A0A096NG11_PAPAN Loading...

Cytochrome P450 family 27 subfamily B member 1

AlphaFold DB , UniProt , Accession A0A096NG11, Species PAPAN (Papio anubis, Olive baboon), Gene CYP27B1, Length 508 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	26.9	Very low	236 Å²	236	156.8 Å²	156.8	100%	1.163	80%	0.8	S	S	*	*				0	86.8	0	-80.1	171.5	160.7	0	0	108
2	T	29.5	Very low	26.7	Very low	126 Å²	126	160.8 Å²	160.8	77%	0.773	81%	0.808	S	S	*	*				73.1	96.4	98.6	27.7	0	0	0	0	114.7
3	Q	25	Very low	26.5	Very low	161 Å²	161	161.8 Å²	161.8	75%	0.752	81%	0.808	S	S	*	*			trans	21.1	130.7	132.3	-70.8	178.1	-19.1	0	0	120.1
4	T	31	Very low	26.3	Very low	142 Å²	142	166.3 Å²	166.3	87%	0.871	81%	0.811	S	S	*	*			trans	-172.7	85	134.9	11.5	0	0	0	0	107.4
5	L	26.3	Very low	26.4	Very low	118 Å²	118	163.8 Å²	163.8	62%	0.618	81%	0.809	S	S	*	*				45.1	106.6	79.7	-85.6	164.3	0	0	0	115.9
6	K	25.5	Very low	26.2	Very low	180 Å²	180	168.7 Å²	168.7	78%	0.783	82%	0.815	S	S	*	*			trans	43.7	119.8	133.8	-69	177.9	-175.9	177.5	0	118.7
7	Y	24.8	Very low	26.2	Very low	233 Å²	233	173.2 Å²	173.2	91%	0.914	82%	0.822	S	S	*	*			trans	-156.9	112.4	132.8	-104.3	-83.5	0	0	0	108.5
8	A	23.7	Very low	26.2	Very low	75 Å²	75	168.4 Å²	168.4	62%	0.62	82%	0.816	S	S	*	*				82.9	104	111.6	0	0	0	0	0	113
9	S	23.3	Very low	26.3	Very low	104 Å²	104	166.6 Å²	166.6	73%	0.727	82%	0.819	S	S	*	*				64.5	123.9	73.1	88.1	0	0	0	0	113.8
10	R	24.5	Very low	26.4	Very low	236 Å²	236	167.6 Å²	167.6	89%	0.891	82%	0.821	S	S	*	*			trans	92	135.1	163	-58.3	-179.2	172.8	-175.6	-1.8	118.2
11	V	26.1	Very low	26.5	Very low	114 Å²	114	167.7 Å²	167.7	69%	0.691	83%	0.825	S	S	*	*			trans	98.4	93.3	157.9	-163.5	0	0	0	0	114.5
12	F	24.6	Very low	26	Very low	205 Å²	205	160.4 Å²	160.4	90%	0.899	81%	0.81	S	S	*	*				-159.7	118.3	97.5	-98.6	-75	0	0	0	111.1
13	H	23.9	Very low	26.1	Very low	174 Å²	174	158.7 Å²	158.7	81%	0.806	81%	0.809	S	S	*	*			trans	-78.9	155.9	172.1	-112.9	-64.7	0	0	0	110.1
14	R	24.6	Very low	26.2	Very low	224 Å²	224	156.3 Å²	156.3	85%	0.845	81%	0.81	S	S	*	*			trans	88.5	92.8	156	-65.3	165.5	-179.2	-155.6	1.2	117.4
15	V	27.4	Very low	26.4	Very low	129 Å²	129	157.4 Å²	157.4	78%	0.782	81%	0.81	S	S	*	*			trans	-126.7	115.8	130.5	-178.9	0	0	0	0	107.3
16	R	23.4	Very low	26.5	Very low	242 Å²	242	154.6 Å²	154.6	91%	0.913	81%	0.809	S	S	*	*			trans	-74.2	131.3	172	-85.3	175.7	167.1	174.8	-5.4	108.5
17	W	26	Very low	26.7	Very low	246 Å²	246	157 Å²	157	93%	0.932	82%	0.815	S	S	*	*			trans	-124.2	143.5	153.6	-81.3	77.6	0	0	0	108.7
18	A	26.5	Very low	27	Very low	86 Å²	86	155.3 Å²	155.3	71%	0.711	81%	0.807	S	S	*	*			trans	-70.2	165.2	-166.3	0	0	0	0	0	113.4	E20	A18-E20 PolarHBondContact O-N 2.86Å
19	P	27.2	Very low	27.5	Very low	134 Å²	134	160.5 Å²	160.5	87%	0.87	82%	0.818	S	S	*	*			trans	-84.6	111	-168.5	32.3	-28.2	0	0	0	111.2
20	E	27.8	Very low	28.1	Very low	186 Å²	186	163.5 Å²	163.5	87%	0.869	82%	0.815	S	S	*	*			trans	-95	111.9	167.2	-75.7	-175.2	167.3	0	0	110	A18 G22	A18-E20 PolarHBondContact O-N 2.86Å; E20-G22 PolarHBondContact O-N 2.72Å
21	L	29.5	Very low	28.7	Very low	171 Å²	171	160 Å²	160	90%	0.895	81%	0.814	S	S	*	*			trans	35.8	82.8	145.1	-71.9	151.5	0	0	0	115.7	A23	L21-A23 PolarHBondContact O-N 3.08Å
22	G	26.3	Very low	29.9	Very low	83 Å²	83	157.5 Å²	157.5	86%	0.856	80%	0.802	S	S	*	*			trans	-62	87.4	158.9	0	0	0	0	0	110.5	E20 S24	E20-G22 PolarHBondContact O-N 2.72Å; G22-S24 VanDerWaalsContact C-N 3.31Å; G22-S24 PolarHBondContact O-N 3.35Å; G22-S24 VanDerWaalsContact O-N 3.15Å
23	A	30	Very low	31.5	Very low	90 Å²	90	152.4 Å²	152.4	74%	0.744	80%	0.797	S	S	*	*			trans	-72.2	97	153.3	0	0	0	0	0	106.3	L21 L25	L21-A23 PolarHBondContact O-N 3.08Å; A23-L25 VanDerWaalsContact C-N 3.32Å; A23-L25 PolarHBondContact O-N 3.29Å
24	S	28.1	Very low	33.7	Very low	110 Å²	110	151.3 Å²	151.3	77%	0.769	79%	0.786	S	S	*	*			trans	-51	98.5	164	55.4	0	0	0	0	108.5	G22 G26	G22-S24 VanDerWaalsContact C-N 3.31Å; G22-S24 PolarHBondContact O-N 3.35Å; G22-S24 VanDerWaalsContact O-N 3.15Å; S24-G26 PolarHBondContact O-N 3.43Å
25	L	35.1	Very low	36.6	Very low	166 Å²	166	147 Å²	147	87%	0.869	77%	0.77	S	S	*	*			trans	-65.2	89.5	155.8	-84.9	161.6	0	0	0	105	A23 Y27	A23-L25 VanDerWaalsContact C-N 3.32Å; A23-L25 PolarHBondContact O-N 3.29Å; L25-Y27 PolarHBondContact O-N 3.14Å; L25-Y27 VanDerWaalsContact O-N 3.08Å
26	G	28.1	Very low	39.5	Very low	59 Å²	59	143.5 Å²	143.5	61%	0.608	75%	0.751	S	S	*	*			trans	-48.5	121.4	170.2	0	0	0	0	0	107.2	S24 R28	S24-G26 PolarHBondContact O-N 3.43Å; G26-R28 PolarHBondContact O-N 3.31Å
27	Y	30.2	Very low	42.5	Very low	230 Å²	230	133.5 Å²	133.5	90%	0.902	72%	0.715	S	S	*	*			trans	-53.1	92.2	149.3	-91.2	-100.2	0	0	0	105.7	L25 E29	L25-Y27 PolarHBondContact O-N 3.14Å; L25-Y27 VanDerWaalsContact O-N 3.08Å; Y27-E29 PolarHBondContact O-N 3.18Å
28	R	31	Very low	45.4	Very low	197 Å²	197	126 Å²	126	74%	0.743	71%	0.705	S	S	*	*			trans	-65.3	100.7	153.8	-88.3	-175.2	171.4	171.5	-1.9	103.8	G26 Y30	G26-R28 PolarHBondContact O-N 3.31Å; R28-Y30 HydrophobicContact CB-CD2 3.86Å; R28-Y30 HydrophobicContact CB-CE2 4.28Å; R28-Y30 PolarHBondContact O-N 3.2Å
29	E	33.7	Very low	48.5	Very low	184 Å²	184	125.9 Å²	125.9	86%	0.86	69%	0.693	S	S	*	*			trans	-49.9	93.6	146	-81	178.2	145.3	0	0	106.3	Y27 D31	Y27-E29 PolarHBondContact O-N 3.18Å; E29-D31 PolarHBondContact O-N 2.7Å
30	Y	35	Very low	51.6	Low	167 Å²	167	120 Å²	120	66%	0.655	65%	0.654	S	S	*	*			trans	-76.6	77.7	164.7	-109.6	-86.9	0	0	0	105.9	R28 S32	R28-Y30 HydrophobicContact CB-CD2 3.86Å; R28-Y30 HydrophobicContact CB-CE2 4.28Å; R28-Y30 PolarHBondContact O-N 3.2Å; Y30-S32 PolarHBondContact O-N 3.03Å
31	D	38.6	Very low	54.7	Low	164 Å²	164	113.4 Å²	113.4	88%	0.877	63%	0.627	S	S	*	*			trans	-74.7	48	158.2	-154	16.4	0	0	0	108.8	E29 A33	E29-D31 PolarHBondContact O-N 2.7Å; D31-A33 PolarHBondContact O-N 3.21Å
32	S	50.7	Low	57.7	Low	61 Å²	61	106.8 Å²	106.8	43%	0.427	60%	0.601	S	S	.	*			trans	-77.6	118	169.2	56.7	0	0	0	0	107.1	Y30 R34	Y30-S32 PolarHBondContact O-N 3.03Å; S32-R34 PolarHBondContact O-N 3.48Å
33	A	58.3	Low	60.6	Low	97 Å²	97	103.7 Å²	103.7	80%	0.802	57%	0.565	S	S	*	*			trans	-38.6	111.4	161.9	0	0	0	0	0	108.9	D31	D31-A33 PolarHBondContact O-N 3.21Å
34	R	69.3	Low	63.2	Low	151 Å²	151	102.9 Å²	102.9	57%	0.57	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-59	141.8	-173.7	-70.1	179.4	179.6	154.8	3.1	109.5	S32 H396 I401	S32-R34 PolarHBondContact O-N 3.48Å; R34-H396 PolarHBondContact NH1-CE1 3.25Å; R34-H396 PolarHBondContact NH1-ND1 3.36Å; R34-I401 HydrophobicContact CB-CD1 3.97Å; R34-I401 HydrophobicContact CB-CG1 4.05Å
35	R	86.6	Confident	65.8	Low	135 Å²	135	101 Å²	101	51%	0.509	54%	0.538	S	S	.	.	B	Isolated β-bridge	trans	-72.9	140.1	-171.8	-69.6	-176.5	-171.5	177.8	4.5	110.3	D39 D399 Y400 I401	R35-D39 HydrophobicContact CB-CB 3.79Å; R35-D39 HydrophobicContact CG-CB 4.25Å; R35-D399 PolarHBondContact N-O 3.18Å; R35-Y400 HydrophobicContact CB-CD1 3.57Å; R35-Y400 HydrophobicContact CB-CE1 3.76Å; R35-Y400 WeakPolarHBondContact O-CA 3.46Å; R35-I401 PolarHBondContact O-N 2.67Å
36	S	88.6	Confident	67.9	Low	55 Å²	55	97.6 Å²	97.6	39%	0.385	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-81.4	172.6	179.7	73.7	0	0	0	0	111.3	A38 D39	S36-A38 PolarHBondContact O-N 2.94Å; S36-A38 VanDerWaalsContact O-N 3.15Å; S36-A38 PolarHBondContact OG-N 3.27Å; S36-D39 WeakPolarHBondContact CB-OD2 3.17Å; S36-D39 PolarHBondContact N-OD2 3.07Å; S36-D39 WeakPolarHBondContact O-CB 3.24Å; S36-D39 PolarHBondContact O-N 3.41Å; S36-D39 PolarHBondContact OG-OD2 3.01Å
37	L	86.9	Confident	70.4	Confident	31 Å²	31	96.4 Å²	96.4	16%	0.162	51%	0.509	C	S	.	.	G	3₁₀ helix	trans	-55.1	-30.4	173.4	-171.2	73.7	0	0	0	113	D39 I40 L77 V86 P403 T406	L37-D39 VanDerWaalsContact C-N 3.26Å; L37-D39 PolarHBondContact O-N 3.2Å; L37-I40 HydrophobicContact CD1-CD1 3.89Å; L37-I40 PolarHBondContact O-N 2.73Å; L37-L77 HydrophobicContact CD1-CD1 4.37Å; L37-V86 HydrophobicContact CD1-CG2 3.55Å; L37-P403 HydrophobicContact CB-CG 4.37Å; L37-T406 HydrophobicContact CD1-CG2 4.18Å
38	A	86.6	Confident	72.8	Confident	88 Å²	88	86.1 Å²	86.1	73%	0.727	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-72.7	-20.1	-179.2	0	0	0	0	0	113.2	S36	S36-A38 PolarHBondContact O-N 2.94Å; S36-A38 VanDerWaalsContact O-N 3.15Å; S36-A38 PolarHBondContact OG-N 3.27Å
39	D	91	Very high	75	Confident	85 Å²	85	79.6 Å²	79.6	46%	0.455	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-88.7	-6.1	-178.4	-57.4	-56.5	0	0	0	112.5	R35 S36 L37 Y400	R35-D39 HydrophobicContact CB-CB 3.79Å; R35-D39 HydrophobicContact CG-CB 4.25Å; S36-D39 WeakPolarHBondContact CB-OD2 3.17Å; S36-D39 PolarHBondContact N-OD2 3.07Å; S36-D39 WeakPolarHBondContact O-CB 3.24Å; S36-D39 PolarHBondContact O-N 3.41Å; S36-D39 PolarHBondContact OG-OD2 3.01Å; L37-D39 VanDerWaalsContact C-N 3.26Å; L37-D39 PolarHBondContact O-N 3.2Å; D39-Y400 HydrophobicContact CB-CE1 4.38Å
40	I	92.4	Very high	77.1	Confident	11 Å²	11	73.1 Å²	73.1	6%	0.056	43%	0.426	C	S	.	.	S	Bend	trans	-71.4	126.9	177.7	-61	-178.3	0	0	0	109	L37 V75 W76 L77 V86 Y400	L37-I40 HydrophobicContact CD1-CD1 3.89Å; L37-I40 PolarHBondContact O-N 2.73Å; I40-V75 HydrophobicContact CD1-CG1 4.34Å; I40-V75 HydrophobicContact CG2-CG1 4.11Å; I40-W76 VanDerWaalsContact CG2-C 3.49Å; I40-L77 HydrophobicContact CB-CB 4.09Å; I40-L77 HydrophobicContact CG2-CB 3.75Å; I40-V86 HydrophobicContact CD1-CG1 4.25Å; I40-V86 HydrophobicContact CD1-CG2 4.12Å; I40-Y400 HydrophobicContact CB-CE1 4.42Å; I40-Y400 HydrophobicContact CD1-CD1 4.32Å; I40-Y400 HydrophobicContact CD1-CG 4.23Å; I40-Y400 HydrophobicContact CG1-CD1 3.45Å; I40-Y400 VanDerWaalsContact CG1-CD1 3.45Å; I40-Y400 HydrophobicContact CG1-CD2 4.37Å; I40-Y400 HydrophobicContact CG1-CE1 3.76Å; I40-Y400 HydrophobicContact CG1-CG 3.79Å
41	P	93.6	Very high	79.1	Confident	46 Å²	46	66.5 Å²	66.5	30%	0.299	40%	0.401	S	S	.	.			trans	-65.3	156	178.3	29.1	-35.9	0	0	0	111.2	F72 W76 L77	P41-F72 HydrophobicContact CB-CB 4.41Å; P41-F72 HydrophobicContact CB-CD1 4.38Å; P41-F72 HydrophobicContact CG-CB 4.37Å; P41-F72 WeakPolarHBondContact CG-O 3.18Å; P41-W76 CarbonylContact O-C 3.6Å; P41-W76 WeakPolarHBondContact O-CA 3.26Å; P41-W76 VanDerWaalsContact O-CB 3.26Å; P41-W76 WeakPolarHBondContact O-CB 3.38Å; P41-L77 PolarHBondContact O-N 3.29Å
42	G	90.8	Very high	80.8	Confident	33 Å²	33	58.9 Å²	58.9	34%	0.34	36%	0.36	S	S	.	.			trans	-177.4	164.6	179.6	0	0	0	0	0	114	F72 L77	G42-F72 VanDerWaalsContact C-CE1 3.47Å; G42-L77 VanDerWaalsContact CA-O 3.25Å; G42-L77 WeakPolarHBondContact CA-O 3.5Å
43	P	88.6	Confident	82.1	Confident	17 Å²	17	62.1 Å²	62.1	11%	0.11	37%	0.367	C	S	.	.			trans	-68	148.7	173.1	29.5	-33.3	0	0	0	110.5	F48 F72 L77 A78	P43-F48 HydrophobicContact CB-CB 4.2Å; P43-F48 HydrophobicContact CG-CB 3.99Å; P43-F48 HydrophobicContact CG-CD2 3.83Å; P43-F48 HydrophobicContact CG-CG 4.24Å; P43-F72 HydrophobicContact CB-CE2 4.21Å; P43-F72 HydrophobicContact CB-CZ 3.85Å; P43-F72 HydrophobicContact CG-CE2 4.21Å; P43-F72 HydrophobicContact CG-CZ 4.27Å; P43-F72 VanDerWaalsContact N-CZ 3.33Å; P43-L77 WeakPolarHBondContact CD-O 3.47Å; P43-A78 HydrophobicContact CG-CB 4.08Å
44	S	84.9	Confident	82.5	Confident	74 Å²	74	62.6 Å²	62.6	52%	0.517	36%	0.363	S	S	.	.			trans	-63	148.1	166.1	67.1	0	0	0	0	109.9	P46 S47 F48	S44-P46 VanDerWaalsContact C-CD 3.49Å; S44-P46 VanDerWaalsContact C-N 3.33Å; S44-S47 WeakPolarHBondContact O-CB 3.36Å; S44-S47 PolarHBondContact O-N 2.86Å; S44-S47 VanDerWaalsContact OG-CB 3.3Å; S44-S47 WeakPolarHBondContact OG-CB 3.3Å; S44-S47 PolarHBondContact OG-N 3.44Å; S44-F48 PolarHBondContact O-N 3.46Å
45	T	81.4	Confident	82.3	Confident	69 Å²	69	62 Å²	62	42%	0.423	37%	0.365	S	S	.	.	H	α-helix	trans	-53	-43.5	-179.3	-48.5	0	0	0	0	113.1	S47 F48 L49	T45-S47 PolarHBondContact O-N 3.16Å; T45-F48 PolarHBondContact O-N 3.48Å; T45-L49 HydrophobicContact CG2-CD1 4.12Å; T45-L49 HydrophobicContact CG2-CG 4.47Å; T45-L49 VanDerWaalsContact O-CG 3.27Å; T45-L49 WeakPolarHBondContact O-CG 3.39Å; T45-L49 PolarHBondContact O-N 2.82Å
46	P	79.2	Confident	81.1	Confident	96 Å²	96	57.6 Å²	57.6	62%	0.623	36%	0.362	S	S	*	.	H	α-helix	trans	-64.4	-39.5	175.9	-21.6	34.3	0	0	0	113.2	S44 F48 L49 A50	S44-P46 VanDerWaalsContact C-CD 3.49Å; S44-P46 VanDerWaalsContact C-N 3.33Å; P46-F48 VanDerWaalsContact C-N 3.35Å; P46-L49 PolarHBondContact O-N 3.43Å; P46-A50 WeakPolarHBondContact O-CB 3.28Å; P46-A50 PolarHBondContact O-N 3.35Å
47	S	81	Confident	80.4	Confident	34 Å²	34	55.9 Å²	55.9	24%	0.238	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-42.7	176.6	-175.2	0	0	0	0	111.1	S44 T45 A50 E51	S44-S47 WeakPolarHBondContact O-CB 3.36Å; S44-S47 PolarHBondContact O-N 2.86Å; S44-S47 VanDerWaalsContact OG-CB 3.3Å; S44-S47 WeakPolarHBondContact OG-CB 3.3Å; S44-S47 PolarHBondContact OG-N 3.44Å; T45-S47 PolarHBondContact O-N 3.16Å; S47-A50 PolarHBondContact O-N 3.34Å; S47-E51 WeakPolarHBondContact O-CG 3.11Å; S47-E51 PolarHBondContact O-N 3.01Å
48	F	80.2	Confident	79.9	Confident	14 Å²	14	56.5 Å²	56.5	6%	0.061	36%	0.355	C	S	.	.	H	α-helix	trans	-66.2	-40.7	178.2	-172.1	-108.5	0	0	0	111.8	P43 S44 T45 P46 E51 L52 A78 S79 F80	P43-F48 HydrophobicContact CB-CB 4.2Å; P43-F48 HydrophobicContact CG-CB 3.99Å; P43-F48 HydrophobicContact CG-CD2 3.83Å; P43-F48 HydrophobicContact CG-CG 4.24Å; S44-F48 PolarHBondContact O-N 3.46Å; T45-F48 PolarHBondContact O-N 3.48Å; P46-F48 VanDerWaalsContact C-N 3.35Å; F48-E51 PolarHBondContact O-N 2.92Å; F48-L52 VanDerWaalsContact O-CB 3.27Å; F48-L52 WeakPolarHBondContact O-CB 3.43Å; F48-L52 PolarHBondContact O-N 2.8Å; F48-A78 HydrophobicContact CD1-CB 4.44Å; F48-A78 HydrophobicContact CD2-CB 3.88Å; F48-A78 HydrophobicContact CE1-CB 4.34Å; F48-A78 HydrophobicContact CE2-CB 3.75Å; F48-A78 HydrophobicContact CG-CB 4.22Å; F48-A78 HydrophobicContact CZ-CB 3.99Å; F48-S79 WeakPolarHBondContact CD1-O 3.49Å; F48-F80 HydrophobicContact CE1-CB 4.09Å; F48-F80 HydrophobicContact CE1-CD2 4.44Å
