.33Å; L586-E589 PolarHBondContact O-N 3.48Å; L586-F590 HydrophobicContact CD1-CE2 4.04Å; L586-F590 HydrophobicContact CD1-CZ 4.12Å; L586-F590 HydrophobicContact CD2-CE2 4.41Å; L586-F590 HydrophobicContact CG-CD2 4.5Å; L586-F590 HydrophobicContact CG-CE2 3.78Å; L586-F590 HydrophobicContact CG-CZ 4.29Å; L586-F590 WeakPolarHBondContact O-CD2 3.46Å; L586-F590 PolarHBondContact O-N 2.85Å
587	L	92.1	Very high	82.2	Confident	84 Å²	84	82.6 Å²	82.6	44%	0.44	42%	0.416	S	S	.	.	H	α-helix	trans	-64.5	-37.4	173.9	-174	62.7	0	0	0	112.3	E583 Q584 R585 F590	E583-L587 WeakPolarHBondContact O-CB 3.19Å; E583-L587 PolarHBondContact O-N 2.7Å; Q584-L587 PolarHBondContact O-N 3.13Å; R585-L587 VanDerWaalsContact C-N 3.29Å; R585-L587 PolarHBondContact O-N 3.27Å; L587-F590 PolarHBondContact O-N 3.04Å
588	G	91.4	Very high	80.3	Confident	28 Å²	28	84.2 Å²	84.2	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-47.4	172.2	0	0	0	0	0	112.3	Q584 R585 L586 F590 R591 E592	Q584-G588 PolarHBondContact O-N 2.84Å; R585-G588 WeakPolarHBondContact O-CA 3.1Å; R585-G588 PolarHBondContact O-N 2.79Å; R585-G588 VanDerWaalsContact O-N 3.1Å; L586-G588 VanDerWaalsContact C-N 3.33Å; G588-F590 PolarHBondContact O-N 3.23Å; G588-R591 PolarHBondContact O-N 3.08Å; G588-E592 PolarHBondContact O-N 3.14Å
589	E	89.3	Confident	78.5	Confident	44 Å²	44	82.3 Å²	82.3	21%	0.206	43%	0.429	C	S	.	.	H	α-helix	trans	-59.9	-27.8	178.8	-69.1	-69.5	146.4	0	0	113.9	V522 R523 L526 R585 L586	V522-E589 HydrophobicContact CG1-CG 4.05Å; V522-E589 WeakPolarHBondContact CG1-OE1 3.32Å; R523-E589 HydrophobicContact CG-CB 3.69Å; R523-E589 HydrophobicContact CG-CG 4.38Å; R523-E589 PolarHBondContact NE-O 3.15Å; R523-E589 VanDerWaalsContact NE-O 3.09Å; R523-E589 PolarHBondContact NH2-O 2.86Å; L526-E589 HydrophobicContact CD1-CG 4.02Å; R585-E589 PolarHBondContact O-N 3.4Å; L586-E589 PolarHBondContact O-N 3.48Å
590	F	87.9	Confident	76.3	Confident	29 Å²	29	92.1 Å²	92.1	13%	0.127	47%	0.47	C	S	.	.	H	α-helix	trans	-70.5	-38.5	174.3	-71.6	-54.8	0	0	0	112.2	N406 L586 L587 G588 E592	N406-F590 HydrophobicContact CB-CZ 4.35Å; N406-F590 WeakPolarHBondContact ND2-CD2 3.39Å; N406-F590 WeakPolarHBondContact ND2-CE2 2.82Å; L586-F590 HydrophobicContact CD1-CE2 4.04Å; L586-F590 HydrophobicContact CD1-CZ 4.12Å; L586-F590 HydrophobicContact CD2-CE2 4.41Å; L586-F590 HydrophobicContact CG-CD2 4.5Å; L586-F590 HydrophobicContact CG-CE2 3.78Å; L586-F590 HydrophobicContact CG-CZ 4.29Å; L586-F590 WeakPolarHBondContact O-CD2 3.46Å; L586-F590 PolarHBondContact O-N 2.85Å; L587-F590 PolarHBondContact O-N 3.04Å; G588-F590 PolarHBondContact O-N 3.23Å; F590-E592 PolarHBondContact O-N 2.8Å
591	R	82.4	Confident	74.3	Confident	190 Å²	190	92.1 Å²	92.1	72%	0.717	47%	0.47	S	S	*	.	H	α-helix	trans	-70.5	-28.4	-175.5	-65.2	177.5	-178.8	-179.7	0	113.8	G588	G588-R591 PolarHBondContact O-N 3.08Å
592	E	70.4	Confident	72.6	Confident	147 Å²	147	94.5 Å²	94.5	69%	0.687	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-17.6	-173.3	-68	-174.9	175	0	0	114.3	G588 F590	G588-E592 PolarHBondContact O-N 3.14Å; F590-E592 PolarHBondContact O-N 2.8Å
593	N	61	Low	71	Confident	63 Å²	63	95.7 Å²	95.7	34%	0.337	48%	0.482	S	S	.	.			trans	-136.2	40.1	-163.7	-81.7	-46.1	0	0	0	114.5	F595	N593-F595 VanDerWaalsContact C-N 3.27Å; N593-F595 PolarHBondContact O-N 3.07Å
594	D	54.5	Low	69	Low	136 Å²	136	93.5 Å²	93.5	73%	0.727	48%	0.475	S	S	*	.			trans	-75.7	-3.4	-178.9	-87.4	-22.5	0	0	0	115.4	D596	D594-D596 PolarHBondContact O-N 3.39Å
595	F	48.8	Very low	66.9	Low	204 Å²	204	90.2 Å²	90.2	90%	0.895	46%	0.462	S	S	*	.			trans	-96.3	74.6	178.8	-74.7	-82.8	0	0	0	112.7	N593	N593-F595 VanDerWaalsContact C-N 3.27Å; N593-F595 PolarHBondContact O-N 3.07Å
596	D	54.4	Low	64.5	Low	56 Å²	56	93.4 Å²	93.4	30%	0.299	48%	0.48	S	S	.	.			trans	-96.7	105.3	162.6	-86.9	-39.6	0	0	0	110.3	K380 K519 Y520 D594 A598	K380-D596 VanDerWaalsContact NZ-CG 3.32Å; K380-D596 IonicContact NZ-OD1 3.7Å; K380-D596 PolarHBondContact NZ-OD1 3.35Å; K380-D596 IonicContact NZ-OD2 3.85Å; K519-D596 IonicContact NZ-OD1 3.72Å; Y520-D596 VanDerWaalsContact OH-CG 3.26Å; Y520-D596 PolarHBondContact OH-OD1 3.05Å; Y520-D596 PolarHBondContact OH-OD2 3.3Å; D594-D596 PolarHBondContact O-N 3.39Å; D596-A598 PolarHBondContact O-N 3.12Å
597	A	49.9	Very low	61.7	Low	90 Å²	90	98.5 Å²	98.5	74%	0.744	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-60.7	127.9	169.6	0	0	0	0	0	109.7
598	A	54.2	Low	59	Low	86 Å²	86	103.7 Å²	103.7	71%	0.711	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-59.4	141.8	176.7	0	0	0	0	0	110.7	D596	D596-A598 PolarHBondContact O-N 3.12Å
599	P	54.3	Low	56.5	Low	53 Å²	53	106.9 Å²	106.9	34%	0.344	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-60	142.5	-180	21.9	-30.9	0	0	0	111.8	K380 Y381 S601	K380-P599 WeakPolarHBondContact O-CD 3.35Å; Y381-P599 HydrophobicContact CD1-CG 4.13Å; Y381-P599 HydrophobicContact CE1-CB 4.34Å; Y381-P599 HydrophobicContact CE1-CG 3.89Å; P599-S601 PolarHBondContact O-N 3.03Å
600	K	47.9	Very low	54.2	Low	224 Å²	224	111.2 Å²	111.2	97%	0.974	56%	0.564	S	S	*	*	S	Bend	trans	-64.2	-19.1	-177.5	-68.5	-176.5	179.3	179.2	0	114.1
601	S	53.6	Low	51.9	Low	56 Å²	56	112.3 Å²	112.3	39%	0.392	57%	0.574	S	S	.	*	S	Bend	trans	-130.6	154.6	174.9	67.3	0	0	0	0	110.1	P599 Y603	P599-S601 PolarHBondContact O-N 3.03Å; S601-Y603 PolarHBondContact O-N 3.47Å; S601-Y603 VanDerWaalsContact OG-C 3.24Å; S601-Y603 PolarHBondContact OG-O 2.92Å
602	K	60.7	Low	50.1	Low	124 Å²	124	105 Å²	105	54%	0.539	55%	0.549	S	S	.	.	S	Bend	trans	-58.9	-36.4	179.5	-167.4	175.4	-178.2	-178.3	0	111.8	D452	D452-K602 IonicContact OD1-NZ 2.77Å; D452-K602 PolarHBondContact OD1-NZ 3.42Å; D452-K602 VanDerWaalsContact OD1-NZ 3.16Å
603	Y	61.6	Low	48.9	Very low	27 Å²	27	104.3 Å²	104.3	11%	0.106	55%	0.55	C	S	.	.	S	Bend	trans	-140.1	133	168.1	-53	-64.7	0	0	0	109	D452 H453 L481 S601 L605	D452-Y603 PolarHBondContact O-OH 3.16Å; H453-Y603 AromaticContact CD2-CE1 3.6Å; H453-Y603 AromaticContact CD2-CZ 3.82Å; H453-Y603 PolarHBondContact CD2-OH 2.87Å; H453-Y603 AromaticContact NE2-CE1 3.48Å; H453-Y603 WeakPolarHBondContact NE2-CE1 3.38Å; H453-Y603 AromaticContact NE2-CZ 3.8Å; H453-Y603 PolarHBondContact NE2-OH 3.15Å; L481-Y603 HydrophobicContact CB-CD1 4.25Å; L481-Y603 HydrophobicContact CB-CE1 3.74Å; L481-Y603 HydrophobicContact CB-CE2 4.31Å; L481-Y603 HydrophobicContact CD2-CD1 3.66Å; L481-Y603 HydrophobicContact CD2-CE1 3.7Å; L481-Y603 HydrophobicContact CG-CD1 4.49Å; L481-Y603 HydrophobicContact CG-CE1 4.36Å; S601-Y603 PolarHBondContact O-N 3.47Å; S601-Y603 VanDerWaalsContact OG-C 3.24Å; S601-Y603 PolarHBondContact OG-O 2.92Å; Y603-L605 VanDerWaalsContact C-N 3.33Å; Y603-L605 PolarHBondContact O-N 3.08Å
604	P	51.9	Low	48.4	Very low	36 Å²	36	104.8 Å²	104.8	23%	0.234	56%	0.563	C	S	.	*			trans	-75.5	89.2	170.9	29.6	-32.6	0	0	0	108.4	Y381 P511	Y381-P604 VanDerWaalsContact OH-CD 3.25Å; Y381-P604 WeakPolarHBondContact OH-CD 3.43Å; Y381-P604 WeakPolarHBondContact OH-CG 3.3Å; P511-P604 HydrophobicContact CG-CB 4.21Å; P511-P604 HydrophobicContact CG-CG 3.77Å; P511-P604 WeakPolarHBondContact CG-O 3.16Å
605	L	49.8	Very low	48	Very low	66 Å²	66	99.3 Å²	99.3	35%	0.346	53%	0.533	S	S	.	.			trans	-111.8	139.4	162.8	-64.9	150.6	0	0	0	105.3	T358 Y603	T358-L605 HydrophobicContact CG2-CD1 3.4Å; T358-L605 VanDerWaalsContact CG2-CD1 3.4Å; T358-L605 HydrophobicContact CG2-CD2 3.99Å; T358-L605 HydrophobicContact CG2-CG 4.31Å; Y603-L605 VanDerWaalsContact C-N 3.33Å; Y603-L605 PolarHBondContact O-N 3.08Å