49	L	77.7	Confident	79.8	Confident	60 Å²	60	54 Å²	54	31%	0.314	33%	0.333	S	S	.	.	H	α-helix	trans	-65	-41.5	174.8	-69.1	171.1	0	0	0	111.7	T45 P46 E51 L52 F53 F80	T45-L49 HydrophobicContact CG2-CD1 4.12Å; T45-L49 HydrophobicContact CG2-CG 4.47Å; T45-L49 VanDerWaalsContact O-CG 3.27Å; T45-L49 WeakPolarHBondContact O-CG 3.39Å; T45-L49 PolarHBondContact O-N 2.82Å; P46-L49 PolarHBondContact O-N 3.43Å; L49-E51 VanDerWaalsContact C-N 3.34Å; L49-E51 PolarHBondContact O-N 3.19Å; L49-L52 PolarHBondContact O-N 3.09Å; L49-F53 HydrophobicContact CB-CD2 4.46Å; L49-F53 HydrophobicContact CD2-CD2 4.38Å; L49-F53 HydrophobicContact CD2-CE2 3.88Å; L49-F53 WeakPolarHBondContact O-CB 3.29Å; L49-F53 VanDerWaalsContact O-CD2 3.26Å; L49-F53 WeakPolarHBondContact O-CD2 3.4Å; L49-F53 PolarHBondContact O-N 2.93Å; L49-F80 HydrophobicContact CD2-CD2 3.8Å; L49-F80 HydrophobicContact CD2-CE2 3.69Å
50	A	77.3	Confident	79.7	Confident	48 Å²	48	51.2 Å²	51.2	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-41.2	175.3	0	0	0	0	0	111.7	P46 S47 C54	P46-A50 WeakPolarHBondContact O-CB 3.28Å; P46-A50 PolarHBondContact O-N 3.35Å; S47-A50 PolarHBondContact O-N 3.34Å; A50-C54 WeakPolarHBondContact O-CA 3.42Å; A50-C54 WeakPolarHBondContact O-CB 3.31Å; A50-C54 PolarHBondContact O-N 2.88Å
51	E	76.9	Confident	79.4	Confident	27 Å²	27	53 Å²	53	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-45.1	173.3	-73.9	171.9	-172	0	0	111.4	S47 F48 L49 F53 K55 L64 R71	S47-E51 WeakPolarHBondContact O-CG 3.11Å; S47-E51 PolarHBondContact O-N 3.01Å; F48-E51 PolarHBondContact O-N 2.92Å; L49-E51 VanDerWaalsContact C-N 3.34Å; L49-E51 PolarHBondContact O-N 3.19Å; E51-F53 VanDerWaalsContact C-N 3.34Å; E51-F53 PolarHBondContact O-N 2.79Å; E51-K55 HydrophobicContact CG-CD 4.31Å; E51-K55 PolarHBondContact O-N 3.08Å; E51-L64 HydrophobicContact CB-CD2 4.28Å; E51-R71 IonicContact OE1-NH1 3.97Å; E51-R71 PolarHBondContact OE1-NH1 2.89Å
52	L	75.7	Confident	79.3	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-28.8	-178.3	-167.1	69	0	0	0	113.9	F48 L49 G57 L58 L61 L64 F80	F48-L52 VanDerWaalsContact O-CB 3.27Å; F48-L52 WeakPolarHBondContact O-CB 3.43Å; F48-L52 PolarHBondContact O-N 2.8Å; L49-L52 PolarHBondContact O-N 3.09Å; L52-G57 CarbonylContact O-C 3.56Å; L52-G57 WeakPolarHBondContact O-CA 3.37Å; L52-L58 HydrophobicContact CD1-CD2 3.82Å; L52-L58 HydrophobicContact CD2-CD2 4.41Å; L52-L58 HydrophobicContact CG-CD2 4.28Å; L52-L58 PolarHBondContact O-N 2.89Å; L52-L61 HydrophobicContact CD1-CD2 3.52Å; L52-L61 HydrophobicContact CD1-CG 4.5Å; L52-L64 HydrophobicContact CD1-CD1 4.48Å; L52-F80 HydrophobicContact CD2-CD2 3.32Å; L52-F80 HydrophobicContact CD2-CE2 3.17Å; L52-F80 HydrophobicContact CD2-CG 4.33Å; L52-F80 HydrophobicContact CD2-CZ 4.09Å
53	F	76.8	Confident	79.4	Confident	129 Å²	129	52.1 Å²	52.1	57%	0.566	31%	0.308	S	S	*	.	H	α-helix	trans	-111	-27.2	-176.1	-69.9	-70.5	0	0	0	114.4	L49 E51 F80	L49-F53 HydrophobicContact CB-CD2 4.46Å; L49-F53 HydrophobicContact CD2-CD2 4.38Å; L49-F53 HydrophobicContact CD2-CE2 3.88Å; L49-F53 WeakPolarHBondContact O-CB 3.29Å; L49-F53 VanDerWaalsContact O-CD2 3.26Å; L49-F53 WeakPolarHBondContact O-CD2 3.4Å; L49-F53 PolarHBondContact O-N 2.93Å; E51-F53 VanDerWaalsContact C-N 3.34Å; E51-F53 PolarHBondContact O-N 2.79Å; F53-F80 HydrophobicContact CE2-CE2 4.05Å; F53-F80 HydrophobicContact CZ-CE2 4.18Å; F53-F80 HydrophobicContact CZ-CZ 4.38Å
54	C	67.8	Low	79.4	Confident	107 Å²	107	52.5 Å²	52.5	72%	0.723	31%	0.309	S	S	*	.	H	α-helix	trans	-104.8	-21.8	-174.3	-54	0	0	0	0	114.3	A50	A50-C54 WeakPolarHBondContact O-CA 3.42Å; A50-C54 WeakPolarHBondContact O-CB 3.31Å; A50-C54 PolarHBondContact O-N 2.88Å
55	K	64.4	Low	79.9	Confident	139 Å²	139	49.7 Å²	49.7	60%	0.604	29%	0.288	S	S	*	.	S	Bend	trans	-107.2	54.2	-178	-66.3	-174.2	-178.8	173.7	0	113	E51	E51-K55 HydrophobicContact CG-CD 4.31Å; E51-K55 PolarHBondContact O-N 3.08Å
56	G	62.3	Low	80.5	Confident	43 Å²	43	49.2 Å²	49.2	44%	0.443	29%	0.285	S	S	.	.	S	Bend	trans	88.9	1.7	177.4	0	0	0	0	0	115.2	S59	G56-S59 PolarHBondContact O-OG 3.37Å
57	G	72.6	Confident	81.1	Confident	18 Å²	18	48.8 Å²	48.8	19%	0.186	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	81.8	-167.1	164.9	0	0	0	0	0	115.2	L52 S59 R60	L52-G57 CarbonylContact O-C 3.56Å; L52-G57 WeakPolarHBondContact O-CA 3.37Å; G57-S59 PolarHBondContact O-N 3.45Å; G57-R60 PolarHBondContact O-N 3.17Å; G57-R60 VanDerWaalsContact O-N 3.16Å
58	L	77.1	Confident	81.6	Confident	44 Å²	44	47.5 Å²	47.5	23%	0.23	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-54.6	-17	164.2	-69	167.9	0	0	0	113.3	L52 R60 L61 L233	L52-L58 HydrophobicContact CD1-CD2 3.82Å; L52-L58 HydrophobicContact CD2-CD2 4.41Å; L52-L58 HydrophobicContact CG-CD2 4.28Å; L52-L58 PolarHBondContact O-N 2.89Å; L58-R60 VanDerWaalsContact C-N 3.26Å; L58-R60 PolarHBondContact O-N 2.9Å; L58-L61 HydrophobicContact CD2-CD1 4Å; L58-L61 HydrophobicContact CD2-CG 4.45Å; L58-L61 WeakPolarHBondContact O-CG 3.47Å; L58-L233 HydrophobicContact CD1-CB 4.46Å
59	S	83.8	Confident	82.3	Confident	37 Å²	37	48.1 Å²	48.1	26%	0.259	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-74	-13.8	179.6	83.9	0	0	0	0	114.3	G56 G57 M490 T491	G56-S59 PolarHBondContact O-OG 3.37Å; G57-S59 PolarHBondContact O-N 3.45Å; S59-M490 CarbonylContact O-C 3.45Å; S59-M490 WeakPolarHBondContact O-CA 3.45Å; S59-T491 WeakPolarHBondContact CA-O 3.47Å; S59-T491 PolarHBondContact O-N 2.83Å
60	R	88.6	Confident	83	Confident	25 Å²	25	49.6 Å²	49.6	9%	0.094	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-116.8	19.2	-178	-60	-67.8	176.4	-177.4	-8	113.4	G57 L58 H62 E63 L64 P489 E498	G57-R60 PolarHBondContact O-N 3.17Å; G57-R60 VanDerWaalsContact O-N 3.16Å; L58-R60 VanDerWaalsContact C-N 3.26Å; L58-R60 PolarHBondContact O-N 2.9Å; R60-H62 PolarHBondContact O-N 3.45Å; R60-H62 VanDerWaalsContact O-N 3.11Å; R60-E63 VanDerWaalsContact CD-OE1 3.28Å; R60-E63 WeakPolarHBondContact CD-OE1 3.25Å; R60-E63 IonicContact CZ-OE1 3.81Å; R60-E63 IonicContact NE-OE1 2.6Å; R60-E63 IonicContact NH1-OE1 3.33Å; R60-E63 PolarHBondContact NH1-OE1 3.5Å; R60-E63 WeakPolarHBondContact O-CB 3.46Å; R60-E63 PolarHBondContact O-N 3.29Å; R60-L64 PolarHBondContact O-N 2.9Å; R60-P489 PolarHBondContact NH1-O 2.97Å; R60-E498 IonicContact CZ-OE1 2.74Å; R60-E498 IonicContact CZ-OE2 2.83Å; R60-E498 IonicContact NH2-OE1 3.43Å; R60-E498 PolarHBondContact NH2-OE1 2.82Å; R60-E498 IonicContact NH2-OE2 3.08Å; R60-E498 PolarHBondContact NH2-OE2 2.98Å
61	L	86.9	Confident	83.8	Confident	48 Å²	48	54.3 Å²	54.3	25%	0.251	30%	0.303	S	S	.	.	H	α-helix	trans	-53.8	-33.2	179.8	-78	175	0	0	0	114	L52 L58 L64 T491	L52-L61 HydrophobicContact CD1-CD2 3.52Å; L52-L61 HydrophobicContact CD1-CG 4.5Å; L58-L61 HydrophobicContact CD2-CD1 4Å; L58-L61 HydrophobicContact CD2-CG 4.45Å; L58-L61 WeakPolarHBondContact O-CG 3.47Å; L61-L64 HydrophobicContact CD2-CD1 4.13Å; L61-L64 PolarHBondContact O-N 3.44Å; L61-T491 HydrophobicContact CB-CG2 4.27Å; L61-T491 HydrophobicContact CD1-CG2 4.4Å
62	H	91.9	Very high	84.6	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-67.3	-36.5	176.9	62	-82.8	0	0	0	112.6	R60 Q65 P385 Y413 P489 T491 L495	R60-H62 PolarHBondContact O-N 3.45Å; R60-H62 VanDerWaalsContact O-N 3.11Å; H62-Q65 WeakPolarHBondContact O-CB 3.42Å; H62-Q65 PolarHBondContact O-N 3.39Å; H62-P385 HydrophobicContact CB-CB 3.8Å; H62-P385 HydrophobicContact CB-CG 4.08Å; H62-Y413 HydrophobicContact CB-CD1 4.08Å; H62-Y413 HydrophobicContact CB-CD2 3.98Å; H62-Y413 HydrophobicContact CB-CE1 4.4Å; H62-Y413 HydrophobicContact CB-CE2 4.29Å; H62-Y413 HydrophobicContact CB-CG 3.87Å; H62-Y413 AromaticContact CD2-CE1 3.72Å; H62-Y413 AromaticContact CD2-CE2 3.67Å; H62-Y413 AromaticContact CD2-CZ 3.39Å; H62-Y413 VanDerWaalsContact O-CD1 3.23Å; H62-Y413 WeakPolarHBondContact O-CD1 3.44Å; H62-P489 PolarHBondContact CE1-O 3.18Å; H62-T491 PolarHBondContact ND1-OG1 3.17Å; H62-L495 HydrophobicContact CB-CD1 4.04Å
63	E	92.3	Very high	85.5	Confident	61 Å²	61	56 Å²	56	29%	0.285	32%	0.316	S	S	.	.	H	α-helix	trans	-70.5	-33.8	177.1	-59.9	179.3	-169.2	0	0	111.4	R60 Q65 V66 Q67	R60-E63 VanDerWaalsContact CD-OE1 3.28Å; R60-E63 WeakPolarHBondContact CD-OE1 3.25Å; R60-E63 IonicContact CZ-OE1 3.81Å; R60-E63 IonicContact NE-OE1 2.6Å; R60-E63 IonicContact NH1-OE1 3.33Å; R60-E63 PolarHBondContact NH1-OE1 3.5Å; R60-E63 WeakPolarHBondContact O-CB 3.46Å; R60-E63 PolarHBondContact O-N 3.29Å; E63-Q65 PolarHBondContact O-N 3.25Å; E63-V66 PolarHBondContact O-N 3.35Å; E63-Q67 WeakPolarHBondContact O-CG 3.26Å; E63-Q67 PolarHBondContact O-N 2.95Å
64	L	89.7	Confident	86.4	Confident	25 Å²	25	53.2 Å²	53.2	13%	0.131	31%	0.311	C	S	.	.	H	α-helix	trans	-60.5	-25.8	174.4	-64.3	-178.2	0	0	0	112.7	E51 L52 R60 L61 G68	E51-L64 HydrophobicContact CB-CD2 4.28Å; L52-L64 HydrophobicContact CD1-CD1 4.48Å; R60-L64 PolarHBondContact O-N 2.9Å; L61-L64 HydrophobicContact CD2-CD1 4.13Å; L61-L64 PolarHBondContact O-N 3.44Å; L64-G68 WeakPolarHBondContact O-CA 3.42Å; L64-G68 PolarHBondContact O-N 2.95Å
65	Q	93.6	Very high	87.8	Confident	14 Å²	14	48.4 Å²	48.4	7%	0.065	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-43.1	173.5	-57.6	-177.1	14	0	0	111.6	H62 E63 A69 W76 P385 C411 A414	H62-Q65 WeakPolarHBondContact O-CB 3.42Å; H62-Q65 PolarHBondContact O-N 3.39Å; E63-Q65 PolarHBondContact O-N 3.25Å; Q65-A69 WeakPolarHBondContact O-CB 3.37Å; Q65-A69 PolarHBondContact O-N 3.2Å; Q65-W76 WeakPolarHBondContact O-CH2 3.36Å; Q65-P385 PolarHBondContact NE2-O 2.95Å; Q65-P385 PolarHBondContact OE1-O 3.46Å; Q65-P385 VanDerWaalsContact OE1-O 3.08Å; Q65-C411 HydrophobicContact CB-CB 4.1Å; Q65-C411 HydrophobicContact CG-CB 4.23Å; Q65-A414 HydrophobicContact CB-CB 3.89Å
66	V	93.8	Very high	89.3	Confident	59 Å²	59	42.2 Å²	42.2	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-68.9	-44.8	179.4	-177.3	0	0	0	0	110	E63 A69 A70 Y413 A414	E63-V66 PolarHBondContact O-N 3.35Å; V66-A69 PolarHBondContact O-N 2.77Å; V66-A70 WeakPolarHBondContact O-CB 3.3Å; V66-A70 PolarHBondContact O-N 3.35Å; V66-Y413 HydrophobicContact CG2-CD1 3.75Å; V66-Y413 HydrophobicContact CG2-CE1 3.86Å; V66-A414 HydrophobicContact CG2-CB 4.38Å
67	Q	92.4	Very high	90.8	Very high	88 Å²	88	41.5 Å²	41.5	41%	0.411	24%	0.237	S	C	.	.	H	α-helix	trans	-64.5	-41.6	177.7	-64.9	173.6	22.6	0	0	111.7	E63 A70 R71	E63-Q67 WeakPolarHBondContact O-CG 3.26Å; E63-Q67 PolarHBondContact O-N 2.95Å; Q67-A70 PolarHBondContact O-N 3.14Å; Q67-R71 VanDerWaalsContact O-CB 3.3Å; Q67-R71 WeakPolarHBondContact O-CB 3.39Å; Q67-R71 PolarHBondContact O-N 3.5Å
68	G	92.3	Very high	91.6	Very high	6 Å²	6	40.8 Å²	40.8	6%	0.062	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-48.5	176.3	0	0	0	0	0	111.9	L64 A70 R71 F72	L64-G68 WeakPolarHBondContact O-CA 3.42Å; L64-G68 PolarHBondContact O-N 2.95Å; G68-A70 VanDerWaalsContact C-N 3.32Å; G68-A70 PolarHBondContact O-N 3.27Å; G68-R71 PolarHBondContact O-N 3.36Å; G68-F72 PolarHBondContact O-N 3.19Å
69	A	94.4	Very high	91.9	Very high	28 Å²	28	40 Å²	40	23%	0.231	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-41.9	176.6	0	0	0	0	0	112.3	Q65 V66 G73 W76 A89	Q65-A69 WeakPolarHBondContact O-CB 3.37Å; Q65-A69 PolarHBondContact O-N 3.2Å; V66-A69 PolarHBondContact O-N 2.77Å; A69-G73 WeakPolarHBondContact CA-O 3.22Å; A69-G73 CarbonylContact O-C 3.58Å; A69-G73 VanDerWaalsContact O-CA 3.26Å; A69-G73 WeakPolarHBondContact O-CA 3.41Å; A69-G73 PolarHBondContact O-N 2.89Å; A69-G73 VanDerWaalsContact O-N 3.08Å; A69-W76 HydrophobicContact CB-CH2 4.39Å; A69-W76 HydrophobicContact CB-CZ3 4.07Å; A69-A89 HydrophobicContact CB-CB 3.83Å
70	A	93.4	Very high	91.2	Very high	90 Å²	90	40.6 Å²	40.6	74%	0.744	23%	0.226	S	C	*	.	H	α-helix	trans	-68.7	-34.1	178.2	0	0	0	0	0	113.4	V66 Q67 G68	V66-A70 WeakPolarHBondContact O-CB 3.3Å; V66-A70 PolarHBondContact O-N 3.35Å; Q67-A70 PolarHBondContact O-N 3.14Å; G68-A70 VanDerWaalsContact C-N 3.32Å; G68-A70 PolarHBondContact O-N 3.27Å
71	R	93.6	Very high	90.3	Very high	148 Å²	148	42.7 Å²	42.7	56%	0.558	26%	0.255	S	S	*	.	H	α-helix	trans	-88.4	-39.5	-174.6	-175.9	174.8	177.1	-171.9	0.6	113.8	E51 Q67 G68	E51-R71 IonicContact OE1-NH1 3.97Å; E51-R71 PolarHBondContact OE1-NH1 2.89Å; Q67-R71 VanDerWaalsContact O-CB 3.3Å; Q67-R71 WeakPolarHBondContact O-CB 3.39Å; Q67-R71 PolarHBondContact O-N 3.5Å; G68-R71 PolarHBondContact O-N 3.36Å
72	F	94.2	Very high	89.4	Confident	41 Å²	41	47.3 Å²	47.3	18%	0.18	29%	0.285	C	S	.	.	H	α-helix	trans	-113.3	-6.9	-171	-56.5	-67.4	0	0	0	113.1	P41 G42 P43 G68 W76	P41-F72 HydrophobicContact CB-CB 4.41Å; P41-F72 HydrophobicContact CB-CD1 4.38Å; P41-F72 HydrophobicContact CG-CB 4.37Å; P41-F72 WeakPolarHBondContact CG-O 3.18Å; G42-F72 VanDerWaalsContact C-CE1 3.47Å; P43-F72 HydrophobicContact CB-CE2 4.21Å; P43-F72 HydrophobicContact CB-CZ 3.85Å; P43-F72 HydrophobicContact CG-CE2 4.21Å; P43-F72 HydrophobicContact CG-CZ 4.27Å; P43-F72 VanDerWaalsContact N-CZ 3.33Å; G68-F72 PolarHBondContact O-N 3.19Å; F72-W76 HydrophobicContact CB-CB 3.53Å; F72-W76 HydrophobicContact CB-CG 4.18Å; F72-W76 HydrophobicContact CD2-CB 4.22Å; F72-W76 HydrophobicContact CD2-CG 4.16Å; F72-W76 HydrophobicContact CG-CB 4.07Å; F72-W76 HydrophobicContact CG-CG 4.49Å
73	G	94.3	Very high	88.7	Confident	25 Å²	25	50.5 Å²	50.5	26%	0.258	31%	0.305	S	S	.	.			trans	88.8	-163.5	-177.2	0	0	0	0	0	113	A69 V75	A69-G73 WeakPolarHBondContact CA-O 3.22Å; A69-G73 CarbonylContact O-C 3.58Å; A69-G73 VanDerWaalsContact O-CA 3.26Å; A69-G73 WeakPolarHBondContact O-CA 3.41Å; A69-G73 PolarHBondContact O-N 2.89Å; A69-G73 VanDerWaalsContact O-N 3.08Å; G73-V75 VanDerWaalsContact C-N 3.27Å; G73-V75 PolarHBondContact O-N 3.21Å
74	P	94.9	Very high	88.4	Confident	70 Å²	70	55.3 Å²	55.3	46%	0.455	32%	0.32	S	S	.	.	S	Bend	trans	-72.1	-16.4	-167.4	29.6	-36.9	0	0	0	114.5	A89 A90 L93	P74-A89 PolarHBondContact O-N 3.41Å; P74-A90 HydrophobicContact CB-CB 3.64Å; P74-L93 HydrophobicContact CB-CD1 4.02Å; P74-L93 HydrophobicContact CG-CD1 4.31Å
75	V	96.7	Very high	88.5	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.036	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	129.3	177.6	-175.4	0	0	0	0	109.3	I40 G73 V86 Y87 L93 V397 Y400	I40-V75 HydrophobicContact CD1-CG1 4.34Å; I40-V75 HydrophobicContact CG2-CG1 4.11Å; G73-V75 VanDerWaalsContact C-N 3.27Å; G73-V75 PolarHBondContact O-N 3.21Å; V75-V86 HydrophobicContact CG1-CG1 3.75Å; V75-Y87 VanDerWaalsContact CA-O 3.29Å; V75-Y87 WeakPolarHBondContact CA-O 3.36Å; V75-L93 HydrophobicContact CG2-CD1 3.39Å; V75-V397 HydrophobicContact CG2-CG1 4.22Å; V75-Y400 HydrophobicContact CB-CD2 4.46Å; V75-Y400 HydrophobicContact CB-CE2 4.37Å; V75-Y400 HydrophobicContact CG1-CD2 4.36Å
76	W	95.8	Very high	88.7	Confident	9 Å²	9	54 Å²	54	3%	0.034	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160	173.9	72.6	95.3	0	0	0	112.3	I40 P41 Q65 A69 F72 V86 Y87 A89 C411	I40-W76 VanDerWaalsContact CG2-C 3.49Å; P41-W76 CarbonylContact O-C 3.6Å; P41-W76 WeakPolarHBondContact O-CA 3.26Å; P41-W76 VanDerWaalsContact O-CB 3.26Å; P41-W76 WeakPolarHBondContact O-CB 3.38Å; Q65-W76 WeakPolarHBondContact O-CH2 3.36Å; A69-W76 HydrophobicContact CB-CH2 4.39Å; A69-W76 HydrophobicContact CB-CZ3 4.07Å; F72-W76 HydrophobicContact CB-CB 3.53Å; F72-W76 HydrophobicContact CB-CG 4.18Å; F72-W76 HydrophobicContact CD2-CB 4.22Å; F72-W76 HydrophobicContact CD2-CG 4.16Å; F72-W76 HydrophobicContact CG-CB 4.07Å; F72-W76 HydrophobicContact CG-CG 4.49Å; W76-V86 CarbonylContact O-C 3.5Å; W76-V86 WeakPolarHBondContact O-CA 3.45Å; W76-Y87 AromaticContact CD1-CD2 3.87Å; W76-Y87 HydrophobicContact CD2-CG 4.27Å; W76-Y87 AromaticContact CE2-CD2 3.92Å; W76-Y87 AromaticContact CE2-CG 3.52Å; W76-Y87 HydrophobicContact CH2-CG 4.4Å; W76-Y87 AromaticContact CZ2-CD1 3.85Å; W76-Y87 HydrophobicContact CZ2-CD1 3.85Å; W76-Y87 HydrophobicContact CZ2-CD2 4.41Å; W76-Y87 AromaticContact CZ2-CG 3.6Å; W76-Y87 HydrophobicContact CZ2-CG 3.6Å; W76-Y87 PolarHBondContact N-O 2.79Å; W76-Y87 VanDerWaalsContact N-O 3.12Å; W76-Y87 AromaticContact NE1-CD2 3.41Å; W76-Y87 AromaticContact NE1-CG 3.51Å; W76-Y87 PolarHBondContact O-N 2.79Å; W76-A89 HydrophobicContact CH2-CB 4.02Å; W76-A89 HydrophobicContact CZ3-CB 3.64Å; W76-C411 HydrophobicContact CH2-CB 4.43Å; W76-C411 VanDerWaalsContact CH2-SG 3.57Å
77	L	93.9	Very high	88.8	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.152	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.8	179.6	-179	68.7	0	0	0	109.2	L37 I40 P41 G42 P43 R84 V86	L37-L77 HydrophobicContact CD1-CD1 4.37Å; I40-L77 HydrophobicContact CB-CB 4.09Å; I40-L77 HydrophobicContact CG2-CB 3.75Å; P41-L77 PolarHBondContact O-N 3.29Å; G42-L77 VanDerWaalsContact CA-O 3.25Å; G42-L77 WeakPolarHBondContact CA-O 3.5Å; P43-L77 WeakPolarHBondContact CD-O 3.47Å; L77-R84 HydrophobicContact CD1-CB 4.4Å; L77-V86 HydrophobicContact CD1-CG2 3.86Å
78	A	90.1	Very high	89	Confident	2 Å²	2	49 Å²	49	2%	0.017	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.1	167.6	0	0	0	0	0	110.7	P43 F48 T85 Y87	P43-A78 HydrophobicContact CG-CB 4.08Å; F48-A78 HydrophobicContact CD1-CB 4.44Å; F48-A78 HydrophobicContact CD2-CB 3.88Å; F48-A78 HydrophobicContact CE1-CB 4.34Å; F48-A78 HydrophobicContact CE2-CB 3.75Å; F48-A78 HydrophobicContact CG-CB 4.22Å; F48-A78 HydrophobicContact CZ-CB 3.99Å; A78-T85 PolarHBondContact N-O 3.43Å; A78-T85 PolarHBondContact O-N 2.92Å; A78-Y87 HydrophobicContact CB-CD2 4.28Å; A78-Y87 HydrophobicContact CB-CE2 3.63Å
79	S	82.3	Confident	89.3	Confident	27 Å²	27	49.2 Å²	49.2	19%	0.189	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.4	-179.3	-60.7	0	0	0	0	110.2	F48 V83	F48-S79 WeakPolarHBondContact CD1-O 3.49Å; S79-V83 WeakPolarHBondContact CA-O 3.38Å
80	F	70.8	Confident	89.4	Confident	51 Å²	51	48.9 Å²	48.9	22%	0.224	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	110.4	173.6	-176.2	-97.3	0	0	0	110.2	F48 L49 L52 F53 T82 V83 A237	F48-F80 HydrophobicContact CE1-CB 4.09Å; F48-F80 HydrophobicContact CE1-CD2 4.44Å; L49-F80 HydrophobicContact CD2-CD2 3.8Å; L49-F80 HydrophobicContact CD2-CE2 3.69Å; L52-F80 HydrophobicContact CD2-CD2 3.32Å; L52-F80 HydrophobicContact CD2-CE2 3.17Å; L52-F80 HydrophobicContact CD2-CG 4.33Å; L52-F80 HydrophobicContact CD2-CZ 4.09Å; F53-F80 HydrophobicContact CE2-CE2 4.05Å; F53-F80 HydrophobicContact CZ-CE2 4.18Å; F53-F80 HydrophobicContact CZ-CZ 4.38Å; F80-T82 PolarHBondContact O-N 2.92Å; F80-V83 PolarHBondContact N-O 2.91Å; F80-V83 PolarHBondContact O-N 3.43Å; F80-A237 HydrophobicContact CE1-CB 3.77Å; F80-A237 HydrophobicContact CZ-CB 3.9Å
81	G	69.2	Low	89.5	Confident	68 Å²	68	45 Å²	45	70%	0.701	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-123	-173	0	0	0	0	0	111
82	T	68.1	Low	89.7	Confident	146 Å²	146	40.7 Å²	40.7	90%	0.896	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.3	176.8	55.3	0	0	0	0	113.6	F80	F80-T82 PolarHBondContact O-N 2.92Å
83	V	76.3	Confident	89.8	Confident	68 Å²	68	40 Å²	40	41%	0.412	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.1	-175	-176	0	0	0	0	109.5	S79 F80 L407	S79-V83 WeakPolarHBondContact CA-O 3.38Å; F80-V83 PolarHBondContact N-O 2.91Å; F80-V83 PolarHBondContact O-N 3.43Å; V83-L407 HydrophobicContact CG1-CD2 3.79Å
84	R	86.8	Confident	89.9	Confident	162 Å²	162	38.8 Å²	38.8	61%	0.611	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.8	169.4	-65.5	-175.3	177.6	177.1	-0.6	108.8	L77	L77-R84 HydrophobicContact CD1-CB 4.4Å
85	T	92.5	Very high	90	Very high	12 Å²	12	37 Å²	37	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	122.2	-177.8	-57.5	0	0	0	0	110.3	A78 Y87 L407 T409	A78-T85 PolarHBondContact N-O 3.43Å; A78-T85 PolarHBondContact O-N 2.92Å; T85-Y87 HydrophobicContact CG2-CD2 4.07Å; T85-Y87 HydrophobicContact CG2-CE1 4.18Å; T85-Y87 HydrophobicContact CG2-CE2 3.62Å; T85-Y87 VanDerWaalsContact O-CD2 3.29Å; T85-Y87 WeakPolarHBondContact O-CD2 3.45Å; T85-Y87 WeakPolarHBondContact O-CE2 3.43Å; T85-L407 VanDerWaalsContact CA-O 3.31Å; T85-L407 WeakPolarHBondContact CA-O 3.46Å; T85-L407 HydrophobicContact CG2-CD2 4.39Å; T85-L407 HydrophobicContact CG2-CG 4.17Å; T85-L407 WeakPolarHBondContact OG1-CD2 3.38Å; T85-T409 VanDerWaalsContact CG2-OG1 3.26Å; T85-T409 WeakPolarHBondContact CG2-OG1 3.39Å
86	V	96.3	Very high	90	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	129.7	167.5	179.4	0	0	0	0	107.7	L37 I40 V75 W76 L77 V88 I402 T406 L407 V408 T409	L37-V86 HydrophobicContact CD1-CG2 3.55Å; I40-V86 HydrophobicContact CD1-CG1 4.25Å; I40-V86 HydrophobicContact CD1-CG2 4.12Å; V75-V86 HydrophobicContact CG1-CG1 3.75Å; W76-V86 CarbonylContact O-C 3.5Å; W76-V86 WeakPolarHBondContact O-CA 3.45Å; L77-V86 HydrophobicContact CD1-CG2 3.86Å; V86-V88 HydrophobicContact CG1-CG2 4.3Å; V86-I402 HydrophobicContact CB-CD1 4.44Å; V86-I402 HydrophobicContact CG1-CD1 3.9Å; V86-T406 HydrophobicContact CG2-CG2 3.78Å; V86-L407 PolarHBondContact N-O 2.96Å; V86-V408 HydrophobicContact CB-CG1 4.37Å; V86-V408 HydrophobicContact CB-CG2 4.36Å; V86-V408 HydrophobicContact CG1-CG1 4.45Å; V86-V408 CarbonylContact O-C 3.53Å; V86-V408 VanDerWaalsContact O-CA 3.23Å; V86-V408 WeakPolarHBondContact O-CA 3.26Å; V86-T409 PolarHBondContact O-N 3.37Å
87	Y	96.6	Very high	90	Very high	42 Å²	42	39.9 Å²	39.9	17%	0.165	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.2	177.4	-66.6	-97.6	0	0	0	108.8	V75 W76 A78 T85 T409	V75-Y87 VanDerWaalsContact CA-O 3.29Å; V75-Y87 WeakPolarHBondContact CA-O 3.36Å; W76-Y87 AromaticContact CD1-CD2 3.87Å; W76-Y87 HydrophobicContact CD2-CG 4.27Å; W76-Y87 AromaticContact CE2-CD2 3.92Å; W76-Y87 AromaticContact CE2-CG 3.52Å; W76-Y87 HydrophobicContact CH2-CG 4.4Å; W76-Y87 AromaticContact CZ2-CD1 3.85Å; W76-Y87 HydrophobicContact CZ2-CD1 3.85Å; W76-Y87 HydrophobicContact CZ2-CD2 4.41Å; W76-Y87 AromaticContact CZ2-CG 3.6Å; W76-Y87 HydrophobicContact CZ2-CG 3.6Å; W76-Y87 PolarHBondContact N-O 2.79Å; W76-Y87 VanDerWaalsContact N-O 3.12Å; W76-Y87 AromaticContact NE1-CD2 3.41Å; W76-Y87 AromaticContact NE1-CG 3.51Å; W76-Y87 PolarHBondContact O-N 2.79Å; A78-Y87 HydrophobicContact CB-CD2 4.28Å; A78-Y87 HydrophobicContact CB-CE2 3.63Å; T85-Y87 HydrophobicContact CG2-CD2 4.07Å; T85-Y87 HydrophobicContact CG2-CE1 4.18Å; T85-Y87 HydrophobicContact CG2-CE2 3.62Å; T85-Y87 VanDerWaalsContact O-CD2 3.29Å; T85-Y87 WeakPolarHBondContact O-CD2 3.45Å; T85-Y87 WeakPolarHBondContact O-CE2 3.43Å; Y87-T409 WeakPolarHBondContact CA-O 3.48Å; Y87-T409 HydrophobicContact CD1-CG2 4.01Å; Y87-T409 HydrophobicContact CE1-CG2 4.16Å
88	V	97.4	Very high	90.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.1	-178.6	-175.7	0	0	0	0	108.6	V86 L93 V94 V397 V408 T409 C411	V86-V88 HydrophobicContact CG1-CG2 4.3Å; V88-L93 HydrophobicContact CG1-CB 3.56Å; V88-V94 HydrophobicContact CG1-CG2 3.95Å; V88-V397 HydrophobicContact CG1-CG1 4.29Å; V88-V397 HydrophobicContact CG2-CG1 4.18Å; V88-V408 HydrophobicContact CG2-CG1 3.67Å; V88-T409 PolarHBondContact N-O 3.27Å; V88-C411 WeakPolarHBondContact O-CB 3.46Å; V88-C411 PolarHBondContact O-N 3.18Å
89	A	96.8	Very high	90.4	Very high	10 Å²	10	47.4 Å²	47.4	8%	0.083	26%	0.258	C	S	.	.			trans	-123.2	21.2	-173.8	0	0	0	0	0	114.1	A69 P74 W76 C411 A414 T415	A69-A89 HydrophobicContact CB-CB 3.83Å; P74-A89 PolarHBondContact O-N 3.41Å; W76-A89 HydrophobicContact CH2-CB 4.02Å; W76-A89 HydrophobicContact CZ3-CB 3.64Å; A89-C411 HydrophobicContact CB-CB 3.8Å; A89-A414 HydrophobicContact CB-CB 4.06Å; A89-T415 WeakPolarHBondContact O-CG2 3.34Å
90	A	96.4	Very high	91	Very high	21 Å²	21	48.3 Å²	48.3	17%	0.174	26%	0.259	C	S	.	.			trans	-117.5	130.8	173.1	0	0	0	0	0	111.2	P74 A92 L93 V94	P74-A90 HydrophobicContact CB-CB 3.64Å; A90-A92 VanDerWaalsContact C-N 3.34Å; A90-A92 PolarHBondContact O-N 2.96Å; A90-L93 HydrophobicContact CB-CB 4.23Å; A90-L93 HydrophobicContact CB-CD1 4.02Å; A90-L93 HydrophobicContact CB-CG 3.97Å; A90-L93 PolarHBondContact O-N 3.41Å; A90-L93 VanDerWaalsContact O-N 3.13Å; A90-V94 WeakPolarHBondContact O-CG2 3.38Å; A90-V94 PolarHBondContact O-N 2.92Å
91	P	96.4	Very high	92	Very high	7 Å²	7	48.1 Å²	48.1	5%	0.045	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-40.4	-175.9	-26	33.4	0	0	0	114.7	V94 E95 Q421 H441 F443 A444	P91-V94 PolarHBondContact O-N 3.18Å; P91-E95 PolarHBondContact O-N 2.98Å; P91-Q421 HydrophobicContact CG-CG 3.89Å; P91-H441 HydrophobicContact CB-CB 3.64Å; P91-H441 WeakPolarHBondContact CB-ND1 3.47Å; P91-H441 HydrophobicContact CG-CB 4.28Å; P91-F443 HydrophobicContact CB-CB 4.47Å; P91-A444 HydrophobicContact CB-CB 4.15Å; P91-A444 HydrophobicContact CG-CB 3.75Å
92	A	97	Very high	93.1	Very high	58 Å²	58	45.5 Å²	45.5	48%	0.479	23%	0.232	S	C	.	.	H	α-helix	trans	-65.2	-38.5	178.9	0	0	0	0	0	112.1	A90 E95 E96	A90-A92 VanDerWaalsContact C-N 3.34Å; A90-A92 PolarHBondContact O-N 2.96Å; A92-E95 WeakPolarHBondContact O-CB 3.31Å; A92-E95 PolarHBondContact O-N 2.73Å; A92-E96 PolarHBondContact O-N 3.45Å
93	L	97	Very high	94.2	Very high	27 Å²	27	41.9 Å²	41.9	14%	0.141	21%	0.211	C	C	.	.	H	α-helix	trans	-72.6	-35.9	177.1	-60.8	-172.7	0	0	0	112	P74 V75 V88 A90 E95 E96 L97 V397	P74-L93 HydrophobicContact CB-CD1 4.02Å; P74-L93 HydrophobicContact CG-CD1 4.31Å; V75-L93 HydrophobicContact CG2-CD1 3.39Å; V88-L93 HydrophobicContact CG1-CB 3.56Å; A90-L93 HydrophobicContact CB-CB 4.23Å; A90-L93 HydrophobicContact CB-CD1 4.02Å; A90-L93 HydrophobicContact CB-CG 3.97Å; A90-L93 PolarHBondContact O-N 3.41Å; A90-L93 VanDerWaalsContact O-N 3.13Å; L93-E95 VanDerWaalsContact C-N 3.3Å; L93-E96 PolarHBondContact O-N 3.35Å; L93-L97 WeakPolarHBondContact O-CB 3.26Å; L93-L97 PolarHBondContact O-N 3.16Å; L93-V397 HydrophobicContact CB-CG1 3.88Å; L93-V397 HydrophobicContact CD1-CG1 4.3Å; L93-V397 HydrophobicContact CD2-CG1 4.39Å; L93-V397 HydrophobicContact CG-CG1 4.42Å
94	V	96.9	Very high	95.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-41.8	172	171.5	0	0	0	0	110.4	V88 A90 P91 L98 L410 F443 L446	V88-V94 HydrophobicContact CG1-CG2 3.95Å; A90-V94 WeakPolarHBondContact O-CG2 3.38Å; A90-V94 PolarHBondContact O-N 2.92Å; P91-V94 PolarHBondContact O-N 3.18Å; V94-L98 HydrophobicContact CG1-CD1 3.73Å; V94-L98 WeakPolarHBondContact O-CB 3.44Å; V94-L98 WeakPolarHBondContact O-CD1 3.4Å; V94-L98 VanDerWaalsContact O-CG 3.27Å; V94-L98 WeakPolarHBondContact O-CG 3.43Å; V94-L98 PolarHBondContact O-N 3.27Å; V94-L410 HydrophobicContact CG1-CD1 4.28Å; V94-L410 HydrophobicContact CG1-CD2 4.34Å; V94-L410 HydrophobicContact CG2-CD2 4.31Å; V94-F443 HydrophobicContact CG1-CB 4.34Å; V94-F443 HydrophobicContact CG1-CD1 4.17Å; V94-L446 HydrophobicContact CG1-CD1 3.94Å
95	E	96.9	Very high	95.5	Very high	33 Å²	33	36.2 Å²	36.2	15%	0.154	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-48.6	174.4	176.9	166.7	-139.8	0	0	112.5	P91 A92 L93 L97 L98 R99 H441 F443	P91-E95 PolarHBondContact O-N 2.98Å; A92-E95 WeakPolarHBondContact O-CB 3.31Å; A92-E95 PolarHBondContact O-N 2.73Å; L93-E95 VanDerWaalsContact C-N 3.3Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.41Å; E95-L98 PolarHBondContact O-N 2.92Å; E95-R99 VanDerWaalsContact CD-CZ 3.48Å; E95-R99 VanDerWaalsContact CD-NH2 3.28Å; E95-R99 HydrophobicContact CG-CG 4.19Å; E95-R99 WeakPolarHBondContact O-CB 3.4Å; E95-R99 WeakPolarHBondContact O-CG 3.31Å; E95-R99 PolarHBondContact O-N 3.26Å; E95-R99 IonicContact OE1-CZ 2.83Å; E95-R99 IonicContact OE1-NE 2.75Å; E95-R99 PolarHBondContact OE1-NE 2.98Å; E95-R99 VanDerWaalsContact OE1-NE 3.11Å; E95-R99 IonicContact OE1-NH2 3.38Å; E95-R99 PolarHBondContact OE1-NH2 2.88Å; E95-R99 IonicContact OE2-NH2 3.9Å; E95-H441 IonicContact OE2-CE1 2.73Å; E95-H441 PolarHBondContact OE2-CE1 3.33Å; E95-H441 IonicContact OE2-NE2 2.63Å; E95-H441 PolarHBondContact OE2-NE2 3.45Å; E95-F443 HydrophobicContact CB-CB 4.38Å; E95-F443 HydrophobicContact CB-CD1 4.01Å; E95-F443 HydrophobicContact CB-CD2 3.68Å; E95-F443 HydrophobicContact CB-CE1 4.2Å; E95-F443 HydrophobicContact CB-CE2 3.88Å; E95-F443 HydrophobicContact CB-CG 3.77Å; E95-F443 HydrophobicContact CB-CZ 4.14Å; E95-F443 VanDerWaalsContact CD-CE2 3.45Å; E95-F443 HydrophobicContact CG-CD2 3.91Å; E95-F443 HydrophobicContact CG-CE1 4.35Å; E95-F443 HydrophobicContact CG-CE2 3.61Å; E95-F443 HydrophobicContact CG-CG 4.43Å; E95-F443 HydrophobicContact CG-CZ 3.85Å; E95-F443 WeakPolarHBondContact OE1-CE2 3.32Å