606	F	44	Very low	47.5	Very low	212 Å²	212	94.9 Å²	94.9	93%	0.93	52%	0.516	S	S	*	.	S	Bend	trans	106.4	6.8	177.6	-51	-64.2	0	0	0	119.8
607	T	36.5	Very low	47.1	Very low	114 Å²	114	94.1 Å²	94.1	70%	0.699	51%	0.514	S	S	*	.	S	Bend	trans	-118	116.2	164.2	51.4	0	0	0	0	110.5
608	K	34.6	Very low	47	Very low	193 Å²	193	95.9 Å²	95.9	84%	0.839	50%	0.504	S	S	*	.			trans	-6.1	121	-179.2	-68.9	177.9	177.5	177.4	0	115.8	F610	K608-F610 PolarHBondContact O-N 2.87Å; K608-F610 VanDerWaalsContact O-N 3.14Å
609	P	39.2	Very low	47.1	Very low	95 Å²	95	93.4 Å²	93.4	62%	0.617	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-62.9	118	175.7	25.3	-30.9	0	0	0	109.9	L509	L509-P609 HydrophobicContact CB-CB 4.19Å
610	F	40.6	Very low	47.3	Very low	134 Å²	134	91.4 Å²	91.4	59%	0.588	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-93.8	133.3	172.6	175.5	-100.1	0	0	0	109.8	K514 K608	K514-F610 HydrophobicContact CD-CE1 3.82Å; K608-F610 PolarHBondContact O-N 2.87Å; K608-F610 VanDerWaalsContact O-N 3.14Å
611	T	39.8	Very low	47.7	Very low	53 Å²	53	83 Å²	83	33%	0.325	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-102.7	132.2	-178.5	47.5	0	0	0	0	109.9	L509 P617	L509-T611 HydrophobicContact CD1-CG2 3.71Å; T611-P617 VanDerWaalsContact CG2-CD 3.48Å; T611-P617 HydrophobicContact CG2-CG 3.35Å
612	D	44.2	Very low	47.8	Very low	35 Å²	35	82 Å²	82	19%	0.187	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-74.8	129.1	170.4	-159.9	-10.8	0	0	0	109.7	R369 K514 A614 D615 E616	R369-D612 IonicContact CZ-OD2 3.45Å; R369-D612 IonicContact NH1-OD2 3.57Å; R369-D612 IonicContact NH2-OD2 2.62Å; R369-D612 PolarHBondContact NH2-OD2 3.31Å; K514-D612 VanDerWaalsContact CE-OD1 3.26Å; K514-D612 WeakPolarHBondContact CE-OD1 3.2Å; K514-D612 VanDerWaalsContact CE-OD2 3.32Å; K514-D612 WeakPolarHBondContact CE-OD2 3.48Å; K514-D612 VanDerWaalsContact NZ-CG 3.29Å; K514-D612 IonicContact NZ-OD1 3.85Å; K514-D612 PolarHBondContact NZ-OD1 3.27Å; K514-D612 IonicContact NZ-OD2 3.72Å; D612-A614 PolarHBondContact O-N 3.46Å; D612-A614 VanDerWaalsContact O-N 3.11Å; D612-D615 HydrophobicContact CB-CB 4.31Å; D612-D615 CarbonylContact O-C 3.3Å; D612-D615 VanDerWaalsContact O-C 3.3Å; D612-D615 PolarHBondContact O-N 3.04Å; D612-E616 PolarHBondContact O-N 2.83Å
613	D	45.4	Very low	47.6	Very low	133 Å²	133	78 Å²	78	71%	0.711	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-58.3	-26.1	179.3	-60.9	-46.9	0	0	0	112.2
614	A	50.6	Low	47.1	Very low	74 Å²	74	81.5 Å²	81.5	61%	0.612	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-76.5	-25.9	174.7	0	0	0	0	0	113.9	D612	D612-A614 PolarHBondContact O-N 3.46Å; D612-A614 VanDerWaalsContact O-N 3.11Å
615	D	46.7	Very low	47.2	Very low	21 Å²	21	83.4 Å²	83.4	11%	0.112	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-114.3	24.9	-179.3	-66.7	-34.6	0	0	0	111.2	S365 R369 Y373 D612 P617	S365-D615 WeakPolarHBondContact CB-OD1 3.39Å; S365-D615 PolarHBondContact N-OD1 2.88Å; S365-D615 PolarHBondContact OG-OD1 3.36Å; R369-D615 IonicContact CZ-OD2 3.78Å; R369-D615 VanDerWaalsContact CZ-OD2 3.26Å; R369-D615 IonicContact NE-OD1 3.23Å; R369-D615 IonicContact NE-OD2 3.67Å; R369-D615 PolarHBondContact NE-OD2 3.41Å; R369-D615 IonicContact NH2-OD2 3.96Å; R369-D615 PolarHBondContact NH2-OD2 3.43Å; R369-D615 VanDerWaalsContact NH2-OD2 3.08Å; Y373-D615 PolarHBondContact OH-OD2 3.26Å; D612-D615 HydrophobicContact CB-CB 4.31Å; D612-D615 CarbonylContact O-C 3.3Å; D612-D615 VanDerWaalsContact O-C 3.3Å; D612-D615 PolarHBondContact O-N 3.04Å; D615-P617 WeakPolarHBondContact O-CD 3.27Å