96	E	96.4	Very high	95.5	Very high	68 Å²	68	39.5 Å²	39.5	32%	0.318	20%	0.198	S	C	.	.	H	α-helix	trans	-55.1	-45.5	178.3	-177.6	178.1	-148.9	0	0	111.6	A92 L93 Q100 V397 G398	A92-E96 PolarHBondContact O-N 3.45Å; L93-E96 PolarHBondContact O-N 3.35Å; E96-Q100 PolarHBondContact O-NE2 3.08Å; E96-V397 WeakPolarHBondContact OE2-CA 3.42Å; E96-G398 PolarHBondContact OE2-N 3.05Å
97	L	96.2	Very high	95.3	Very high	6 Å²	6	43 Å²	43	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-50.4	175.8	179.6	153.9	0	0	0	111.7	L93 E95 R99 Q100 R389 I395 V397 V408 L410	L93-L97 WeakPolarHBondContact O-CB 3.26Å; L93-L97 PolarHBondContact O-N 3.16Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.41Å; L97-R99 VanDerWaalsContact C-N 3.28Å; L97-R99 PolarHBondContact O-N 3.39Å; L97-Q100 PolarHBondContact O-N 3.24Å; L97-Q100 VanDerWaalsContact O-N 3.13Å; L97-R389 HydrophobicContact CD2-CB 4.19Å; L97-R389 HydrophobicContact CD2-CG 4.05Å; L97-I395 HydrophobicContact CB-CD1 4.48Å; L97-I395 HydrophobicContact CD1-CD1 3.86Å; L97-I395 HydrophobicContact CG-CD1 3.69Å; L97-V397 HydrophobicContact CB-CG2 4.1Å; L97-V397 HydrophobicContact CD1-CG2 4.15Å; L97-V397 HydrophobicContact CG-CG2 4.49Å; L97-V408 HydrophobicContact CD1-CB 4.01Å; L97-V408 HydrophobicContact CD1-CG1 3.48Å; L97-V408 VanDerWaalsContact CD1-CG1 3.48Å; L97-V408 HydrophobicContact CD1-CG2 4.22Å; L97-L410 HydrophobicContact CD1-CD2 4.06Å; L97-L410 HydrophobicContact CD2-CD2 4.04Å
98	L	95.6	Very high	94.6	Very high	7 Å²	7	42.7 Å²	42.7	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-69.4	-25.6	-174.7	-74.3	168.5	0	0	0	113	V94 E95 Q100 E101 R389 L410 F443 L446 F450	V94-L98 HydrophobicContact CG1-CD1 3.73Å; V94-L98 WeakPolarHBondContact O-CB 3.44Å; V94-L98 WeakPolarHBondContact O-CD1 3.4Å; V94-L98 VanDerWaalsContact O-CG 3.27Å; V94-L98 WeakPolarHBondContact O-CG 3.43Å; V94-L98 PolarHBondContact O-N 3.27Å; E95-L98 PolarHBondContact O-N 2.92Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; L98-E101 WeakPolarHBondContact O-CB 3.32Å; L98-E101 PolarHBondContact O-N 3.33Å; L98-R389 HydrophobicContact CD2-CG 4.43Å; L98-L410 HydrophobicContact CD1-CD1 4.16Å; L98-L410 HydrophobicContact CD2-CD1 4.06Å; L98-L410 HydrophobicContact CG-CD1 4.24Å; L98-F443 HydrophobicContact CB-CE1 4.24Å; L98-F443 HydrophobicContact CD1-CD1 3.74Å; L98-F443 HydrophobicContact CD1-CE1 3.68Å; L98-L446 HydrophobicContact CD1-CD1 4.16Å; L98-F450 HydrophobicContact CB-CD1 4.08Å; L98-F450 HydrophobicContact CD1-CB 3.86Å; L98-F450 HydrophobicContact CD1-CD1 4.05Å; L98-F450 HydrophobicContact CD1-CG 4.22Å; L98-F450 HydrophobicContact CG-CD1 4.5Å
99	R	95.5	Very high	93.5	Very high	182 Å²	182	46 Å²	46	69%	0.687	24%	0.237	S	C	*	.	H	α-helix	trans	-72	-22.1	173.4	-74.2	179.7	178	-174	-0.9	113	E95 L97 E101	E95-R99 VanDerWaalsContact CD-CZ 3.48Å; E95-R99 VanDerWaalsContact CD-NH2 3.28Å; E95-R99 HydrophobicContact CG-CG 4.19Å; E95-R99 WeakPolarHBondContact O-CB 3.4Å; E95-R99 WeakPolarHBondContact O-CG 3.31Å; E95-R99 PolarHBondContact O-N 3.26Å; E95-R99 IonicContact OE1-CZ 2.83Å; E95-R99 IonicContact OE1-NE 2.75Å; E95-R99 PolarHBondContact OE1-NE 2.98Å; E95-R99 VanDerWaalsContact OE1-NE 3.11Å; E95-R99 IonicContact OE1-NH2 3.38Å; E95-R99 PolarHBondContact OE1-NH2 2.88Å; E95-R99 IonicContact OE2-NH2 3.9Å; L97-R99 VanDerWaalsContact C-N 3.28Å; L97-R99 PolarHBondContact O-N 3.39Å; R99-E101 VanDerWaalsContact C-N 3.32Å
100	Q	96.1	Very high	92.4	Very high	46 Å²	46	48.2 Å²	48.2	22%	0.215	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.1	176.4	-68.4	171.3	82.6	0	0	113.2	E96 L97 L98 K393 I395 H396	E96-Q100 PolarHBondContact O-NE2 3.08Å; L97-Q100 PolarHBondContact O-N 3.24Å; L97-Q100 VanDerWaalsContact O-N 3.13Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; Q100-K393 VanDerWaalsContact O-CE 3.29Å; Q100-K393 WeakPolarHBondContact O-CE 3.3Å; Q100-I395 HydrophobicContact CB-CB 4.44Å; Q100-I395 HydrophobicContact CB-CG2 3.95Å; Q100-H396 PolarHBondContact NE2-O 2.82Å
101	E	91.8	Very high	91.6	Very high	48 Å²	48	49.5 Å²	49.5	22%	0.224	25%	0.253	C	S	.	.			trans	-59	131	-177.3	-172	179.7	-105	0	0	112.2	L98 R99 P105 R389	L98-E101 WeakPolarHBondContact O-CB 3.32Å; L98-E101 PolarHBondContact O-N 3.33Å; R99-E101 VanDerWaalsContact C-N 3.32Å; E101-P105 HydrophobicContact CG-CB 3.63Å; E101-P105 HydrophobicContact CG-CG 3.58Å; E101-P105 VanDerWaalsContact OE1-CB 3.31Å; E101-P105 WeakPolarHBondContact OE1-CB 3.45Å; E101-P105 WeakPolarHBondContact OE2-CG 3.48Å; E101-R389 IonicContact OE1-CZ 3.68Å; E101-R389 IonicContact OE1-NE 2.82Å; E101-R389 PolarHBondContact OE1-NE 2.97Å; E101-R389 IonicContact OE1-NH2 3.69Å; E101-R389 PolarHBondContact OE1-NH2 3.24Å
102	G	91.8	Very high	91.1	Very high	13 Å²	13	49.2 Å²	49.2	13%	0.134	25%	0.251	C	S	.	.			trans	-67.8	173.3	175.3	0	0	0	0	0	113.7	R104	G102-R104 PolarHBondContact O-N 2.87Å
103	P	92	Very high	90.8	Very high	69 Å²	69	46.7 Å²	46.7	45%	0.448	23%	0.229	S	C	.	.	S	Bend	trans	-66.5	-21.7	-176.7	27.4	-35.1	0	0	0	113.8	Q135 K452	P103-Q135 PolarHBondContact O-OE1 3.5Å; P103-K452 WeakPolarHBondContact O-CD 3.47Å; P103-K452 PolarHBondContact O-NZ 3.45Å
104	R	94.8	Very high	90.4	Very high	106 Å²	106	46.9 Å²	46.9	40%	0.4	23%	0.231	S	C	.	.	S	Bend	trans	-125.7	78	-177.8	-67.3	173.8	-76.6	-162.7	-4.4	108.8	G102 E106 E132 Q135	G102-R104 PolarHBondContact O-N 2.87Å; R104-E106 PolarHBondContact O-N 3.42Å; R104-E132 IonicContact NH1-OE1 2.98Å; R104-E132 PolarHBondContact NH1-OE1 3.38Å; R104-Q135 HydrophobicContact CG-CB 4.43Å
105	P	94.6	Very high	90.1	Very high	6 Å²	6	48.5 Å²	48.5	4%	0.039	24%	0.239	C	C	.	.			trans	-66	133	-173.1	-16.6	29.5	0	0	0	110.8	E101 K452 R453	E101-P105 HydrophobicContact CG-CB 3.63Å; E101-P105 HydrophobicContact CG-CG 3.58Å; E101-P105 VanDerWaalsContact OE1-CB 3.31Å; E101-P105 WeakPolarHBondContact OE1-CB 3.45Å; E101-P105 WeakPolarHBondContact OE2-CG 3.48Å; P105-K452 HydrophobicContact CG-CB 4.25Å; P105-R453 HydrophobicContact CB-CB 4.04Å; P105-R453 HydrophobicContact CG-CB 4.12Å; P105-R453 WeakPolarHBondContact O-CD 3.24Å; P105-R453 PolarHBondContact O-NH1 3.41Å
106	E	93.6	Very high	90	Very high	80 Å²	80	47 Å²	47	37%	0.374	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-102.7	148.8	176	-62.7	-168.9	-176.6	0	0	111.5	R104 R389 V390	R104-E106 PolarHBondContact O-N 3.42Å; E106-R389 WeakPolarHBondContact O-CA 3.46Å; E106-R389 WeakPolarHBondContact O-CD 3.43Å; E106-V390 HydrophobicContact CB-CB 4.16Å; E106-V390 PolarHBondContact O-N 2.93Å
107	R	91.1	Very high	89.8	Confident	73 Å²	73	43.9 Å²	43.9	28%	0.275	22%	0.217	S	C	.	.			trans	-113.7	-177.2	175.4	-62.4	-172	175.8	-178	-4.3	110	S109 S388 R453	R107-S109 PolarHBondContact O-N 2.94Å; R107-S388 WeakPolarHBondContact CG-O 3.47Å; R107-R453 PolarHBondContact NH2-O 2.82Å
108	C	83.3	Confident	89.6	Confident	37 Å²	37	52 Å²	52	25%	0.25	25%	0.248	C	C	.	.			trans	-56.3	124.1	168.9	-175.8	0	0	0	0	109.7	F110 L407	C108-F110 PolarHBondContact O-N 3.37Å; C108-L407 HydrophobicContact CB-CD1 3.89Å
109	S	72.8	Confident	89.4	Confident	68 Å²	68	59 Å²	59	48%	0.476	27%	0.274	S	S	.	.			trans	-63.6	123.4	178.2	178.4	0	0	0	0	110.6	R107 S111	R107-S109 PolarHBondContact O-N 2.94Å; S109-S111 PolarHBondContact O-N 2.96Å; S109-S111 PolarHBondContact OG-N 3.07Å
110	F	74.7	Confident	89.2	Confident	58 Å²	58	56.5 Å²	56.5	25%	0.254	26%	0.264	S	S	.	.			trans	-77.3	59.1	166	-65.2	-79.8	0	0	0	110	C108 P112 W113 T114 T232 M236	C108-F110 PolarHBondContact O-N 3.37Å; F110-P112 VanDerWaalsContact C-N 3.27Å; F110-P112 VanDerWaalsContact O-N 3.08Å; F110-W113 HydrophobicContact CB-CB 4.08Å; F110-W113 HydrophobicContact CB-CD2 3.92Å; F110-W113 HydrophobicContact CB-CE3 4.1Å; F110-W113 HydrophobicContact CB-CG 3.93Å; F110-W113 HydrophobicContact CD1-CD2 4.28Å; F110-W113 HydrophobicContact CD1-CE3 4.42Å; F110-W113 HydrophobicContact CD1-CZ2 4.39Å; F110-W113 HydrophobicContact CG-CD2 4.2Å; F110-W113 HydrophobicContact CG-CE3 4.12Å; F110-W113 HydrophobicContact CG-CZ3 4.5Å; F110-W113 WeakPolarHBondContact O-CA 3.4Å; F110-W113 WeakPolarHBondContact O-CB 3.38Å; F110-W113 PolarHBondContact O-N 3.42Å; F110-T114 PolarHBondContact O-N 2.95Å; F110-T232 HydrophobicContact CD1-CG2 4.49Å; F110-M236 HydrophobicContact CD1-SD 4.34Å
111	S	78.6	Confident	89	Confident	48 Å²	48	62 Å²	62	34%	0.336	29%	0.29	S	S	.	.	H	α-helix	trans	-46.1	-42.6	-174.9	168.8	0	0	0	0	113.8	S109 W113 T114 E115	S109-S111 PolarHBondContact O-N 2.96Å; S109-S111 PolarHBondContact OG-N 3.07Å; S111-W113 VanDerWaalsContact C-N 3.3Å; S111-W113 PolarHBondContact O-N 3.36Å; S111-T114 WeakPolarHBondContact CA-OG1 3.24Å; S111-T114 PolarHBondContact O-N 3.28Å; S111-T114 PolarHBondContact O-OG1 3.04Å; S111-E115 VanDerWaalsContact O-CB 3.26Å; S111-E115 WeakPolarHBondContact O-CB 3.21Å; S111-E115 PolarHBondContact O-N 3.5Å
112	P	86.3	Confident	89	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-36	175.6	-28.4	39.1	0	0	0	114.6	F110 H116 T235 M236 W250 L253	F110-P112 VanDerWaalsContact C-N 3.27Å; F110-P112 VanDerWaalsContact O-N 3.08Å; P112-H116 PolarHBondContact O-N 3.11Å; P112-H116 VanDerWaalsContact O-N 3.08Å; P112-T235 HydrophobicContact CB-CG2 3.76Å; P112-T235 HydrophobicContact CG-CG2 3.68Å; P112-M236 HydrophobicContact CG-CG 3.73Å; P112-W250 HydrophobicContact CB-CZ3 4Å; P112-W250 WeakPolarHBondContact O-CZ3 3.36Å; P112-L253 HydrophobicContact CB-CD1 4.06Å; P112-L253 HydrophobicContact CB-CD2 4.31Å
113	W	91.1	Very high	88.9	Confident	5 Å²	5	63 Å²	63	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-73.8	-48.5	-178.7	-61.3	5.8	0	0	0	110.1	F110 S111 E115 H116 R117 L127 T128 T232 W257 L316	F110-W113 HydrophobicContact CB-CB 4.08Å; F110-W113 HydrophobicContact CB-CD2 3.92Å; F110-W113 HydrophobicContact CB-CE3 4.1Å; F110-W113 HydrophobicContact CB-CG 3.93Å; F110-W113 HydrophobicContact CD1-CD2 4.28Å; F110-W113 HydrophobicContact CD1-CE3 4.42Å; F110-W113 HydrophobicContact CD1-CZ2 4.39Å; F110-W113 HydrophobicContact CG-CD2 4.2Å; F110-W113 HydrophobicContact CG-CE3 4.12Å; F110-W113 HydrophobicContact CG-CZ3 4.5Å; F110-W113 WeakPolarHBondContact O-CA 3.4Å; F110-W113 WeakPolarHBondContact O-CB 3.38Å; F110-W113 PolarHBondContact O-N 3.42Å; S111-W113 VanDerWaalsContact C-N 3.3Å; S111-W113 PolarHBondContact O-N 3.36Å; W113-E115 PolarHBondContact O-N 3.42Å; W113-H116 WeakPolarHBondContact O-CB 3.23Å; W113-H116 PolarHBondContact O-N 3.05Å; W113-H116 VanDerWaalsContact O-N 3.09Å; W113-R117 WeakPolarHBondContact O-CG 3.29Å; W113-R117 PolarHBondContact O-N 3.11Å; W113-L127 HydrophobicContact CZ3-CD2 4.29Å; W113-T128 HydrophobicContact CB-CG2 3.84Å; W113-T128 HydrophobicContact CE3-CG2 3.81Å; W113-T232 HydrophobicContact CZ2-CG2 4.19Å; W113-T232 VanDerWaalsContact NE1-CG2 3.3Å; W113-T232 PolarHBondContact NE1-OG1 3.31Å; W113-W257 HydrophobicContact CB-CZ2 4.49Å; W113-W257 AromaticContact CD1-NE1 3.44Å; W113-W257 HydrophobicContact CD2-CH2 4.39Å; W113-W257 AromaticContact CD2-CZ2 3.41Å; W113-W257 HydrophobicContact CD2-CZ2 3.41Å; W113-W257 VanDerWaalsContact CD2-CZ2 3.41Å; W113-W257 AromaticContact CE2-CZ2 3.62Å; W113-W257 HydrophobicContact CE3-CH2 4.11Å; W113-W257 AromaticContact CE3-CZ2 3.54Å; W113-W257 HydrophobicContact CE3-CZ2 3.54Å; W113-W257 AromaticContact CG-CZ2 3.85Å; W113-W257 HydrophobicContact CG-CZ2 3.85Å; W113-W257 AromaticContact CG-NE1 3.76Å; W113-W257 HydrophobicContact CH2-CZ2 4.08Å; W113-W257 AromaticContact CZ2-CZ2 3.97Å; W113-W257 HydrophobicContact CZ2-CZ2 3.97Å; W113-W257 HydrophobicContact CZ3-CH2 4.21Å; W113-W257 AromaticContact CZ3-CZ2 3.88Å; W113-W257 HydrophobicContact CZ3-CZ2 3.88Å; W113-W257 AromaticContact NE1-NE1 3.63Å; W113-L316 HydrophobicContact CH2-CD2 3.69Å; W113-L316 HydrophobicContact CZ2-CD2 4.35Å; W113-L316 HydrophobicContact CZ3-CD2 4.06Å
114	T	89.4	Confident	88.8	Confident	30 Å²	30	60.7 Å²	60.7	18%	0.184	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-36.4	175.7	51.9	0	0	0	0	112.1	F110 S111 R117 R118	F110-T114 PolarHBondContact O-N 2.95Å; S111-T114 WeakPolarHBondContact CA-OG1 3.24Å; S111-T114 PolarHBondContact O-N 3.28Å; S111-T114 PolarHBondContact O-OG1 3.04Å; T114-R117 PolarHBondContact O-N 2.98Å; T114-R118 WeakPolarHBondContact O-CB 2.99Å; T114-R118 PolarHBondContact O-N 2.98Å
115	E	90.6	Very high	88.7	Confident	35 Å²	35	55.7 Å²	55.7	16%	0.164	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-39.4	175.7	176.9	64.2	-176.1	0	0	111.7	S111 W113 R118 R119 W250	S111-E115 VanDerWaalsContact O-CB 3.26Å; S111-E115 WeakPolarHBondContact O-CB 3.21Å; S111-E115 PolarHBondContact O-N 3.5Å; W113-E115 PolarHBondContact O-N 3.42Å; E115-R118 PolarHBondContact O-N 3.21Å; E115-R118 IonicContact OE2-CZ 3.95Å; E115-R118 IonicContact OE2-NH1 2.96Å; E115-R118 PolarHBondContact OE2-NH1 3.1Å; E115-R119 WeakPolarHBondContact O-CG 3.31Å; E115-R119 PolarHBondContact O-N 3Å; E115-R119 IonicContact OE1-CZ 2.72Å; E115-R119 VanDerWaalsContact OE1-CZ 3.25Å; E115-R119 IonicContact OE1-NE 3.1Å; E115-R119 PolarHBondContact OE1-NE 3.37Å; E115-R119 IonicContact OE1-NH2 2.65Å; E115-R119 PolarHBondContact OE1-NH2 3.03Å; E115-W250 HydrophobicContact CB-CH2 3.91Å; E115-W250 HydrophobicContact CG-CH2 3.55Å; E115-W250 HydrophobicContact CG-CZ2 3.99Å
116	H	93.1	Very high	88.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-46.4	172	167.3	-87.7	0	0	0	111.6	P112 W113 R118 R119 R120 R122 W257 D258	P112-H116 PolarHBondContact O-N 3.11Å; P112-H116 VanDerWaalsContact O-N 3.08Å; W113-H116 WeakPolarHBondContact O-CB 3.23Å; W113-H116 PolarHBondContact O-N 3.05Å; W113-H116 VanDerWaalsContact O-N 3.09Å; H116-R118 PolarHBondContact O-N 3.37Å; H116-R119 PolarHBondContact O-N 3.28Å; H116-R120 WeakPolarHBondContact O-CB 3.45Å; H116-R120 WeakPolarHBondContact O-CG 3.23Å; H116-R120 PolarHBondContact O-N 3.05Å; H116-R122 PolarHBondContact CE1-NH1 3.18Å; H116-W257 VanDerWaalsContact CE1-CB 3.4Å; H116-W257 WeakPolarHBondContact CE1-CB 2.99Å; H116-W257 WeakPolarHBondContact NE2-CB 3.33Å; H116-D258 IonicContact CD2-OD1 2.85Å; H116-D258 IonicContact CE1-OD1 2.77Å; H116-D258 IonicContact NE2-OD1 3.26Å; H116-D258 PolarHBondContact NE2-OD1 2.86Å
117	R	93	Very high	88.3	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-55.7	-49.8	176.8	-62.3	-49.9	179.8	-107	-7.4	111.8	W113 T114 R119 R120 Q121 R122 F261 E313	W113-R117 WeakPolarHBondContact O-CG 3.29Å; W113-R117 PolarHBondContact O-N 3.11Å; T114-R117 PolarHBondContact O-N 2.98Å; R117-R119 PolarHBondContact O-N 3.38Å; R117-R120 CarbonylContact O-C 3.47Å; R117-R120 PolarHBondContact O-N 2.84Å; R117-Q121 PolarHBondContact O-N 3.22Å; R117-R122 WeakPolarHBondContact CB-O 3.36Å; R117-R122 PolarHBondContact O-N 2.83Å; R117-F261 VanDerWaalsContact CZ-CZ 3.48Å; R117-E313 IonicContact CZ-OE1 3.47Å; R117-E313 IonicContact NE-OE1 3.38Å; R117-E313 IonicContact NH2-OE1 3.57Å; R117-E313 PolarHBondContact NH2-OE1 3.45Å
118	R	92.1	Very high	88.4	Confident	176 Å²	176	51.4 Å²	51.4	66%	0.664	24%	0.243	S	C	*	.	H	α-helix	trans	-58.5	-49	178.2	-171	-171.3	-58.8	150.8	-6.9	112.1	T114 E115 H116 R120 Q121	T114-R118 WeakPolarHBondContact O-CB 2.99Å; T114-R118 PolarHBondContact O-N 2.98Å; E115-R118 PolarHBondContact O-N 3.21Å; E115-R118 IonicContact OE2-CZ 3.95Å; E115-R118 IonicContact OE2-NH1 2.96Å; E115-R118 PolarHBondContact OE2-NH1 3.1Å; H116-R118 PolarHBondContact O-N 3.37Å; R118-R120 VanDerWaalsContact C-N 3.31Å; R118-R120 PolarHBondContact O-N 3.01Å; R118-Q121 PolarHBondContact O-N 3.46Å
119	R	91.8	Very high	88.8	Confident	155 Å²	155	49.7 Å²	49.7	59%	0.585	23%	0.232	S	C	*	.	H	α-helix	trans	-65.9	-31	-179.6	-73.3	-172.4	-170.4	-155.6	0.4	113.7	E115 H116 R117	E115-R119 WeakPolarHBondContact O-CG 3.31Å; E115-R119 PolarHBondContact O-N 3Å; E115-R119 IonicContact OE1-CZ 2.72Å; E115-R119 VanDerWaalsContact OE1-CZ 3.25Å; E115-R119 IonicContact OE1-NE 3.1Å; E115-R119 PolarHBondContact OE1-NE 3.37Å; E115-R119 IonicContact OE1-NH2 2.65Å; E115-R119 PolarHBondContact OE1-NH2 3.03Å; H116-R119 PolarHBondContact O-N 3.28Å; R117-R119 PolarHBondContact O-N 3.38Å
120	R	91.8	Very high	89.7	Confident	129 Å²	129	49.2 Å²	49.2	49%	0.487	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	2.9	179	-65.4	-57.6	-165.2	-157.9	2.4	113.5	H116 R117 R118 R122 D258	H116-R120 WeakPolarHBondContact O-CB 3.45Å; H116-R120 WeakPolarHBondContact O-CG 3.23Å; H116-R120 PolarHBondContact O-N 3.05Å; R117-R120 CarbonylContact O-C 3.47Å; R117-R120 PolarHBondContact O-N 2.84Å; R118-R120 VanDerWaalsContact C-N 3.31Å; R118-R120 PolarHBondContact O-N 3.01Å; R120-R122 HydrophobicContact CB-CG 3.99Å; R120-R122 PolarHBondContact O-N 3.4Å; R120-D258 IonicContact CZ-OD2 3.25Å; R120-D258 IonicContact NE-OD1 2.88Å; R120-D258 PolarHBondContact NE-OD1 3.06Å; R120-D258 IonicContact NE-OD2 3.62Å; R120-D258 PolarHBondContact NE-OD2 2.91Å; R120-D258 VanDerWaalsContact NE-OD2 3.1Å; R120-D258 IonicContact NH2-OD2 2.72Å; R120-D258 PolarHBondContact NH2-OD2 3.16Å
121	Q	91.2	Very high	90.5	Very high	162 Å²	162	47.3 Å²	47.3	76%	0.757	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	42.8	-174.5	-59.2	177.7	-3.5	0	0	112.1	R117 R118	R117-Q121 PolarHBondContact O-N 3.22Å; R118-Q121 PolarHBondContact O-N 3.46Å
122	R	90.6	Very high	91.2	Very high	61 Å²	61	51.9 Å²	51.9	23%	0.23	24%	0.235	C	C	.	.			trans	-106.1	148.8	178.2	-71.7	175.7	171.2	159.1	2.7	109.8	H116 R117 R120 D258 F261	H116-R122 PolarHBondContact CE1-NH1 3.18Å; R117-R122 WeakPolarHBondContact CB-O 3.36Å; R117-R122 PolarHBondContact O-N 2.83Å; R120-R122 HydrophobicContact CB-CG 3.99Å; R120-R122 PolarHBondContact O-N 3.4Å; R122-D258 IonicContact CZ-OD1 2.79Å; R122-D258 IonicContact NH1-OD1 3.45Å; R122-D258 PolarHBondContact NH1-OD1 3.02Å; R122-D258 IonicContact NH2-OD1 2.65Å; R122-F261 HydrophobicContact CB-CE1 4.28Å; R122-F261 HydrophobicContact CG-CD1 4.41Å; R122-F261 HydrophobicContact CG-CE1 4.37Å; R122-F261 VanDerWaalsContact CZ-CB 3.41Å
123	A	89.8	Confident	91.5	Very high	20 Å²	20	56.1 Å²	56.1	17%	0.165	26%	0.255	C	S	.	.			trans	-71.1	151.9	175.1	0	0	0	0	0	111.7	Q305	A123-Q305 HydrophobicContact CB-CB 4.24Å; A123-Q305 WeakPolarHBondContact CB-O 3.1Å
124	C	91.1	Very high	91.6	Very high	22 Å²	22	56.1 Å²	56.1	15%	0.149	25%	0.254	C	S	.	.			trans	-74	145.7	168.4	-78.1	0	0	0	0	110.3	T128 A129	C124-T128 WeakPolarHBondContact CA-OG1 3.23Å; C124-T128 WeakPolarHBondContact CB-OG1 3.37Å; C124-T128 PolarHBondContact SG-OG1 3.46Å; C124-T128 VanDerWaalsContact SG-OG1 3.37Å; C124-A129 HydrophobicContact CB-CB 4.25Å
125	G	91.2	Very high	91.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.258	C	S	.	.			trans	-95.3	-175.8	167.3	0	0	0	0	0	111.7	L127 T128 A129 E313	G125-L127 PolarHBondContact O-N 3.17Å; G125-L127 VanDerWaalsContact O-N 3.12Å; G125-T128 PolarHBondContact N-OG1 3.43Å; G125-T128 PolarHBondContact O-N 2.81Å; G125-A129 WeakPolarHBondContact O-CB 3.21Å; G125-A129 PolarHBondContact O-N 3.41Å; G125-E313 VanDerWaalsContact CA-CD 3.42Å; G125-E313 WeakPolarHBondContact CA-OE2 3.41Å; G125-E313 PolarHBondContact N-OE1 2.96Å; G125-E313 PolarHBondContact N-OE2 3.43Å
126	L	91.4	Very high	92	Very high	10 Å²	10	62.7 Å²	62.7	5%	0.052	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.2	-179.5	-172.1	70.5	0	0	0	114.2	L137 R138 L141 N310 E313 M456	L126-L137 HydrophobicContact CD1-CB 3.99Å; L126-R138 HydrophobicContact CD1-CB 3.98Å; L126-L141 HydrophobicContact CB-CD1 4.34Å; L126-L141 HydrophobicContact CD1-CD1 4.43Å; L126-L141 HydrophobicContact CD2-CD1 4.01Å; L126-L141 HydrophobicContact CG-CD1 4.5Å; L126-N310 PolarHBondContact N-OD1 3.37Å; L126-E313 PolarHBondContact N-OE2 2.75Å; L126-M456 HydrophobicContact CD2-CB 3.68Å; L126-M456 HydrophobicContact CD2-CG 3.54Å; L126-M456 HydrophobicContact CD2-SD 3.68Å
127	L	90.1	Very high	91.9	Very high	53 Å²	53	62.9 Å²	62.9	28%	0.277	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-36	-178.7	-83.2	71.5	0	0	0	111.4	W113 G125 E313 A317	W113-L127 HydrophobicContact CZ3-CD2 4.29Å; G125-L127 PolarHBondContact O-N 3.17Å; G125-L127 VanDerWaalsContact O-N 3.12Å; L127-E313 WeakPolarHBondContact CA-OE2 3.23Å; L127-E313 WeakPolarHBondContact CB-OE2 3.36Å; L127-E313 HydrophobicContact CD1-CB 4.18Å; L127-E313 PolarHBondContact N-OE2 3.29Å; L127-A317 HydrophobicContact CD1-CB 4.41Å; L127-A317 HydrophobicContact CD2-CB 4.3Å
128	T	91.6	Very high	92	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.037	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-18.4	-176.7	62.6	0	0	0	0	114.7	W113 C124 G125 E313	W113-T128 HydrophobicContact CB-CG2 3.84Å; W113-T128 HydrophobicContact CE3-CG2 3.81Å; C124-T128 WeakPolarHBondContact CA-OG1 3.23Å; C124-T128 WeakPolarHBondContact CB-OG1 3.37Å; C124-T128 PolarHBondContact SG-OG1 3.46Å; C124-T128 VanDerWaalsContact SG-OG1 3.37Å; G125-T128 PolarHBondContact N-OG1 3.43Å; G125-T128 PolarHBondContact O-N 2.81Å; T128-E313 WeakPolarHBondContact CG2-OE1 3.27Å; T128-E313 PolarHBondContact N-OE2 2.98Å; T128-E313 PolarHBondContact OG1-OE1 3.21Å; T128-E313 VanDerWaalsContact OG1-OE1 3.05Å
129	A	91.9	Very high	92	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.008	27%	0.272	C	S	.	.			trans	-66.9	147.3	175.6	0	0	0	0	0	110.9	C124 G125 E133 W134 L137 R453	C124-A129 HydrophobicContact CB-CB 4.25Å; G125-A129 WeakPolarHBondContact O-CB 3.21Å; G125-A129 PolarHBondContact O-N 3.41Å; A129-E133 HydrophobicContact CB-CB 4.4Å; A129-E133 HydrophobicContact CB-CG 4.02Å; A129-W134 HydrophobicContact CB-CB 4.13Å; A129-W134 WeakPolarHBondContact O-CB 3.38Å; A129-L137 HydrophobicContact CB-CD1 3.92Å; A129-R453 PolarHBondContact O-NH2 2.99Å
130	E	92	Very high	91.9	Very high	58 Å²	58	52.5 Å²	52.5	27%	0.271	25%	0.251	S	S	.	.			trans	-131.5	168.2	178.5	-64.1	-60.1	153.3	0	0	110.4	E132 E133 W134 R453	E130-E132 PolarHBondContact O-N 2.95Å; E130-E133 PolarHBondContact O-N 3.23Å; E130-W134 PolarHBondContact O-N 3.01Å; E130-R453 VanDerWaalsContact CD-NH2 3.35Å; E130-R453 IonicContact OE1-CZ 2.85Å; E130-R453 IonicContact OE1-NH1 2.75Å; E130-R453 PolarHBondContact OE1-NH1 3.37Å; E130-R453 IonicContact OE1-NH2 3.99Å; E130-R453 PolarHBondContact OE1-NH2 3.2Å; E130-R453 IonicContact OE2-CZ 3.7Å; E130-R453 IonicContact OE2-NH1 3.14Å; E130-R453 PolarHBondContact OE2-NH1 3.43Å; E130-R453 IonicContact OE2-NH2 3.84Å; E130-R453 PolarHBondContact OE2-NH2 3.2Å
131	G	92.8	Very high	91.8	Very high	18 Å²	18	46.4 Å²	46.4	19%	0.186	23%	0.228	C	C	.	.	H	α-helix	trans	57.2	-129.7	174	0	0	0	0	0	114.9	Q135	G131-Q135 PolarHBondContact O-N 3.36Å; G131-Q135 VanDerWaalsContact O-N 3.17Å
132	E	93.2	Very high	91.8	Very high	144 Å²	144	39.8 Å²	39.8	67%	0.673	20%	0.201	S	C	*	.	H	α-helix	trans	-72.1	-36.1	-176.6	-65.1	-174.4	175.7	0	0	113.1	R104 E130 W134 Q135 R136	R104-E132 IonicContact NH1-OE1 2.98Å; R104-E132 PolarHBondContact NH1-OE1 3.38Å; E130-E132 PolarHBondContact O-N 2.95Å; E132-W134 VanDerWaalsContact C-N 3.34Å; E132-W134 PolarHBondContact O-N 2.89Å; E132-Q135 PolarHBondContact O-N 2.78Å; E132-R136 WeakPolarHBondContact O-CB 3.31Å; E132-R136 PolarHBondContact O-N 2.93Å
133	E	91.3	Very high	91.8	Very high	91 Å²	91	39 Å²	39	43%	0.425	20%	0.204	S	C	.	.	H	α-helix	trans	-60.6	-47.6	176.2	-174.4	-176.6	-166.9	0	0	110.1	A129 E130 Q135 R136 L137	A129-E133 HydrophobicContact CB-CB 4.4Å; A129-E133 HydrophobicContact CB-CG 4.02Å; E130-E133 PolarHBondContact O-N 3.23Å; E133-Q135 PolarHBondContact O-N 2.93Å; E133-R136 PolarHBondContact O-N 3.34Å; E133-L137 HydrophobicContact CG-CD1 4.35Å; E133-L137 WeakPolarHBondContact O-CG 3.26Å; E133-L137 PolarHBondContact O-N 3.43Å
134	W	94.4	Very high	91.6	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-47.2	174.4	171.8	79.3	0	0	0	112	A129 E130 E132 R136 L137 R138 K452 R453	A129-W134 HydrophobicContact CB-CB 4.13Å; A129-W134 WeakPolarHBondContact O-CB 3.38Å; E130-W134 PolarHBondContact O-N 3.01Å; E132-W134 VanDerWaalsContact C-N 3.34Å; E132-W134 PolarHBondContact O-N 2.89Å; W134-R136 VanDerWaalsContact C-N 3.33Å; W134-R136 PolarHBondContact O-N 2.81Å; W134-L137 PolarHBondContact O-N 2.87Å; W134-R138 HydrophobicContact CH2-CG 4.21Å; W134-R138 HydrophobicContact CZ2-CB 4.1Å; W134-R138 HydrophobicContact CZ2-CG 3.82Å; W134-R138 WeakPolarHBondContact O-CB 3.19Å; W134-R138 PolarHBondContact O-N 2.99Å; W134-K452 HydrophobicContact CH2-CB 4Å; W134-R453 HydrophobicContact CH2-CB 4.09Å; W134-R453 HydrophobicContact CH2-CG 4.45Å; W134-R453 HydrophobicContact CZ2-CB 3.56Å; W134-R453 HydrophobicContact CZ2-CG 3.53Å
135	Q	94.8	Very high	91.5	Very high	56 Å²	56	39 Å²	39	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-62.5	-40.9	-178.5	-179.2	62.3	61.3	0	0	111.3	P103 R104 G131 E132 E133 R138 S139	P103-Q135 PolarHBondContact O-OE1 3.5Å; R104-Q135 HydrophobicContact CG-CB 4.43Å; G131-Q135 PolarHBondContact O-N 3.36Å; G131-Q135 VanDerWaalsContact O-N 3.17Å; E132-Q135 PolarHBondContact O-N 2.78Å; E133-Q135 PolarHBondContact O-N 2.93Å; Q135-R138 PolarHBondContact O-N 3.29Å; Q135-S139 PolarHBondContact NE2-OG 2.99Å; Q135-S139 WeakPolarHBondContact O-CB 3.3Å; Q135-S139 PolarHBondContact O-N 2.74Å; Q135-S139 PolarHBondContact O-OG 2.9Å
136	R	92.4	Very high	91.3	Very high	147 Å²	147	41.2 Å²	41.2	56%	0.555	21%	0.211	S	C	*	.	H	α-helix	trans	-61.3	-53	175.9	-177.1	-176.1	177.1	-139.6	-0.9	111	E132 E133 W134 R138 S139 L140	E132-R136 WeakPolarHBondContact O-CB 3.31Å; E132-R136 PolarHBondContact O-N 2.93Å; E133-R136 PolarHBondContact O-N 3.34Å; W134-R136 VanDerWaalsContact C-N 3.33Å; W134-R136 PolarHBondContact O-N 2.81Å; R136-R138 VanDerWaalsContact C-N 3.32Å; R136-R138 PolarHBondContact O-N 3.5Å; R136-S139 PolarHBondContact O-N 2.79Å; R136-L140 PolarHBondContact O-N 3.06Å; R136-L140 VanDerWaalsContact O-N 3.12Å
137	L	91.8	Very high	91.2	Very high	6 Å²	6	48 Å²	48	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-42.6	178.9	-68	176.6	0	0	0	111.7	L126 A129 E133 W134 L140 L141 N310	L126-L137 HydrophobicContact CD1-CB 3.99Å; A129-L137 HydrophobicContact CB-CD1 3.92Å; E133-L137 HydrophobicContact CG-CD1 4.35Å; E133-L137 WeakPolarHBondContact O-CG 3.26Å; E133-L137 PolarHBondContact O-N 3.43Å; W134-L137 PolarHBondContact O-N 2.87Å; L137-L140 PolarHBondContact O-N 2.86Å; L137-L141 WeakPolarHBondContact O-CB 3.25Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 3.24Å; L137-N310 VanDerWaalsContact CD2-ND2 3.31Å; L137-N310 WeakPolarHBondContact CD2-ND2 3.37Å
138	R	94	Very high	90.9	Very high	18 Å²	18	49.8 Å²	49.8	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-45	178.7	-179.1	59.4	171.5	-160.2	-5.1	111.9	L126 W134 Q135 R136 L140 L141 A142 K452 S454 M456	L126-R138 HydrophobicContact CD1-CB 3.98Å; W134-R138 HydrophobicContact CH2-CG 4.21Å; W134-R138 HydrophobicContact CZ2-CB 4.1Å; W134-R138 HydrophobicContact CZ2-CG 3.82Å; W134-R138 WeakPolarHBondContact O-CB 3.19Å; W134-R138 PolarHBondContact O-N 2.99Å; Q135-R138 PolarHBondContact O-N 3.29Å; R136-R138 VanDerWaalsContact C-N 3.32Å; R136-R138 PolarHBondContact O-N 3.5Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 3.04Å; R138-L141 PolarHBondContact O-N 3.03Å; R138-A142 WeakPolarHBondContact O-CB 3.48Å; R138-A142 PolarHBondContact O-N 3.16Å; R138-K452 VanDerWaalsContact CZ-O 3.25Å; R138-K452 PolarHBondContact NE-O 2.65Å; R138-K452 PolarHBondContact NH2-O 2.71Å; R138-S454 VanDerWaalsContact CZ-O 3.31Å; R138-S454 PolarHBondContact NH1-O 3.37Å; R138-S454 PolarHBondContact NH2-O 2.98Å; R138-S454 PolarHBondContact NH2-OG 2.83Å; R138-M456 VanDerWaalsContact NH1-CA 3.32Å; R138-M456 PolarHBondContact NH1-SD 3.34Å
139	S	92.6	Very high	90.4	Very high	67 Å²	67	57.4 Å²	57.4	47%	0.469	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-35.4	178.5	-69.9	0	0	0	0	112.1	Q135 R136 P143	Q135-S139 PolarHBondContact NE2-OG 2.99Å; Q135-S139 WeakPolarHBondContact O-CB 3.3Å; Q135-S139 PolarHBondContact O-N 2.74Å; Q135-S139 PolarHBondContact O-OG 2.9Å; R136-S139 PolarHBondContact O-N 2.79Å; S139-P143 WeakPolarHBondContact O-CD 3.49Å