616	E	38.5	Very low	47	Very low	111 Å²	111	88.2 Å²	88.2	52%	0.519	47%	0.47	S	S	.	.			trans	-41.2	112.7	-173.5	-157.5	-165.9	-150.9	0	0	110.8	D612 K618	D612-E616 PolarHBondContact O-N 2.83Å; E616-K618 PolarHBondContact O-N 2.79Å; E616-K618 WeakPolarHBondContact OE2-CE 3.35Å; E616-K618 IonicContact OE2-NZ 2.74Å
617	P	44.4	Very low	47	Very low	40 Å²	40	81.2 Å²	81.2	26%	0.26	46%	0.458	S	S	.	.			trans	-76.9	80.8	174.3	30.8	-29.4	0	0	0	105.9	F363 L509 T611 D615 S619	F363-P617 HydrophobicContact CD2-CB 4.06Å; F363-P617 HydrophobicContact CE2-CB 3.97Å; L509-P617 HydrophobicContact CD1-CG 3.84Å; T611-P617 VanDerWaalsContact CG2-CD 3.48Å; T611-P617 HydrophobicContact CG2-CG 3.35Å; D615-P617 WeakPolarHBondContact O-CD 3.27Å; P617-S619 PolarHBondContact O-N 3.2Å
618	K	49.1	Very low	47	Very low	126 Å²	126	79.1 Å²	79.1	55%	0.548	46%	0.459	S	S	.	.			trans	-59.6	94.4	147.7	-66.5	-177	-170.9	179.4	0	103.1	E616 A620 A623	E616-K618 PolarHBondContact O-N 2.79Å; E616-K618 WeakPolarHBondContact OE2-CE 3.35Å; E616-K618 IonicContact OE2-NZ 2.74Å; K618-A620 WeakPolarHBondContact O-CA 3.42Å; K618-A620 PolarHBondContact O-N 3.03Å; K618-A623 HydrophobicContact CB-CB 4.29Å
619	S	55.2	Low	47.1	Very low	35 Å²	35	74.2 Å²	74.2	25%	0.245	45%	0.449	C	S	.	.			trans	-30.2	116.9	-176.9	151.8	0	0	0	0	106.5	D506 P617 I621 A622 A623	D506-S619 WeakPolarHBondContact OD2-CA 3.36Å; D506-S619 WeakPolarHBondContact OD2-CB 3.14Å; D506-S619 PolarHBondContact OD2-OG 3.06Å; P617-S619 PolarHBondContact O-N 3.2Å; S619-I621 CarbonylContact O-C 3.43Å; S619-I621 PolarHBondContact O-N 3.49Å; S619-A622 CarbonylContact O-C 3.55Å; S619-A622 WeakPolarHBondContact O-CA 3.47Å; S619-A622 PolarHBondContact O-N 3.21Å; S619-A622 PolarHBondContact OG-N 2.85Å; S619-A623 PolarHBondContact O-N 3.17Å
620	A	58.1	Low	46.9	Very low	10 Å²	10	75.3 Å²	75.3	8%	0.083	46%	0.458	C	S	.	.	H	α-helix	trans	-54.1	-29.4	-168.5	0	0	0	0	0	108.8	V491 Y494 R495 D506 K618	V491-A620 HydrophobicContact CG1-CB 4.34Å; Y494-A620 HydrophobicContact CD1-CB 4.32Å; Y494-A620 HydrophobicContact CE1-CB 4.16Å; R495-A620 HydrophobicContact CG-CB 4.2Å; R495-A620 PolarHBondContact NE-O 3.27Å; R495-A620 PolarHBondContact NH2-O 2.87Å; D506-A620 PolarHBondContact OD2-N 3.4Å; K618-A620 WeakPolarHBondContact O-CA 3.42Å; K618-A620 PolarHBondContact O-N 3.03Å
621	I	57.1	Low	46.7	Very low	48 Å²	48	72.4 Å²	72.4	25%	0.246	47%	0.467	C	S	.	.	H	α-helix	trans	-72.6	-51.6	173.8	-51.3	-178.6	0	0	0	111.7	C498 G504 S619 A623 Q624 A625	C498-I621 HydrophobicContact CB-CD1 3.86Å; G504-I621 WeakPolarHBondContact O-CD1 3.48Å; S619-I621 CarbonylContact O-C 3.43Å; S619-I621 PolarHBondContact O-N 3.49Å; I621-A623 VanDerWaalsContact C-N 3.31Å; I621-A623 PolarHBondContact O-N 3.06Å; I621-Q624 PolarHBondContact O-N 3.28Å; I621-Q624 VanDerWaalsContact O-N 3.07Å; I621-A625 PolarHBondContact O-N 2.82Å
622	A	56	Low	46.4	Very low	35 Å²	35	78.7 Å²	78.7	29%	0.289	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-30.5	177.2	0	0	0	0	0	114.3	S619 Q624 A625 R626	S619-A622 CarbonylContact O-C 3.55Å; S619-A622 WeakPolarHBondContact O-CA 3.47Å; S619-A622 PolarHBondContact O-N 3.21Å; S619-A622 PolarHBondContact OG-N 2.85Å; A622-Q624 PolarHBondContact O-N 2.82Å; A622-A625 PolarHBondContact O-N 3.22Å; A622-R626 PolarHBondContact O-N 3.48Å; A622-R626 VanDerWaalsContact O-N 3.11Å
623	A	56.1	Low	46.2	Very low	41 Å²	41	81.3 Å²	81.3	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-29.6	174.5	0	0	0	0	0	111.9	K618 S619 I621 G627	K618-A623 HydrophobicContact CB-CB 4.29Å; S619-A623 PolarHBondContact O-N 3.17Å; I621-A623 VanDerWaalsContact C-N 3.31Å; I621-A623 PolarHBondContact O-N 3.06Å; A623-G627 PolarHBondContact O-N 2.8Å