140	L	90	Very high	89.9	Confident	29 Å²	29	58.1 Å²	58.1	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-73.3	-44	178.3	-173	151.5	0	0	0	112.2	R136 L137 R138 L297 E300 L302	R136-L140 PolarHBondContact O-N 3.06Å; R136-L140 VanDerWaalsContact O-N 3.12Å; L137-L140 PolarHBondContact O-N 2.86Å; R138-L140 VanDerWaalsContact C-N 3.27Å; R138-L140 PolarHBondContact O-N 3.04Å; L140-L297 HydrophobicContact CD2-CD2 3.3Å; L140-E300 HydrophobicContact CD1-CB 3.73Å; L140-E300 HydrophobicContact CD1-CG 3.96Å; L140-E300 HydrophobicContact CD2-CG 4.44Å; L140-E300 HydrophobicContact CG-CB 4.45Å; L140-E300 HydrophobicContact CG-CG 4.15Å; L140-L302 HydrophobicContact CD1-CD1 3.8Å; L140-L302 HydrophobicContact CD1-CD2 4Å; L140-L302 HydrophobicContact CD1-CG 4.01Å; L140-L302 HydrophobicContact CD2-CD1 4.14Å
141	L	89.9	Confident	89.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-79.3	-28.2	-177.1	-71.1	172.3	0	0	0	114.1	L126 L137 R138 L144 L145 L293 L297 L314 M456	L126-L141 HydrophobicContact CB-CD1 4.34Å; L126-L141 HydrophobicContact CD1-CD1 4.43Å; L126-L141 HydrophobicContact CD2-CD1 4.01Å; L126-L141 HydrophobicContact CG-CD1 4.5Å; L137-L141 WeakPolarHBondContact O-CB 3.25Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 3.24Å; R138-L141 PolarHBondContact O-N 3.03Å; L141-L144 PolarHBondContact O-N 3.15Å; L141-L144 VanDerWaalsContact O-N 3.16Å; L141-L145 PolarHBondContact O-N 3.32Å; L141-L145 VanDerWaalsContact O-N 3.09Å; L141-L293 HydrophobicContact CD2-CD1 4.11Å; L141-L293 HydrophobicContact CD2-CD2 4.02Å; L141-L293 HydrophobicContact CD2-CG 4.38Å; L141-L297 HydrophobicContact CD2-CD2 3.79Å; L141-L314 HydrophobicContact CD1-CD1 4.4Å; L141-M456 HydrophobicContact CB-SD 3.82Å
142	A	91.8	Very high	89	Confident	24 Å²	24	56.6 Å²	56.6	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-44.3	-174.7	0	0	0	0	0	115.1	R138 L144 L145 L146 M456	R138-A142 WeakPolarHBondContact O-CB 3.48Å; R138-A142 PolarHBondContact O-N 3.16Å; A142-L144 PolarHBondContact O-N 2.85Å; A142-L145 PolarHBondContact O-N 3.43Å; A142-L146 HydrophobicContact CB-CD1 4.09Å; A142-L146 WeakPolarHBondContact O-CB 3.39Å; A142-L146 PolarHBondContact O-N 3Å; A142-M456 VanDerWaalsContact CA-CE 3.48Å; A142-M456 HydrophobicContact CB-CE 3.94Å
143	P	89.6	Confident	88.6	Confident	45 Å²	45	56.4 Å²	56.4	29%	0.292	28%	0.281	S	S	.	.	H	α-helix	trans	-58.9	-32.5	174.6	-26	35.8	0	0	0	113.6	S139 A150	S139-P143 WeakPolarHBondContact O-CD 3.49Å; P143-A150 VanDerWaalsContact O-CB 3.26Å; P143-A150 WeakPolarHBondContact O-CB 3.32Å
144	L	86.7	Confident	88.4	Confident	32 Å²	32	52.5 Å²	52.5	17%	0.168	26%	0.262	C	S	.	.	H	α-helix	trans	-82.5	-28.6	-175.9	-57.1	176	0	0	0	113	L141 A142 A150 L293 F296	L141-L144 PolarHBondContact O-N 3.15Å; L141-L144 VanDerWaalsContact O-N 3.16Å; A142-L144 PolarHBondContact O-N 2.85Å; L144-A150 VanDerWaalsContact O-CB 3.23Å; L144-A150 WeakPolarHBondContact O-CB 3.06Å; L144-L293 HydrophobicContact CB-CD1 3.94Å; L144-L293 HydrophobicContact CD1-CD1 3.72Å; L144-L293 HydrophobicContact CG-CD1 4.47Å; L144-F296 HydrophobicContact CD1-CB 3.71Å; L144-F296 HydrophobicContact CD1-CG 4.29Å; L144-F296 HydrophobicContact CD2-CB 4.34Å; L144-F296 HydrophobicContact CD2-CD1 4.34Å; L144-F296 HydrophobicContact CD2-CD2 4.39Å; L144-F296 HydrophobicContact CD2-CG 4.1Å
145	L	87.7	Confident	88	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-119.1	-25.7	-171.2	-63.4	174.7	0	0	0	115.3	L141 A142 Y154 L293 M456	L141-L145 PolarHBondContact O-N 3.32Å; L141-L145 VanDerWaalsContact O-N 3.09Å; A142-L145 PolarHBondContact O-N 3.43Å; L145-Y154 HydrophobicContact CD2-CE2 4.22Å; L145-L293 HydrophobicContact CD1-CD2 4.13Å; L145-L293 HydrophobicContact CD2-CD1 4.33Å; L145-L293 HydrophobicContact CG-CD1 4.36Å; L145-M456 HydrophobicContact CB-CE 4.18Å; L145-M456 HydrophobicContact CB-CG 4.49Å; L145-M456 HydrophobicContact CD1-CG 3.75Å
146	L	88.6	Confident	87.5	Confident	47 Å²	47	59.1 Å²	59.1	25%	0.246	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-19.6	-176	-70.3	174.2	0	0	0	114.8	A142 M456 R458 R459	A142-L146 HydrophobicContact CB-CD1 4.09Å; A142-L146 WeakPolarHBondContact O-CB 3.39Å; A142-L146 PolarHBondContact O-N 3Å; L146-M456 HydrophobicContact CB-CE 4.35Å; L146-M456 HydrophobicContact CD1-CE 3.25Å; L146-M456 HydrophobicContact CD2-CE 4.03Å; L146-M456 WeakPolarHBondContact CD2-O 3.48Å; L146-M456 HydrophobicContact CG-CE 3.22Å; L146-R458 HydrophobicContact CD2-CB 4.44Å; L146-R459 VanDerWaalsContact O-CG 3.31Å; L146-R459 WeakPolarHBondContact O-CG 3.4Å
147	R	87.6	Confident	87.3	Confident	154 Å²	154	54.4 Å²	54.4	58%	0.581	28%	0.276	S	S	*	.	S	Bend	trans	-72.6	130.2	176.2	-66.5	-176.5	-178.9	174	2.4	108.7	Q149 A150 A151	R147-Q149 PolarHBondContact O-N 2.57Å; R147-A150 HydrophobicContact CB-CB 3.98Å; R147-A150 WeakPolarHBondContact O-CB 3.42Å; R147-A150 PolarHBondContact O-N 2.9Å; R147-A151 PolarHBondContact O-N 3.43Å
148	P	83.8	Confident	87.2	Confident	90 Å²	90	54.1 Å²	54.1	58%	0.584	27%	0.274	S	S	*	.	H	α-helix	trans	-53.3	-41.4	179.1	-28.3	35.3	0	0	0	113.2	A150 A151 A152	P148-A150 VanDerWaalsContact C-N 3.33Å; P148-A150 PolarHBondContact O-N 3.37Å; P148-A151 PolarHBondContact O-N 3.02Å; P148-A152 WeakPolarHBondContact O-CB 3.31Å; P148-A152 PolarHBondContact O-N 3.27Å
149	Q	81.8	Confident	87	Confident	166 Å²	166	54.7 Å²	54.7	78%	0.776	28%	0.279	S	S	*	.	H	α-helix	trans	-64	-36.6	176.9	-67.7	170.2	-5	0	0	112.6	R147 A152 R153	R147-Q149 PolarHBondContact O-N 2.57Å; Q149-A152 PolarHBondContact O-N 2.63Å; Q149-R153 PolarHBondContact O-N 3.41Å
150	A	81.6	Confident	86.8	Confident	15 Å²	15	55.1 Å²	55.1	12%	0.124	28%	0.276	C	S	.	.	H	α-helix	trans	-70.9	-42.8	179.1	0	0	0	0	0	111.2	P143 L144 R147 P148 A152 R153	P143-A150 VanDerWaalsContact O-CB 3.26Å; P143-A150 WeakPolarHBondContact O-CB 3.32Å; L144-A150 VanDerWaalsContact O-CB 3.23Å; L144-A150 WeakPolarHBondContact O-CB 3.06Å; R147-A150 HydrophobicContact CB-CB 3.98Å; R147-A150 WeakPolarHBondContact O-CB 3.42Å; R147-A150 PolarHBondContact O-N 2.9Å; P148-A150 VanDerWaalsContact C-N 3.33Å; P148-A150 PolarHBondContact O-N 3.37Å; A150-A152 VanDerWaalsContact C-N 3.29Å; A150-A152 PolarHBondContact O-N 2.73Å; A150-R153 WeakPolarHBondContact O-CB 3.24Å; A150-R153 PolarHBondContact O-N 2.95Å
151	A	82.3	Confident	87	Confident	5 Å²	5	53.7 Å²	53.7	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-38.6	173.4	0	0	0	0	0	112.1	R147 P148 R153 Y154 R459 L463	R147-A151 PolarHBondContact O-N 3.43Å; P148-A151 PolarHBondContact O-N 3.02Å; A151-R153 PolarHBondContact O-N 3.46Å; A151-Y154 PolarHBondContact O-N 2.93Å; A151-Y154 VanDerWaalsContact O-N 3.08Å; A151-R459 HydrophobicContact CB-CB 3.65Å; A151-L463 WeakPolarHBondContact O-CD2 3.2Å
152	A	83.6	Confident	87.2	Confident	40 Å²	40	53.7 Å²	53.7	33%	0.331	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-25.3	178.6	0	0	0	0	0	113.6	P148 Q149 A150 Y154 T155	P148-A152 WeakPolarHBondContact O-CB 3.31Å; P148-A152 PolarHBondContact O-N 3.27Å; Q149-A152 PolarHBondContact O-N 2.63Å; A150-A152 VanDerWaalsContact C-N 3.29Å; A150-A152 PolarHBondContact O-N 2.73Å; A152-Y154 PolarHBondContact O-N 2.62Å; A152-T155 WeakPolarHBondContact O-CB 3.39Å; A152-T155 PolarHBondContact O-N 3.06Å; A152-T155 VanDerWaalsContact O-N 3.09Å; A152-T155 PolarHBondContact O-OG1 3.5Å
153	R	84.6	Confident	87.2	Confident	140 Å²	140	57 Å²	57	53%	0.528	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.2	175.2	-60.9	176.8	78.2	178	4.8	112.4	Q149 A150 A151 T155	Q149-R153 PolarHBondContact O-N 3.41Å; A150-R153 WeakPolarHBondContact O-CB 3.24Å; A150-R153 PolarHBondContact O-N 2.95Å; A151-R153 PolarHBondContact O-N 3.46Å; R153-T155 VanDerWaalsContact C-N 3.28Å; R153-T155 PolarHBondContact O-N 3.3Å
154	Y	86.1	Confident	87.5	Confident	8 Å²	8	56 Å²	56	3%	0.031	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-4	178.9	-57.1	-61.6	0	0	0	113.7	L145 A151 A152 R156 T157 L158 V201 A291 L460	L145-Y154 HydrophobicContact CD2-CE2 4.22Å; A151-Y154 PolarHBondContact O-N 2.93Å; A151-Y154 VanDerWaalsContact O-N 3.08Å; A152-Y154 PolarHBondContact O-N 2.62Å; Y154-R156 PolarHBondContact O-N 2.99Å; Y154-T157 WeakPolarHBondContact O-CB 3.47Å; Y154-T157 PolarHBondContact O-N 2.8Å; Y154-L158 WeakPolarHBondContact O-CG 3.24Å; Y154-L158 PolarHBondContact O-N 2.91Å; Y154-V201 HydrophobicContact CD1-CB 4.34Å; Y154-V201 HydrophobicContact CD1-CG1 3.8Å; Y154-V201 HydrophobicContact CD1-CG2 4.13Å; Y154-V201 HydrophobicContact CD2-CG1 4.22Å; Y154-V201 HydrophobicContact CE1-CG1 3.74Å; Y154-V201 HydrophobicContact CE2-CG1 4.15Å; Y154-V201 HydrophobicContact CG-CG1 4.04Å; Y154-V201 HydrophobicContact CG-CG2 4.11Å; Y154-A291 WeakPolarHBondContact CE1-O 3.44Å; Y154-L460 HydrophobicContact CD2-CD1 3.92Å; Y154-L460 HydrophobicContact CG-CD1 4.22Å
155	T	87.1	Confident	87.9	Confident	33 Å²	33	54.5 Å²	54.5	20%	0.202	26%	0.26	C	S	.	.	H	α-helix	trans	-53.6	-50.8	-178	-60.8	0	0	0	0	112.1	A152 R153 T157 L158 D159 A361 M467	A152-T155 WeakPolarHBondContact O-CB 3.39Å; A152-T155 PolarHBondContact O-N 3.06Å; A152-T155 VanDerWaalsContact O-N 3.09Å; A152-T155 PolarHBondContact O-OG1 3.5Å; R153-T155 VanDerWaalsContact C-N 3.28Å; R153-T155 PolarHBondContact O-N 3.3Å; T155-T157 VanDerWaalsContact C-N 3.31Å; T155-T157 PolarHBondContact O-N 2.95Å; T155-L158 PolarHBondContact O-N 3.21Å; T155-D159 WeakPolarHBondContact O-CB 3.22Å; T155-D159 PolarHBondContact O-N 2.91Å; T155-A361 HydrophobicContact CG2-CB 3.35Å; T155-A361 WeakPolarHBondContact OG1-CB 3.25Å; T155-M467 HydrophobicContact CG2-CE 4.21Å; T155-M467 HydrophobicContact CG2-SD 4.42Å
156	R	85.1	Confident	88.3	Confident	166 Å²	166	54.3 Å²	54.3	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-40.8	-177.9	-177.2	178.2	174.8	-177.1	-2.5	111.7	Y154 D159 N160	Y154-R156 PolarHBondContact O-N 2.99Å; R156-D159 PolarHBondContact O-N 3.4Å; R156-N160 PolarHBondContact O-N 3.03Å; R156-N160 PolarHBondContact O-ND2 2.87Å
157	T	87.6	Confident	88.5	Confident	48 Å²	48	59.1 Å²	59.1	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-47.5	176.8	-57	0	0	0	0	111.1	Y154 T155 V161 A200	Y154-T157 WeakPolarHBondContact O-CB 3.47Å; Y154-T157 PolarHBondContact O-N 2.8Å; T155-T157 VanDerWaalsContact C-N 3.31Å; T155-T157 PolarHBondContact O-N 2.95Å; T157-V161 PolarHBondContact O-N 3.41Å; T157-A200 HydrophobicContact CG2-CB 3.48Å; T157-A200 VanDerWaalsContact CG2-CB 3.48Å
158	L	90.1	Very high	88.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-69.3	-34.2	179.5	-69.3	176	0	0	0	112.6	Y154 T155 N160 V161 V162 V201 L460 L463 E464 M467	Y154-L158 WeakPolarHBondContact O-CG 3.24Å; Y154-L158 PolarHBondContact O-N 2.91Å; T155-L158 PolarHBondContact O-N 3.21Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.36Å; L158-V161 PolarHBondContact O-N 2.92Å; L158-V162 WeakPolarHBondContact O-CG2 3.5Å; L158-V162 PolarHBondContact O-N 2.9Å; L158-V201 HydrophobicContact CD2-CG2 4.13Å; L158-V201 HydrophobicContact CG-CG2 4.46Å; L158-L460 HydrophobicContact CD1-CD1 3.87Å; L158-L463 HydrophobicContact CD1-CD2 3.95Å; L158-L463 HydrophobicContact CD1-CG 4.11Å; L158-E464 HydrophobicContact CD1-CB 4.24Å; L158-E464 HydrophobicContact CD2-CG 4.29Å; L158-M467 HydrophobicContact CB-CE 4.12Å; L158-M467 HydrophobicContact CB-SD 4.04Å
159	D	89	Confident	89.4	Confident	30 Å²	30	48.3 Å²	48.3	16%	0.16	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-43.9	178.5	-170.6	60.8	0	0	0	111.1	T155 R156 V161 V162 R163 H358 M467	T155-D159 WeakPolarHBondContact O-CB 3.22Å; T155-D159 PolarHBondContact O-N 2.91Å; R156-D159 PolarHBondContact O-N 3.4Å; D159-V161 PolarHBondContact O-N 3.21Å; D159-V162 PolarHBondContact O-N 3.25Å; D159-R163 VanDerWaalsContact O-CG 3.27Å; D159-R163 WeakPolarHBondContact O-CG 3.44Å; D159-R163 PolarHBondContact O-N 2.82Å; D159-R163 IonicContact OD2-CZ 3.09Å; D159-R163 VanDerWaalsContact OD2-CZ 3.26Å; D159-R163 IonicContact OD2-NE 2.6Å; D159-R163 PolarHBondContact OD2-NE 3.18Å; D159-R163 IonicContact OD2-NH2 3.11Å; D159-R163 PolarHBondContact OD2-NH2 3.46Å; D159-H358 IonicContact OD1-CG 3.59Å; D159-H358 IonicContact OD1-ND1 3.87Å; D159-M467 HydrophobicContact CB-CE 3.78Å
160	N	89.5	Confident	90	Very high	76 Å²	76	45.3 Å²	45.3	41%	0.406	20%	0.203	S	C	.	.	H	α-helix	trans	-61.2	-43.2	174.7	-68.1	-30.2	0	0	0	112.1	R156 L158 R163 D164	R156-N160 PolarHBondContact O-N 3.03Å; R156-N160 PolarHBondContact O-ND2 2.87Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.36Å; N160-R163 PolarHBondContact O-N 3.22Å; N160-D164 PolarHBondContact O-N 2.98Å; N160-D164 VanDerWaalsContact O-N 3.16Å; N160-D164 VanDerWaalsContact O-OD1 3.05Å
161	V	93.9	Very high	90.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-39.4	179	-179.7	0	0	0	0	111.2	T157 L158 D159 D164 L165 F193 E196 A200 L210	T157-V161 PolarHBondContact O-N 3.41Å; L158-V161 PolarHBondContact O-N 2.92Å; D159-V161 PolarHBondContact O-N 3.21Å; V161-D164 WeakPolarHBondContact O-CB 3.32Å; V161-D164 PolarHBondContact O-N 3.07Å; V161-L165 PolarHBondContact O-N 2.85Å; V161-F193 HydrophobicContact CB-CE2 4.5Å; V161-F193 HydrophobicContact CG1-CD2 3.69Å; V161-F193 HydrophobicContact CG1-CE2 3.73Å; V161-E196 HydrophobicContact CG1-CB 3.89Å; V161-E196 HydrophobicContact CG1-CG 3.78Å; V161-E196 HydrophobicContact CG2-CG 4.1Å; V161-A200 HydrophobicContact CG2-CB 4.09Å; V161-L210 HydrophobicContact CG1-CD1 3.9Å; V161-L210 WeakPolarHBondContact O-CD1 3.35Å
162	V	93.6	Very high	91	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-68.5	-40.2	178.3	175.3	0	0	0	0	111.7	L158 D159 D164 L165 V166 F193 M467 A468 Q471	L158-V162 WeakPolarHBondContact O-CG2 3.5Å; L158-V162 PolarHBondContact O-N 2.9Å; D159-V162 PolarHBondContact O-N 3.25Å; V162-D164 PolarHBondContact O-N 3.19Å; V162-L165 WeakPolarHBondContact O-CB 3.34Å; V162-L165 PolarHBondContact O-N 2.7Å; V162-L165 VanDerWaalsContact O-N 3.16Å; V162-V166 PolarHBondContact O-N 2.79Å; V162-F193 HydrophobicContact CB-CE2 4.43Å; V162-F193 HydrophobicContact CG2-CE2 3.71Å; V162-F193 HydrophobicContact CG2-CZ 3.82Å; V162-M467 HydrophobicContact CG2-CB 4.07Å; V162-A468 HydrophobicContact CG2-CB 4.48Å; V162-Q471 HydrophobicContact CG1-CB 3.39Å; V162-Q471 HydrophobicContact CG1-CG 3.43Å; V162-Q471 VanDerWaalsContact CG1-CG 3.43Å
163	R	92.1	Very high	91.5	Very high	93 Å²	93	50.8 Å²	50.8	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-57.7	-40.3	172.4	-72.1	168.7	-171.5	-86.4	-2.9	111.5	D159 N160 L165 V166 R167 H358	D159-R163 VanDerWaalsContact O-CG 3.27Å; D159-R163 WeakPolarHBondContact O-CG 3.44Å; D159-R163 PolarHBondContact O-N 2.82Å; D159-R163 IonicContact OD2-CZ 3.09Å; D159-R163 VanDerWaalsContact OD2-CZ 3.26Å; D159-R163 IonicContact OD2-NE 2.6Å; D159-R163 PolarHBondContact OD2-NE 3.18Å; D159-R163 IonicContact OD2-NH2 3.11Å; D159-R163 PolarHBondContact OD2-NH2 3.46Å; N160-R163 PolarHBondContact O-N 3.22Å; R163-L165 VanDerWaalsContact C-N 3.32Å; R163-V166 PolarHBondContact O-N 2.92Å; R163-R167 WeakPolarHBondContact O-CG 3.33Å; R163-R167 PolarHBondContact O-N 3.37Å; R163-H358 PolarHBondContact NH1-CD2 2.77Å; R163-H358 VanDerWaalsContact NH1-CD2 3.29Å; R163-H358 PolarHBondContact NH1-NE2 3.37Å; R163-H358 PolarHBondContact NH2-CD2 2.8Å; R163-H358 PolarHBondContact NH2-NE2 3.36Å
164	D	94.5	Very high	91.7	Very high	25 Å²	25	46 Å²	46	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-35	179.7	-66.2	6.9	0	0	0	111.3	N160 V161 V162 R167 R168 R206 L210	N160-D164 PolarHBondContact O-N 2.98Å; N160-D164 VanDerWaalsContact O-N 3.16Å; N160-D164 VanDerWaalsContact O-OD1 3.05Å; V161-D164 WeakPolarHBondContact O-CB 3.32Å; V161-D164 PolarHBondContact O-N 3.07Å; V162-D164 PolarHBondContact O-N 3.19Å; D164-R167 VanDerWaalsContact CG-NH2 3.34Å; D164-R167 PolarHBondContact O-N 3.49Å; D164-R167 IonicContact OD1-CZ 3.62Å; D164-R167 IonicContact OD1-NE 3.21Å; D164-R167 IonicContact OD1-NH2 3.72Å; D164-R167 PolarHBondContact OD1-NH2 3.06Å; D164-R167 IonicContact OD2-NH2 3.73Å; D164-R168 VanDerWaalsContact O-CB 3.25Å; D164-R168 WeakPolarHBondContact O-CB 3.37Å; D164-R168 PolarHBondContact O-N 3.38Å; D164-R206 IonicContact OD2-CZ 3.73Å; D164-R206 IonicContact OD2-NH1 3.36Å; D164-R206 PolarHBondContact OD2-NH1 2.92Å; D164-R206 IonicContact OD2-NH2 3.44Å; D164-R206 PolarHBondContact OD2-NH2 3.19Å; D164-L210 HydrophobicContact CB-CB 4.12Å; D164-L210 HydrophobicContact CB-CD1 3.72Å
165	L	95.9	Very high	91.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-48.3	171.2	173.5	61.2	0	0	0	111.3	V161 V162 R163 R167 R168 L169 F190 F193 L210 L326 A468 I472	V161-L165 PolarHBondContact O-N 2.85Å; V162-L165 WeakPolarHBondContact O-CB 3.34Å; V162-L165 PolarHBondContact O-N 2.7Å; V162-L165 VanDerWaalsContact O-N 3.16Å; R163-L165 VanDerWaalsContact C-N 3.32Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 PolarHBondContact O-N 3.38Å; L165-R168 WeakPolarHBondContact O-CB 3.38Å; L165-R168 PolarHBondContact O-N 3.16Å; L165-R168 VanDerWaalsContact O-N 3.15Å; L165-L169 HydrophobicContact CD1-CD1 4.26Å; L165-L169 HydrophobicContact CD1-CG 4.1Å; L165-L169 HydrophobicContact CG-CD1 4.23Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.44Å; L165-F190 HydrophobicContact CD1-CD1 3.95Å; L165-F190 HydrophobicContact CD1-CE1 4.07Å; L165-F190 HydrophobicContact CD2-CD1 4.3Å; L165-F190 HydrophobicContact CD2-CE1 4.39Å; L165-F193 HydrophobicContact CB-CD2 3.78Å; L165-F193 HydrophobicContact CB-CE2 4.28Å; L165-F193 HydrophobicContact CB-CG 4.43Å; L165-F193 HydrophobicContact CD1-CB 4.14Å; L165-F193 HydrophobicContact CD1-CG 4.48Å; L165-F193 HydrophobicContact CD2-CB 4.28Å; L165-F193 HydrophobicContact CD2-CD1 4.09Å; L165-F193 HydrophobicContact CD2-CD2 3.69Å; L165-F193 HydrophobicContact CD2-CE1 4.37Å; L165-F193 HydrophobicContact CD2-CE2 3.99Å; L165-F193 HydrophobicContact CD2-CG 3.74Å; L165-F193 HydrophobicContact CD2-CZ 4.33Å; L165-F193 HydrophobicContact CG-CD2 4.22Å; L165-F193 HydrophobicContact CG-CG 4.44Å; L165-L210 HydrophobicContact CB-CD1 4.47Å; L165-L326 HydrophobicContact CD2-CD2 4.19Å; L165-A468 HydrophobicContact CD2-CB 4.45Å; L165-I472 HydrophobicContact CD2-CD1 4.02Å
166	V	95.1	Very high	91.4	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-46.8	177.7	171.6	0	0	0	0	110.8	V162 R163 R168 L169 R170 Q471 H475 F476	V162-V166 PolarHBondContact O-N 2.79Å; R163-V166 PolarHBondContact O-N 2.92Å; V166-R168 VanDerWaalsContact C-N 3.31Å; V166-R168 PolarHBondContact O-N 3.35Å; V166-L169 PolarHBondContact O-N 3.05Å; V166-R170 PolarHBondContact O-N 2.86Å; V166-R170 VanDerWaalsContact O-N 3.16Å; V166-Q471 HydrophobicContact CG2-CB 4.02Å; V166-H475 HydrophobicContact CG1-CB 4.21Å; V166-F476 HydrophobicContact CG1-CE2 3.9Å; V166-F476 HydrophobicContact CG1-CZ 4.18Å
167	R	94.7	Very high	91.1	Very high	147 Å²	147	51.2 Å²	51.2	56%	0.555	27%	0.266	S	S	*	.	H	α-helix	trans	-59	-43.7	175.8	-71.2	-170.3	-71.9	147.6	-18.2	111.5	R163 D164 L165 R170 C171	R163-R167 WeakPolarHBondContact O-CG 3.33Å; R163-R167 PolarHBondContact O-N 3.37Å; D164-R167 VanDerWaalsContact CG-NH2 3.34Å; D164-R167 PolarHBondContact O-N 3.49Å; D164-R167 IonicContact OD1-CZ 3.62Å; D164-R167 IonicContact OD1-NE 3.21Å; D164-R167 IonicContact OD1-NH2 3.72Å; D164-R167 PolarHBondContact OD1-NH2 3.06Å; D164-R167 IonicContact OD2-NH2 3.73Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 PolarHBondContact O-N 3.38Å; R167-R170 WeakPolarHBondContact O-CB 3.34Å; R167-R170 PolarHBondContact O-N 3.31Å; R167-C171 PolarHBondContact O-N 2.93Å; R167-C171 VanDerWaalsContact O-N 3.11Å; R167-C171 PolarHBondContact O-SG 2.93Å; R167-C171 VanDerWaalsContact O-SG 3.36Å
168	R	94.2	Very high	90.9	Very high	17 Å²	17	51.6 Å²	51.6	6%	0.064	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-43	178.9	-174.1	167.6	-176.2	89.1	4.6	112.4	D164 L165 V166 R170 C171 Q172 E189 L210 E211	D164-R168 VanDerWaalsContact O-CB 3.25Å; D164-R168 WeakPolarHBondContact O-CB 3.37Å; D164-R168 PolarHBondContact O-N 3.38Å; L165-R168 WeakPolarHBondContact O-CB 3.38Å; L165-R168 PolarHBondContact O-N 3.16Å; L165-R168 VanDerWaalsContact O-N 3.15Å; V166-R168 VanDerWaalsContact C-N 3.31Å; V166-R168 PolarHBondContact O-N 3.35Å; R168-R170 VanDerWaalsContact C-N 3.3Å; R168-R170 PolarHBondContact O-N 2.74Å; R168-C171 PolarHBondContact O-N 3.49Å; R168-Q172 HydrophobicContact CG-CG 4.2Å; R168-Q172 WeakPolarHBondContact O-CG 3.32Å; R168-Q172 PolarHBondContact O-N 2.93Å; R168-E189 WeakPolarHBondContact CD-OE2 3.46Å; R168-E189 IonicContact CZ-OE2 3.62Å; R168-E189 IonicContact NE-OE2 3.23Å; R168-E189 PolarHBondContact NE-OE2 3.5Å; R168-E189 IonicContact NH2-OE1 3.8Å; R168-E189 IonicContact NH2-OE2 2.95Å; R168-E189 PolarHBondContact NH2-OE2 2.81Å; R168-L210 WeakPolarHBondContact CD-O 3.17Å; R168-L210 PolarHBondContact NH1-O 3.02Å; R168-E211 PolarHBondContact NH1-O 2.99Å
169	L	95.5	Very high	90.8	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-42.6	175.6	-70	172.1	0	0	0	111.2	L165 V166 C171 Q172 R173 V183 F190 I472 F476 F505	L165-L169 HydrophobicContact CD1-CD1 4.26Å; L165-L169 HydrophobicContact CD1-CG 4.1Å; L165-L169 HydrophobicContact CG-CD1 4.23Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.44Å; V166-L169 PolarHBondContact O-N 3.05Å; L169-C171 VanDerWaalsContact C-N 3.32Å; L169-C171 PolarHBondContact O-N 3.42Å; L169-Q172 PolarHBondContact O-N 2.74Å; L169-R173 WeakPolarHBondContact O-CG 3.33Å; L169-R173 PolarHBondContact O-N 3.22Å; L169-V183 HydrophobicContact CD2-CG1 4.36Å; L169-F190 HydrophobicContact CD1-CE1 4.39Å; L169-F190 HydrophobicContact CD2-CE1 4.17Å; L169-I472 HydrophobicContact CD1-CD1 4.01Å; L169-I472 HydrophobicContact CD1-CG1 3.96Å; L169-F476 HydrophobicContact CB-CE2 4.3Å; L169-F476 HydrophobicContact CB-CZ 4.45Å; L169-F476 HydrophobicContact CD1-CE2 4.41Å; L169-F505 HydrophobicContact CD1-CD1 4.26Å; L169-F505 HydrophobicContact CD1-CE1 3.84Å; L169-F505 HydrophobicContact CD1-CZ 4.29Å; L169-F505 HydrophobicContact CD2-CE1 4.34Å; L169-F505 HydrophobicContact CD2-CE2 4.23Å; L169-F505 HydrophobicContact CD2-CZ 4Å
170	R	94.6	Very high	90.9	Very high	102 Å²	102	57 Å²	57	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-43.2	172.7	-63.7	-169.1	175.3	112	2.8	112.3	V166 R167 R168 Q172 H475 F476	V166-R170 PolarHBondContact O-N 2.86Å; V166-R170 VanDerWaalsContact O-N 3.16Å; R167-R170 WeakPolarHBondContact O-CB 3.34Å; R167-R170 PolarHBondContact O-N 3.31Å; R168-R170 VanDerWaalsContact C-N 3.3Å; R168-R170 PolarHBondContact O-N 2.74Å; R170-Q172 PolarHBondContact O-N 3.33Å; R170-H475 VanDerWaalsContact NH2-CG 3.3Å; R170-H475 PolarHBondContact NH2-ND1 3.4Å; R170-H475 VanDerWaalsContact NH2-ND1 3.18Å; R170-F476 HydrophobicContact CG-CE1 3.94Å; R170-F476 HydrophobicContact CG-CZ 3.56Å
171	C	92.6	Very high	91.1	Very high	79 Å²	79	53.6 Å²	53.6	53%	0.534	30%	0.299	S	S	.	.	H	α-helix	trans	-72.9	-23.5	-179.2	-65.1	0	0	0	0	114.5	R167 R168 L169 R175	R167-C171 PolarHBondContact O-N 2.93Å; R167-C171 VanDerWaalsContact O-N 3.11Å; R167-C171 PolarHBondContact O-SG 2.93Å; R167-C171 VanDerWaalsContact O-SG 3.36Å; R168-C171 PolarHBondContact O-N 3.49Å; L169-C171 VanDerWaalsContact C-N 3.32Å; L169-C171 PolarHBondContact O-N 3.42Å; C171-R175 PolarHBondContact O-NE 2.93Å
172	Q	92.4	Very high	91.3	Very high	32 Å²	32	53.8 Å²	53.8	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-87.5	-15.4	179.2	-66.8	-62.4	-24.2	0	0	112.9	R168 L169 R170 G174 R175 V183	R168-Q172 HydrophobicContact CG-CG 4.2Å; R168-Q172 WeakPolarHBondContact O-CG 3.32Å; R168-Q172 PolarHBondContact O-N 2.93Å; L169-Q172 PolarHBondContact O-N 2.74Å; R170-Q172 PolarHBondContact O-N 3.33Å; Q172-G174 PolarHBondContact O-N 2.77Å; Q172-R175 WeakPolarHBondContact O-CB 3.44Å; Q172-R175 PolarHBondContact O-N 3.28Å; Q172-V183 HydrophobicContact CB-CG1 3.96Å; Q172-V183 HydrophobicContact CB-CG2 4.27Å
173	R	94	Very high	91.4	Very high	64 Å²	64	53.8 Å²	53.8	24%	0.242	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	134.1	175.5	-79.9	174	59.4	-177.3	-0.5	111.5	L169 R175 P180 L182 V183 F505 D507	L169-R173 WeakPolarHBondContact O-CG 3.33Å; L169-R173 PolarHBondContact O-N 3.22Å; R173-R175 PolarHBondContact O-N 3.05Å; R173-P180 CarbonylContact C-O 3.57Å; R173-P180 WeakPolarHBondContact CB-O 3.23Å; R173-L182 WeakPolarHBondContact CA-O 3.5Å; R173-V183 HydrophobicContact CG-CG2 3.81Å; R173-F505 WeakPolarHBondContact CD-O 3.37Å; R173-F505 PolarHBondContact NE-O 2.72Å; R173-F505 VanDerWaalsContact NE-O 3.17Å; R173-F505 PolarHBondContact NH1-O 3.43Å; R173-D507 IonicContact CZ-OD2 3.56Å; R173-D507 IonicContact NH1-OD1 3.47Å; R173-D507 PolarHBondContact NH1-OD1 3.29Å; R173-D507 VanDerWaalsContact NH1-OD1 3.08Å; R173-D507 IonicContact NH1-OD2 2.76Å; R173-D507 PolarHBondContact NH1-OD2 3.26Å; R173-D507 IonicContact NH2-OD2 2.86Å
174	G	88.1	Confident	91.5	Very high	40 Å²	40	54.1 Å²	54.1	41%	0.412	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	8.6	175.7	0	0	0	0	0	114.4	Q172 G176 P180 L182	Q172-G174 PolarHBondContact O-N 2.77Å; G174-G176 PolarHBondContact O-N 2.85Å; G174-P180 PolarHBondContact N-O 3.34Å; G174-L182 PolarHBondContact N-O 3.34Å
175	R	86.2	Confident	91.5	Very high	142 Å²	142	56 Å²	56	54%	0.536	31%	0.311	S	S	.	.			trans	-76.9	104	170.8	-67.9	-164.9	-179	-152.4	-5.5	109.7	C171 Q172 R173	C171-R175 PolarHBondContact O-NE 2.93Å; Q172-R175 WeakPolarHBondContact O-CB 3.44Å; Q172-R175 PolarHBondContact O-N 3.28Å; R173-R175 PolarHBondContact O-N 3.05Å
176	G	79.6	Confident	91.5	Very high	62 Å²	62	56 Å²	56	64%	0.639	31%	0.311	S	S	*	.	S	Bend	trans	114.4	-165.4	179	0	0	0	0	0	112.5	G174	G174-G176 PolarHBondContact O-N 2.85Å
177	T	78.9	Confident	91.4	Very high	113 Å²	113	56.7 Å²	56.7	69%	0.693	32%	0.317	S	S	*	.	S	Bend	trans	-80.3	143.7	174.8	55.7	0	0	0	0	110	R184	T177-R184 PolarHBondContact O-NE 3.26Å; T177-R184 PolarHBondContact O-NH2 3.43Å; T177-R184 PolarHBondContact OG1-NH2 3.27Å
178	G	84.6	Confident	91.2	Very high	56 Å²	56	50.5 Å²	50.5	58%	0.577	30%	0.299	S	S	*	.	S	Bend	trans	126.6	-170.9	176.3	0	0	0	0	0	113.9
179	P	88.6	Confident	91.2	Very high	38 Å²	38	50.6 Å²	50.6	25%	0.247	30%	0.3	C	S	.	.			trans	-58.7	148.5	179.2	-24.3	34	0	0	0	112.7	A181 L182 P482	P179-A181 PolarHBondContact O-N 2.92Å; P179-A181 VanDerWaalsContact O-N 3.14Å; P179-L182 HydrophobicContact CB-CB 4.37Å; P179-L182 WeakPolarHBondContact O-CB 3.39Å; P179-L182 PolarHBondContact O-N 2.89Å; P179-P482 HydrophobicContact CG-CG 4.15Å
180	P	90.7	Very high	91.2	Very high	106 Å²	106	50.6 Å²	50.6	69%	0.688	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.5	-178.8	26.4	-34.9	0	0	0	113.2	R173 G174	R173-P180 CarbonylContact C-O 3.57Å; R173-P180 WeakPolarHBondContact CB-O 3.23Å; G174-P180 PolarHBondContact N-O 3.34Å
181	A	94.3	Very high	91.1	Very high	4 Å²	4	46.9 Å²	46.9	3%	0.033	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-4.4	176	0	0	0	0	0	113.7	P179 Q504 F505 L506	P179-A181 PolarHBondContact O-N 2.92Å; P179-A181 VanDerWaalsContact O-N 3.14Å; A181-Q504 HydrophobicContact CB-CB 4.23Å; A181-Q504 CarbonylContact O-C 3.44Å; A181-Q504 VanDerWaalsContact O-CA 3.31Å; A181-Q504 WeakPolarHBondContact O-CA 3.35Å; A181-F505 PolarHBondContact O-N 3.38Å; A181-L506 HydrophobicContact CB-CD2 3.67Å; A181-L506 HydrophobicContact CB-CG 4.41Å
182	L	96.3	Very high	91.2	Very high	4 Å²	4	45 Å²	45	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129.7	-174.7	-171.5	70.5	0	0	0	111.3	R173 G174 P179 R184 E481 N502 Q504	R173-L182 WeakPolarHBondContact CA-O 3.5Å; G174-L182 PolarHBondContact N-O 3.34Å; P179-L182 HydrophobicContact CB-CB 4.37Å; P179-L182 WeakPolarHBondContact O-CB 3.39Å; P179-L182 PolarHBondContact O-N 2.89Å; L182-R184 HydrophobicContact CD2-CG 4.04Å; L182-R184 HydrophobicContact CG-CG 4.34Å; L182-E481 HydrophobicContact CD1-CB 3.99Å; L182-E481 HydrophobicContact CD1-CG 4.12Å; L182-N502 HydrophobicContact CD1-CB 4.11Å; L182-Q504 HydrophobicContact CD1-CG 4.06Å