624	Q	51.9	Low	46.1	Very low	99 Å²	99	84.1 Å²	84.1	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-81.5	-38.8	173.9	-172.2	176.8	-4.3	0	0	112.3	I621 A622 R626 G627 G628	I621-Q624 PolarHBondContact O-N 3.28Å; I621-Q624 VanDerWaalsContact O-N 3.07Å; A622-Q624 PolarHBondContact O-N 2.82Å; Q624-R626 PolarHBondContact O-N 2.64Å; Q624-G627 WeakPolarHBondContact O-CA 2.98Å; Q624-G627 PolarHBondContact O-N 3.46Å; Q624-G628 PolarHBondContact O-N 3.17Å
625	A	52.8	Low	45.7	Very low	77 Å²	77	88.5 Å²	88.5	64%	0.636	52%	0.52	S	S	*	.	H	α-helix	trans	-56.5	-40.1	175.6	0	0	0	0	0	111.3	I621 A622 G627 G628	I621-A625 PolarHBondContact O-N 2.82Å; A622-A625 PolarHBondContact O-N 3.22Å; A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.28Å; A625-G628 PolarHBondContact O-N 3.24Å
626	R	47.2	Very low	45.6	Very low	167 Å²	167	90.1 Å²	90.1	63%	0.63	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-25.1	174.2	-71.6	-173.5	-87.8	-164.3	-4.7	114.3	A622 Q624 G628	A622-R626 PolarHBondContact O-N 3.48Å; A622-R626 VanDerWaalsContact O-N 3.11Å; Q624-R626 PolarHBondContact O-N 2.64Å; R626-G628 VanDerWaalsContact C-N 3.32Å
627	G	43.4	Very low	46	Very low	65 Å²	65	88.3 Å²	88.3	67%	0.67	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-2.2	176.6	0	0	0	0	0	114.6	A623 Q624 A625	A623-G627 PolarHBondContact O-N 2.8Å; Q624-G627 WeakPolarHBondContact O-CA 2.98Å; Q624-G627 PolarHBondContact O-N 3.46Å; A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.28Å
628	G	36.2	Very low	46.1	Very low	69 Å²	69	93.7 Å²	93.7	71%	0.711	55%	0.552	S	S	*	*	S	Bend	trans	-82.4	-20.7	-175.7	0	0	0	0	0	115.3	Q624 A625 R626	Q624-G628 PolarHBondContact O-N 3.17Å; A625-G628 PolarHBondContact O-N 3.24Å; R626-G628 VanDerWaalsContact C-N 3.32Å
629	S	36.7	Very low	46.1	Very low	91 Å²	91	93.1 Å²	93.1	64%	0.636	55%	0.554	S	S	*	*	S	Bend	trans	-138.2	135.8	177.5	68	0	0	0	0	110.4
630	S	35.5	Very low	45.8	Very low	117 Å²	117	98 Å²	98	82%	0.818	58%	0.575	S	S	*	*	S	Bend	trans	89.2	109.9	-177.6	82.1	0	0	0	0	115.5
631	G	34.8	Very low	45.8	Very low	74 Å²	74	106.5 Å²	106.5	76%	0.763	61%	0.605	S	S	*	*			trans	55.7	104.2	151.7	0	0	0	0	0	118.2	P633	G631-P633 VanDerWaalsContact O-N 3.09Å
632	K	35.4	Very low	45.7	Very low	184 Å²	184	111 Å²	111	80%	0.8	62%	0.622	S	S	*	*			trans	-39.8	120.8	162.5	-77	174.9	178	168.9	0	109.9	K634	K632-K634 PolarHBondContact O-N 2.82Å; K632-K634 VanDerWaalsContact O-N 3.14Å
633	P	38.2	Very low	45.7	Very low	91 Å²	91	116.4 Å²	116.4	59%	0.591	64%	0.64	S	S	*	*			trans	-59.4	124.4	-174	18.9	-29.3	0	0	0	109.3	G631 F635 A636	G631-P633 VanDerWaalsContact O-N 3.09Å; P633-F635 PolarHBondContact O-N 3.44Å; P633-A636 PolarHBondContact O-N 2.87Å
634	K	44.3	Very low	45.9	Very low	191 Å²	191	121.4 Å²	121.4	83%	0.83	65%	0.654	S	S	*	*	H	α-helix	trans	-48.7	-23.9	-176.2	-73.7	179.6	176.8	173.4	0	113	K632 K638	K632-K634 PolarHBondContact O-N 2.82Å; K632-K634 VanDerWaalsContact O-N 3.14Å; K634-K638 PolarHBondContact O-N 3.32Å; K634-K638 VanDerWaalsContact O-N 3.1Å
635	F	42.8	Very low	46.4	Very low	167 Å²	167	123 Å²	123	73%	0.732	66%	0.661	S	S	*	*	H	α-helix	trans	-66	-40.4	176.3	-140	-92.2	0	0	0	114.1	P633 V637 K638 L639	P633-F635 PolarHBondContact O-N 3.44Å; F635-V637 VanDerWaalsContact C-N 3.35Å; F635-V637 PolarHBondContact O-N 3.2Å; F635-K638 PolarHBondContact O-N 2.87Å; F635-L639 PolarHBondContact O-N 2.65Å
636	A	43.2	Very low	46.7	Very low	54 Å²	54	129.3 Å²	129.3	45%	0.446	67%	0.668	S	S	.	*	H	α-helix	trans	-68.6	-35.6	178.3	0	0	0	0	0	111.7	P633 M640	P633-A636 PolarHBondContact O-N 2.87Å; A636-M640 WeakPolarHBondContact O-CB 3.32Å; A636-M640 VanDerWaalsContact O-CG 3.25Å; A636-M640 WeakPolarHBondContact O-CG 3.29Å; A636-M640 PolarHBondContact O-N 3.47Å
637	V	48.3	Very low	47.2	Very low	74 Å²	74	130.9 Å²	130.9	45%	0.448	67%	0.674	S	S	.	*	H	α-helix	trans	-67.4	-39.1	174.7	-178.5	0	0	0	0	110.9	F635 M640 R641	F635-V637 VanDerWaalsContact C-N 3.35Å; F635-V637 PolarHBondContact O-N 3.2Å; V637-M640 PolarHBondContact O-N 3.48Å; V637-R641 WeakPolarHBondContact O-CB 3.15Å; V637-R641 PolarHBondContact O-N 3.09Å
638	K	46.7	Very low	47.8	Very low	152 Å²	152	133.8 Å²	133.8	66%	0.661	67%	0.671	S	S	*	*	H	α-helix	trans	-67.7	-40.1	177.6	-153.7	173.9	-172.9	176.9	0	112	K634 F635 R641 K642	K634-K638 PolarHBondContact O-N 3.32Å; K634-K638 VanDerWaalsContact O-N 3.1Å; F635-K638 PolarHBondContact O-N 2.87Å; K638-R641 PolarHBondContact O-N 3.04Å; K638-K642 PolarHBondContact O-N 3.35Å
639	L	47.6	Very low	48.6	Very low	115 Å²	115	132.3 Å²	132.3	60%	0.602	66%	0.655	S	S	*	*	H	α-helix	trans	-67.2	-41.2	176.7	-153	81.7	0	0	0	111.9	F635 K642 K643	F635-L639 PolarHBondContact O-N 2.65Å; L639-K642 PolarHBondContact O-N 3.08Å; L639-K643 PolarHBondContact O-N 3.07Å
640	M	48.9	Very low	49.4	Very low	138 Å²	138	130.9 Å²	130.9	68%	0.68	65%	0.649	S	S	*	*	H	α-helix	trans	-65.5	-40	175.7	-74.4	-79.5	-85.6	0	0	112.1	A636 V637 K643 K644	A636-M640 WeakPolarHBondContact O-CB 3.32Å; A636-M640 VanDerWaalsContact O-CG 3.25Å; A636-M640 WeakPolarHBondContact O-CG 3.29Å; A636-M640 PolarHBondContact O-N 3.47Å; V637-M640 PolarHBondContact O-N 3.48Å; M640-K643 PolarHBondContact O-N 3.36Å; M640-K644 WeakPolarHBondContact O-CB 3.42Å; M640-K644 PolarHBondContact O-N 3.1Å
641	R	57.9	Low	50.2	Low	187 Å²	187	135.3 Å²	135.3	71%	0.706	65%	0.647	S	S	*	*	H	α-helix	trans	-61.7	-44.9	172.7	-91	-177.1	160.8	176.2	-5	111.9	V637 K638 K643 K644 Q645	V637-R641 WeakPolarHBondContact O-CB 3.15Å; V637-R641 PolarHBondContact O-N 3.09Å; K638-R641 PolarHBondContact O-N 3.04Å; R641-K643 PolarHBondContact O-N 2.89Å; R641-K644 PolarHBondContact O-N 3.13Å; R641-Q645 WeakPolarHBondContact O-CG 2.69Å; R641-Q645 PolarHBondContact O-N 3.38Å
642	K	56.1	Low	51	Low	142 Å²	142	135.2 Å²	135.2	62%	0.617	64%	0.635	S	S	*	*	H	α-helix	trans	-62.7	-40.3	175.1	-96.8	-173.4	173	-176.5	0	112.6	K638 L639 Q645 R646	K638-K642 PolarHBondContact O-N 3.35Å; L639-K642 PolarHBondContact O-N 3.08Å; K642-Q645 PolarHBondContact O-N 3.17Å; K642-R646 PolarHBondContact O-N 3.33Å
643	K	56.8	Low	52	Low	150 Å²	150	131.4 Å²	131.4	65%	0.652	63%	0.627	S	S	*	*	H	α-helix	trans	-67.1	-38.1	177	-129.8	179	-175.6	179.8	0	111.9	L639 M640 R641 R647	L639-K643 PolarHBondContact O-N 3.07Å; M640-K643 PolarHBondContact O-N 3.36Å; R641-K643 PolarHBondContact O-N 2.89Å; K643-R647 PolarHBondContact O-N 3.09Å; K643-R647 VanDerWaalsContact O-N 3.08Å
644	K	59	Low	52.5	Low	146 Å²	146	134 Å²	134	64%	0.635	63%	0.631	S	S	*	*	H	α-helix	trans	-67.4	-40.8	175.7	-158.8	176.2	-176	-178.6	0	111.7	M640 R641 R647 Q648	M640-K644 WeakPolarHBondContact O-CB 3.42Å; M640-K644 PolarHBondContact O-N 3.1Å; R641-K644 PolarHBondContact O-N 3.13Å; K644-R647 PolarHBondContact O-N 3.09Å; K644-Q648 WeakPolarHBondContact O-CG 3.36Å; K644-Q648 PolarHBondContact O-N 3.26Å
645	Q	62.5	Low	52.9	Low	131 Å²	131	133.2 Å²	133.2	61%	0.612	63%	0.628	S	S	*	*	H	α-helix	trans	-64.5	-43.1	173.9	-77.5	177.8	-18.8	0	0	112.5	R641 K642 R647 Q648 G649	R641-Q645 WeakPolarHBondContact O-CG 2.69Å; R641-Q645 PolarHBondContact O-N 3.38Å; K642-Q645 PolarHBondContact O-N 3.17Å; Q645-R647 VanDerWaalsContact C-N 3.33Å; Q645-R647 PolarHBondContact O-N 2.9Å; Q645-Q648 PolarHBondContact O-N 3.17Å; Q645-G649 PolarHBondContact O-N 3.06Å
646	R	59.3	Low	53.4	Low	210 Å²	210	133 Å²	133	79%	0.792	63%	0.627	S	S	*	*	H	α-helix	trans	-62	-38.4	174.9	-74.4	-178.8	89.3	171.5	5.5	112.3	K642 G649 A650	K642-R646 PolarHBondContact O-N 3.33Å; R646-G649 PolarHBondContact O-N 3.02Å; R646-A650 WeakPolarHBondContact O-CB 3.26Å; R646-A650 PolarHBondContact O-N 3.07Å
647	R	58	Low	53.7	Low	200 Å²	200	132.4 Å²	132.4	76%	0.755	63%	0.626	S	S	*	*	H	α-helix	trans	-67.2	-37.8	175.3	-83.2	-175.8	150.6	-175.9	-7.1	113.1	K643 K644 Q645 R651	K643-R647 PolarHBondContact O-N 3.09Å; K643-R647 VanDerWaalsContact O-N 3.08Å; K644-R647 PolarHBondContact O-N 3.09Å; Q645-R647 VanDerWaalsContact C-N 3.33Å; Q645-R647 PolarHBondContact O-N 2.9Å; R647-R651 PolarHBondContact O-N 3.42Å; R647-R651 VanDerWaalsContact O-N 3.17Å
648	Q	55	Low	53.8	Low	127 Å²	127	136.3 Å²	136.3	59%	0.593	64%	0.637	S	S	*	*	H	α-helix	trans	-70.1	-39.6	175.2	-74.2	179.8	-15.5	0	0	111.8	K644 Q645 R651 S652	K644-Q648 WeakPolarHBondContact O-CG 3.36Å; K644-Q648 PolarHBondContact O-N 3.26Å; Q645-Q648 PolarHBondContact O-N 3.17Å; Q648-R651 PolarHBondContact O-N 2.9Å; Q648-S652 PolarHBondContact O-N 2.93Å; Q648-S652 VanDerWaalsContact O-N 3.13Å
649	G	52.9	Low	54	Low	38 Å²	38	137.4 Å²	137.4	39%	0.392	64%	0.641	S	S	.	*	H	α-helix	trans	-60.9	-46.6	172.9	0	0	0	0	0	112.5	Q645 R646 R651 S652 V653	Q645-G649 PolarHBondContact O-N 3.06Å; R646-G649 PolarHBondContact O-N 3.02Å; G649-R651 VanDerWaalsContact C-N 3.35Å; G649-R651 PolarHBondContact O-N 2.91Å; G649-S652 WeakPolarHBondContact O-CB 3.26Å; G649-S652 PolarHBondContact O-N 2.7Å; G649-S652 VanDerWaalsContact O-N 3.11Å; G649-V653 WeakPolarHBondContact O-CG2 3.23Å; G649-V653 PolarHBondContact O-N 2.98Å; G649-V653 VanDerWaalsContact O-N 3.1Å
650	A	54.8	Low	54.1	Low	60 Å²	60	140 Å²	140	50%	0.496	65%	0.648	S	S	.	*	H	α-helix	trans	-62.3	-38.5	178.6	0	0	0	0	0	112.9	R646 S652 V653 H654	R646-A650 WeakPolarHBondContact O-CB 3.26Å; R646-A650 PolarHBondContact O-N 3.07Å; A650-S652 VanDerWaalsContact C-N 3.34Å; A650-S652 PolarHBondContact O-N 3.13Å; A650-V653 PolarHBondContact O-N 3.3Å; A650-H654 PolarHBondContact O-N 3.29Å; A650-H654 VanDerWaalsContact O-N 3.15Å
651	R	52.2	Low	54.2	Low	210 Å²	210	138.2 Å²	138.2	79%	0.792	65%	0.645	S	S	*	*	H	α-helix	trans	-66.1	-33.6	173.8	-85.2	-175.9	168.4	-175.2	-3.5	112.9	R647 Q648 G649 K655	R647-R651 PolarHBondContact O-N 3.42Å; R647-R651 VanDerWaalsContact O-N 3.17Å; Q648-R651 PolarHBondContact O-N 2.9Å; G649-R651 VanDerWaalsContact C-N 3.35Å; G649-R651 PolarHBondContact O-N 2.91Å; R651-K655 PolarHBondContact O-N 3.24Å
652	S	51.5	Low	53.8	Low	72 Å²	72	135.7 Å²	135.7	50%	0.503	64%	0.644	S	S	.	*	H	α-helix	trans	-68.6	-41.1	176.6	-170.6	0	0	0	0	112.2	Q648 G649 A650 H654 K655 K656	Q648-S652 PolarHBondContact O-N 2.93Å; Q648-S652 VanDerWaalsContact O-N 3.13Å; G649-S652 WeakPolarHBondContact O-CB 3.26Å; G649-S652 PolarHBondContact O-N 2.7Å; G649-S652 VanDerWaalsContact O-N 3.11Å; A650-S652 VanDerWaalsContact C-N 3.34Å; A650-S652 PolarHBondContact O-N 3.13Å; S652-H654 PolarHBondContact O-N 2.79Å; S652-K655 PolarHBondContact O-N 3.44Å; S652-K656 PolarHBondContact O-N 3.42Å; S652-K656 VanDerWaalsContact O-N 3.15Å
653	V	55.3	Low	53.6	Low	105 Å²	105	132 Å²	132	64%	0.636	64%	0.64	S	S	*	*	H	α-helix	trans	-64.3	-42.1	176.6	179	0	0	0	0	111.1	G649 A650 K655 K656 G657	G649-V653 WeakPolarHBondContact O-CG2 3.23Å; G649-V653 PolarHBondContact O-N 2.98Å; G649-V653 VanDerWaalsContact O-N 3.1Å; A650-V653 PolarHBondContact O-N 3.3Å; V653-K655 VanDerWaalsContact C-N 3.32Å; V653-K655 PolarHBondContact O-N 3.22Å; V653-K656 PolarHBondContact O-N 2.84Å; V653-G657 PolarHBondContact O-N 3.1Å
654	H	49.7	Very low	53.3	Low	146 Å²	146	131.3 Å²	131.3	68%	0.676	64%	0.644	S	S	*	*	H	α-helix	trans	-63.1	-35	176.7	-114.1	67.2	0	0	0	113.3	A650 S652 K658	A650-H654 PolarHBondContact O-N 3.29Å; A650-H654 VanDerWaalsContact O-N 3.15Å; S652-H654 PolarHBondContact O-N 2.79Å; H654-K658 PolarHBondContact O-N 2.94Å
655	K	51.9	Low	52.7	Low	173 Å²	173	135.3 Å²	135.3	75%	0.752	66%	0.655	S	S	*	*	H	α-helix	trans	-70.9	-34.7	176	-113.2	-177.4	178.3	-176.7	0	112.9	R651 S652 V653	R651-K655 PolarHBondContact O-N 3.24Å; S652-K655 PolarHBondContact O-N 3.44Å; V653-K655 VanDerWaalsContact C-N 3.32Å; V653-K655 PolarHBondContact O-N 3.22Å
656	K	53.4	Low	51.9	Low	163 Å²	163	140.4 Å²	140.4	71%	0.709	67%	0.669	S	S	*	*	H	α-helix	trans	-71.8	-36	174.7	-83.8	-174.2	173.8	-176.8	0	112.5	S652 V653 K659 K660	S652-K656 PolarHBondContact O-N 3.42Å; S652-K656 VanDerWaalsContact O-N 3.15Å; V653-K656 PolarHBondContact O-N 2.84Å; K656-K659 PolarHBondContact O-N 3.32Å; K656-K660 PolarHBondContact O-N 2.71Å
657	G	50.9	Low	50.9	Low	42 Å²	42	144.1 Å²	144.1	43%	0.433	68%	0.683	S	S	.	*	H	α-helix	trans	-60.9	-46	175.9	0	0	0	0	0	113.1	V653 K659 K660 T661	V653-G657 PolarHBondContact O-N 3.1Å; G657-K659 VanDerWaalsContact C-N 3.34Å; G657-K659 PolarHBondContact O-N 3.02Å; G657-K660 PolarHBondContact O-N 3.21Å; G657-T661 PolarHBondContact O-N 3.28Å; G657-T661 PolarHBondContact O-OG1 3.12Å
658	K	49.9	Very low	50.6	Low	155 Å²	155	141.4 Å²	141.4	67%	0.674	68%	0.679	S	S	*	*	H	α-helix	trans	-67.1	-27.4	179.2	-83	-171.4	173	-174.5	0	114.5	H654 T661	H654-K658 PolarHBondContact O-N 2.94Å; K658-T661 PolarHBondContact O-OG1 3.46Å
659	K	51.2	Low	50.3	Low	175 Å²	175	142.1 Å²	142.1	76%	0.761	68%	0.684	S	S	*	*	H	α-helix	trans	-73.3	-31.7	174.6	-90.2	-168.6	173.3	-171.1	0	112.8	K656 G657 A663	K656-K659 PolarHBondContact O-N 3.32Å; G657-K659 VanDerWaalsContact C-N 3.34Å; G657-K659 PolarHBondContact O-N 3.02Å; K659-A663 PolarHBondContact O-N 3.31Å
660	K	50.2	Low	50.2	Low	171 Å²	171	147.9 Å²	147.9	74%	0.743	70%	0.7	S	S	*	*	H	α-helix	trans	-73.3	-34.3	177.9	-88.3	-170.6	171.4	-172	0	113	K656 G657 A663	K656-K660 PolarHBondContact O-N 2.71Å; G657-K660 PolarHBondContact O-N 3.21Å; K660-A663 PolarHBondContact O-N 3.46Å
661	T	49.2	Very low	49.9	Very low	99 Å²	99	153.1 Å²	153.1	61%	0.607	71%	0.712	S	S	*	*	H	α-helix	trans	-73.8	-26.5	178	37.9	0	0	0	0	113.9	G657 K658	G657-T661 PolarHBondContact O-N 3.28Å; G657-T661 PolarHBondContact O-OG1 3.12Å; K658-T661 PolarHBondContact O-OG1 3.46Å
662	L	50.1	Low	49.8	Very low	134 Å²	134	149.5 Å²	149.5	70%	0.702	71%	0.707	S	S	*	*	H	α-helix	trans	-75.8	-29.1	172.8	-101.1	112.1	0	0	0	113.6
663	A	53.1	Low	49.7	Very low	64 Å²	64	154.7 Å²	154.7	53%	0.529	72%	0.72	S	S	.	*	H	α-helix	trans	-71.8	-31.9	179.5	0	0	0	0	0	112.8	K659 K660 R665	K659-A663 PolarHBondContact O-N 3.31Å; K660-A663 PolarHBondContact O-N 3.46Å; A663-R665 VanDerWaalsContact C-N 3.32Å; A663-R665 PolarHBondContact O-N 3.16Å
664	N	48.9	Very low	49.3	Very low	136 Å²	136	158.2 Å²	158.2	73%	0.727	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-1.5	179.8	-88.8	15.1	0	0	0	114.8
665	R	46.9	Very low	49.2	Very low	230 Å²	230	159.2 Å²	159.2	87%	0.868	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	3.5	174.3	-105.5	-175.7	175.1	-172.6	-2.2	114	A663	A663-R665 VanDerWaalsContact C-N 3.32Å; A663-R665 PolarHBondContact O-N 3.16Å
666	R	45.1	Very low	49	Very low	239 Å²	239	158 Å²	158	90%	0.902	73%	0.728	S	S	*	*			trans	-119.2	12.7	177.1	-85.2	-170	171.6	-172.2	-2.6	114.1
667	R	39.6	Very low	48.6	Very low	288 Å²	288	157.5 Å²	157.5	100%	1.087	73%	0.73	S	S	*	*			trans	-107.9	0	155.4	-76.8	-176.5	176.2	-177.9	-3	106.6

Retrieved 667 of 667 residues in 3619.9 ms (Link to these results)

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