183	V	96.4	Very high	91.3	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.9	163.8	179.4	0	0	0	0	107.5	L169 Q172 R173 V186 N502 L503 F505	L169-V183 HydrophobicContact CD2-CG1 4.36Å; Q172-V183 HydrophobicContact CB-CG1 3.96Å; Q172-V183 HydrophobicContact CB-CG2 4.27Å; R173-V183 HydrophobicContact CG-CG2 3.81Å; V183-V186 HydrophobicContact CB-CG1 4.27Å; V183-V186 HydrophobicContact CG1-CG1 4.05Å; V183-N502 WeakPolarHBondContact O-CA 3.41Å; V183-L503 PolarHBondContact N-O 2.8Å; V183-L503 PolarHBondContact O-N 3.16Å; V183-L503 VanDerWaalsContact O-N 3.08Å; V183-F505 HydrophobicContact CB-CD2 3.87Å; V183-F505 HydrophobicContact CB-CE2 3.8Å; V183-F505 HydrophobicContact CG1-CE2 4.49Å; V183-F505 HydrophobicContact CG2-CD2 3.57Å; V183-F505 HydrophobicContact CG2-CE2 3.96Å
184	R	94.5	Very high	91.3	Very high	99 Å²	99	40.4 Å²	40.4	37%	0.374	25%	0.25	S	S	.	.	S	Bend	trans	-85.9	148.1	178.6	-67.2	173.3	168.1	-82.4	-1.5	110.2	T177 L182 V186 N502	T177-R184 PolarHBondContact O-NE 3.26Å; T177-R184 PolarHBondContact O-NH2 3.43Å; T177-R184 PolarHBondContact OG1-NH2 3.27Å; L182-R184 HydrophobicContact CD2-CG 4.04Å; L182-R184 HydrophobicContact CG-CG 4.34Å; R184-V186 PolarHBondContact O-N 3.5Å; R184-N502 VanDerWaalsContact CA-OD1 3.31Å; R184-N502 WeakPolarHBondContact CA-OD1 3.36Å
185	D	93.9	Very high	91.5	Very high	65 Å²	65	38.5 Å²	38.5	35%	0.348	23%	0.231	S	C	.	.			trans	48.8	56.2	176.9	-166.6	43.9	0	0	0	114	A187 G188 E189 S500 I501 N502	D185-A187 PolarHBondContact O-N 2.93Å; D185-G188 PolarHBondContact O-N 3.47Å; D185-E189 PolarHBondContact O-N 3.47Å; D185-S500 WeakPolarHBondContact OD1-CB 3.39Å; D185-S500 PolarHBondContact OD1-OG 3.02Å; D185-I501 WeakPolarHBondContact CA-O 3.49Å; D185-I501 PolarHBondContact N-O 2.88Å; D185-N502 PolarHBondContact N-OD1 3.07Å
186	V	95.7	Very high	91.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-25	180	-54.8	0	0	0	0	112.2	V183 R184 E189 F190 I501 L503 F505	V183-V186 HydrophobicContact CB-CG1 4.27Å; V183-V186 HydrophobicContact CG1-CG1 4.05Å; R184-V186 PolarHBondContact O-N 3.5Å; V186-E189 PolarHBondContact O-N 2.85Å; V186-F190 HydrophobicContact CB-CD2 4.45Å; V186-F190 HydrophobicContact CB-CE2 3.86Å; V186-F190 HydrophobicContact CB-CZ 3.98Å; V186-F190 HydrophobicContact CG2-CD2 4.4Å; V186-F190 HydrophobicContact CG2-CE2 3.82Å; V186-F190 HydrophobicContact CG2-CZ 4.38Å; V186-F190 VanDerWaalsContact O-CD2 3.31Å; V186-F190 WeakPolarHBondContact O-CD2 3.34Å; V186-F190 WeakPolarHBondContact O-CG 3.11Å; V186-F190 PolarHBondContact O-N 3.32Å; V186-I501 HydrophobicContact CG2-CB 3.83Å; V186-I501 HydrophobicContact CG2-CG2 3.59Å; V186-I501 WeakPolarHBondContact CG2-O 3.45Å; V186-I501 PolarHBondContact N-O 3.34Å; V186-L503 HydrophobicContact CG1-CB 4.13Å; V186-L503 HydrophobicContact CG1-CD1 4.3Å; V186-L503 HydrophobicContact CG1-CG 4.26Å; V186-L503 HydrophobicContact CG2-CD1 4Å; V186-L503 HydrophobicContact CG2-CG 4.39Å; V186-F505 HydrophobicContact CG1-CE2 3.86Å; V186-F505 HydrophobicContact CG1-CZ 4.18Å
187	A	92.8	Very high	92.6	Very high	19 Å²	19	28.8 Å²	28.8	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-42.5	173.3	0	0	0	0	0	111.8	D185 E189 F190 Y191 S327	D185-A187 PolarHBondContact O-N 2.93Å; A187-E189 VanDerWaalsContact C-N 3.31Å; A187-E189 PolarHBondContact O-N 3.45Å; A187-F190 PolarHBondContact O-N 2.75Å; A187-Y191 WeakPolarHBondContact O-CB 3.31Å; A187-Y191 PolarHBondContact O-N 3.14Å; A187-S327 VanDerWaalsContact CA-OG 3.3Å; A187-S327 WeakPolarHBondContact CA-OG 3.39Å
188	G	91.9	Very high	93.2	Very high	17 Å²	17	24 Å²	24	18%	0.175	15%	0.145	C	C	.	.	H	α-helix	trans	-67.3	-28.9	174.9	0	0	0	0	0	113.6	D185 K192	D185-G188 PolarHBondContact O-N 3.47Å; G188-K192 WeakPolarHBondContact O-CG 3.37Å; G188-K192 PolarHBondContact O-NZ 3.34Å
189	E	94	Very high	93.6	Very high	19 Å²	19	21.4 Å²	21.4	9%	0.089	12%	0.118	C	C	.	.	H	α-helix	trans	-76.3	-42	173.3	-62.7	-52.6	125	0	0	111.8	R168 D185 V186 A187 Y191 K192 F193	R168-E189 WeakPolarHBondContact CD-OE2 3.46Å; R168-E189 IonicContact CZ-OE2 3.62Å; R168-E189 IonicContact NE-OE2 3.23Å; R168-E189 PolarHBondContact NE-OE2 3.5Å; R168-E189 IonicContact NH2-OE1 3.8Å; R168-E189 IonicContact NH2-OE2 2.95Å; R168-E189 PolarHBondContact NH2-OE2 2.81Å; D185-E189 PolarHBondContact O-N 3.47Å; V186-E189 PolarHBondContact O-N 2.85Å; A187-E189 VanDerWaalsContact C-N 3.31Å; A187-E189 PolarHBondContact O-N 3.45Å; E189-Y191 PolarHBondContact O-N 3.41Å; E189-K192 WeakPolarHBondContact O-CB 3.28Å; E189-K192 PolarHBondContact O-N 3.36Å; E189-K192 IonicContact OE1-NZ 3.13Å; E189-K192 PolarHBondContact OE1-NZ 2.85Å; E189-K192 IonicContact OE2-NZ 2.76Å; E189-F193 PolarHBondContact O-N 2.75Å; E189-F193 VanDerWaalsContact O-N 3.08Å
190	F	95.8	Very high	93.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70	-24.5	175.7	-58.4	-24.2	0	0	0	112.8	L165 L169 V186 A187 F193 G194 S323 L326 S327 L330 I472 F505	L165-F190 HydrophobicContact CD1-CD1 3.95Å; L165-F190 HydrophobicContact CD1-CE1 4.07Å; L165-F190 HydrophobicContact CD2-CD1 4.3Å; L165-F190 HydrophobicContact CD2-CE1 4.39Å; L169-F190 HydrophobicContact CD1-CE1 4.39Å; L169-F190 HydrophobicContact CD2-CE1 4.17Å; V186-F190 HydrophobicContact CB-CD2 4.45Å; V186-F190 HydrophobicContact CB-CE2 3.86Å; V186-F190 HydrophobicContact CB-CZ 3.98Å; V186-F190 HydrophobicContact CG2-CD2 4.4Å; V186-F190 HydrophobicContact CG2-CE2 3.82Å; V186-F190 HydrophobicContact CG2-CZ 4.38Å; V186-F190 VanDerWaalsContact O-CD2 3.31Å; V186-F190 WeakPolarHBondContact O-CD2 3.34Å; V186-F190 WeakPolarHBondContact O-CG 3.11Å; V186-F190 PolarHBondContact O-N 3.32Å; A187-F190 PolarHBondContact O-N 2.75Å; F190-F193 WeakPolarHBondContact O-CB 3.4Å; F190-F193 PolarHBondContact O-N 2.85Å; F190-G194 PolarHBondContact O-N 2.78Å; F190-S323 VanDerWaalsContact O-CB 3.25Å; F190-S323 WeakPolarHBondContact O-CB 3.4Å; F190-L326 HydrophobicContact CB-CD2 4.27Å; F190-L326 HydrophobicContact CD1-CD2 3.78Å; F190-L326 HydrophobicContact CD1-CG 4.41Å; F190-L326 HydrophobicContact CD2-CB 4.08Å; F190-L326 HydrophobicContact CD2-CD2 4.01Å; F190-L326 HydrophobicContact CD2-CG 3.79Å; F190-L326 HydrophobicContact CE1-CD2 4.13Å; F190-L326 HydrophobicContact CE2-CD2 4.38Å; F190-L326 HydrophobicContact CE2-CG 3.98Å; F190-L326 HydrophobicContact CG-CB 4.43Å; F190-L326 HydrophobicContact CG-CD2 3.75Å; F190-L326 HydrophobicContact CG-CG 4.07Å; F190-L326 HydrophobicContact CZ-CD2 4.45Å; F190-L326 HydrophobicContact CZ-CG 4.37Å; F190-S327 WeakPolarHBondContact CD2-OG 3.49Å; F190-L330 HydrophobicContact CE1-CD1 4.35Å; F190-L330 HydrophobicContact CE2-CD1 3.64Å; F190-L330 HydrophobicContact CZ-CD1 3.34Å; F190-I472 HydrophobicContact CE1-CD1 4.35Å; F190-F505 HydrophobicContact CZ-CZ 4.43Å
191	Y	92.8	Very high	93.7	Very high	25 Å²	25	14.7 Å²	14.7	10%	0.098	7%	0.074	C	C	.	.	H	α-helix	trans	-61.7	-47.6	169.3	-164.5	-75.2	0	0	0	111.6	A187 E189 F193 G194 L195 I222 V225 V319 D320	A187-Y191 WeakPolarHBondContact O-CB 3.31Å; A187-Y191 PolarHBondContact O-N 3.14Å; E189-Y191 PolarHBondContact O-N 3.41Å; Y191-F193 VanDerWaalsContact C-N 3.27Å; Y191-F193 PolarHBondContact O-N 2.65Å; Y191-G194 PolarHBondContact O-N 2.87Å; Y191-L195 WeakPolarHBondContact O-CB 3.28Å; Y191-L195 PolarHBondContact O-N 2.93Å; Y191-I222 HydrophobicContact CD1-CG1 4.13Å; Y191-I222 HydrophobicContact CD1-CG2 3.93Å; Y191-I222 HydrophobicContact CE1-CB 4.01Å; Y191-I222 HydrophobicContact CE1-CG1 3.81Å; Y191-I222 HydrophobicContact CE1-CG2 3.6Å; Y191-I222 PolarHBondContact OH-O 2.83Å; Y191-V225 WeakPolarHBondContact OH-CB 3.42Å; Y191-V225 WeakPolarHBondContact OH-CG1 3.48Å; Y191-V319 HydrophobicContact CD1-CG1 3.52Å; Y191-V319 HydrophobicContact CD2-CG1 4.06Å; Y191-V319 HydrophobicContact CE1-CB 4.48Å; Y191-V319 HydrophobicContact CE1-CG1 3.32Å; Y191-V319 HydrophobicContact CE2-CG1 3.93Å; Y191-V319 HydrophobicContact CG-CG1 3.89Å; Y191-V319 WeakPolarHBondContact O-CG1 3.09Å; Y191-D320 WeakPolarHBondContact CE2-OD1 3.47Å; Y191-D320 PolarHBondContact OH-OD1 3.47Å
192	K	93.2	Very high	93.4	Very high	38 Å²	38	14.6 Å²	14.6	17%	0.165	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-39.3	175.7	-64.7	175.8	-163.8	83.3	0	110.8	G188 E189 E196 C209 L210 V214 I222	G188-K192 WeakPolarHBondContact O-CG 3.37Å; G188-K192 PolarHBondContact O-NZ 3.34Å; E189-K192 WeakPolarHBondContact O-CB 3.28Å; E189-K192 PolarHBondContact O-N 3.36Å; E189-K192 IonicContact OE1-NZ 3.13Å; E189-K192 PolarHBondContact OE1-NZ 2.85Å; E189-K192 IonicContact OE2-NZ 2.76Å; K192-E196 WeakPolarHBondContact O-CB 3.48Å; K192-E196 PolarHBondContact O-N 3.28Å; K192-C209 HydrophobicContact CB-CB 3.93Å; K192-C209 WeakPolarHBondContact CD-O 3.5Å; K192-C209 WeakPolarHBondContact O-CB 3.44Å; K192-L210 HydrophobicContact CB-CD2 4.14Å; K192-V214 HydrophobicContact CD-CG2 4.11Å; K192-I222 HydrophobicContact CG-CD1 4.35Å
193	F	95.1	Very high	92.9	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-51.8	173.8	167.3	-105.3	0	0	0	112.7	V161 V162 L165 E189 F190 Y191 L195 E196 G197 L210 V322 L326 E464 A468	V161-F193 HydrophobicContact CB-CE2 4.5Å; V161-F193 HydrophobicContact CG1-CD2 3.69Å; V161-F193 HydrophobicContact CG1-CE2 3.73Å; V162-F193 HydrophobicContact CB-CE2 4.43Å; V162-F193 HydrophobicContact CG2-CE2 3.71Å; V162-F193 HydrophobicContact CG2-CZ 3.82Å; L165-F193 HydrophobicContact CB-CD2 3.78Å; L165-F193 HydrophobicContact CB-CE2 4.28Å; L165-F193 HydrophobicContact CB-CG 4.43Å; L165-F193 HydrophobicContact CD1-CB 4.14Å; L165-F193 HydrophobicContact CD1-CG 4.48Å; L165-F193 HydrophobicContact CD2-CB 4.28Å; L165-F193 HydrophobicContact CD2-CD1 4.09Å; L165-F193 HydrophobicContact CD2-CD2 3.69Å; L165-F193 HydrophobicContact CD2-CE1 4.37Å; L165-F193 HydrophobicContact CD2-CE2 3.99Å; L165-F193 HydrophobicContact CD2-CG 3.74Å; L165-F193 HydrophobicContact CD2-CZ 4.33Å; L165-F193 HydrophobicContact CG-CD2 4.22Å; L165-F193 HydrophobicContact CG-CG 4.44Å; E189-F193 PolarHBondContact O-N 2.75Å; E189-F193 VanDerWaalsContact O-N 3.08Å; F190-F193 WeakPolarHBondContact O-CB 3.4Å; F190-F193 PolarHBondContact O-N 2.85Å; Y191-F193 VanDerWaalsContact C-N 3.27Å; Y191-F193 PolarHBondContact O-N 2.65Å; F193-L195 VanDerWaalsContact C-N 3.28Å; F193-L195 PolarHBondContact O-N 3.16Å; F193-E196 WeakPolarHBondContact O-CB 3.32Å; F193-E196 PolarHBondContact O-N 3.38Å; F193-E196 VanDerWaalsContact O-N 3.15Å; F193-G197 PolarHBondContact O-N 2.63Å; F193-L210 HydrophobicContact CB-CD2 4.17Å; F193-L210 HydrophobicContact CD2-CD1 4.39Å; F193-V322 HydrophobicContact CE1-CG1 4.2Å; F193-L326 HydrophobicContact CD1-CD2 4.12Å; F193-L326 HydrophobicContact CE1-CD2 4.14Å; F193-E464 HydrophobicContact CE1-CG 3.84Å; F193-E464 HydrophobicContact CZ-CG 3.7Å; F193-A468 HydrophobicContact CE1-CB 4.01Å; F193-A468 HydrophobicContact CZ-CB 3.85Å
194	G	94.2	Very high	92.2	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-37.5	179.8	0	0	0	0	0	112.4	F190 Y191 I198	F190-G194 PolarHBondContact O-N 2.78Å; Y191-G194 PolarHBondContact O-N 2.87Å; G194-I198 VanDerWaalsContact O-CG2 3.26Å; G194-I198 WeakPolarHBondContact O-CG2 3.27Å; G194-I198 PolarHBondContact O-N 3.39Å
195	L	93.3	Very high	91.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.9	-46.6	173.9	178.4	56.8	0	0	0	112	Y191 F193 G197 A199 L207 T218 F221 I222 L315 V319	Y191-L195 WeakPolarHBondContact O-CB 3.28Å; Y191-L195 PolarHBondContact O-N 2.93Å; F193-L195 VanDerWaalsContact C-N 3.28Å; F193-L195 PolarHBondContact O-N 3.16Å; L195-G197 VanDerWaalsContact C-N 3.34Å; L195-A199 WeakPolarHBondContact O-CB 3.48Å; L195-A199 PolarHBondContact O-N 2.96Å; L195-L207 HydrophobicContact CD1-CD1 3.93Å; L195-L207 HydrophobicContact CD2-CD1 4.44Å; L195-L207 HydrophobicContact CG-CD1 3.82Å; L195-T218 HydrophobicContact CD2-CG2 3.66Å; L195-F221 HydrophobicContact CD1-CD1 3.76Å; L195-F221 HydrophobicContact CD1-CE1 3.6Å; L195-F221 HydrophobicContact CD2-CD1 3.94Å; L195-I222 HydrophobicContact CD2-CD1 4.03Å; L195-I222 HydrophobicContact CD2-CG1 3.55Å; L195-L315 HydrophobicContact CD1-CD1 3.64Å; L195-L315 HydrophobicContact CD1-CG 4.37Å; L195-V319 HydrophobicContact CB-CG1 3.95Å; L195-V319 HydrophobicContact CB-CG2 4.08Å; L195-V319 HydrophobicContact CD1-CG2 3.89Å
196	E	93.9	Very high	91.2	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-43.5	176.5	-167.5	74.3	-167.1	0	0	111.4	V161 K192 F193 A200 R206 L207 G208 C209 L210	V161-E196 HydrophobicContact CG1-CB 3.89Å; V161-E196 HydrophobicContact CG1-CG 3.78Å; V161-E196 HydrophobicContact CG2-CG 4.1Å; K192-E196 WeakPolarHBondContact O-CB 3.48Å; K192-E196 PolarHBondContact O-N 3.28Å; F193-E196 WeakPolarHBondContact O-CB 3.32Å; F193-E196 PolarHBondContact O-N 3.38Å; F193-E196 VanDerWaalsContact O-N 3.15Å; E196-A200 VanDerWaalsContact O-CB 3.23Å; E196-A200 WeakPolarHBondContact O-CB 3.47Å; E196-A200 PolarHBondContact O-N 3.08Å; E196-R206 VanDerWaalsContact OE1-CA 3.22Å; E196-R206 WeakPolarHBondContact OE1-CA 3.47Å; E196-R206 WeakPolarHBondContact OE1-CB 3.46Å; E196-R206 IonicContact OE1-CZ 3.51Å; E196-R206 IonicContact OE1-NE 3.75Å; E196-R206 PolarHBondContact OE1-NE 3.39Å; E196-R206 IonicContact OE1-NH2 2.79Å; E196-R206 PolarHBondContact OE1-NH2 2.98Å; E196-R206 VanDerWaalsContact OE1-NH2 3.1Å; E196-L207 PolarHBondContact OE1-N 3.23Å; E196-L207 WeakPolarHBondContact OE2-CB 3.41Å; E196-L207 PolarHBondContact OE2-N 3.2Å; E196-G208 PolarHBondContact OE1-N 3.41Å; E196-G208 PolarHBondContact OE2-N 3.17Å; E196-C209 HydrophobicContact CB-CB 4.21Å; E196-C209 WeakPolarHBondContact OE2-CB 3.44Å; E196-C209 PolarHBondContact OE2-N 3.1Å; E196-C209 PolarHBondContact OE2-SG 3.4Å; E196-L210 HydrophobicContact CB-CD1 4.25Å; E196-L210 HydrophobicContact CB-CG 4.28Å; E196-L210 HydrophobicContact CG-CD1 4.11Å; E196-L210 HydrophobicContact CG-CG 4.3Å
197	G	93.5	Very high	90.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.4	-54.6	-178.9	0	0	0	0	0	112.5	F193 L195 A199 A200 V201	F193-G197 PolarHBondContact O-N 2.63Å; L195-G197 VanDerWaalsContact C-N 3.34Å; G197-A199 VanDerWaalsContact C-N 3.33Å; G197-A199 PolarHBondContact O-N 3.4Å; G197-A200 PolarHBondContact O-N 2.64Å; G197-V201 WeakPolarHBondContact O-CG2 3.38Å; G197-V201 PolarHBondContact O-N 2.88Å; G197-V201 VanDerWaalsContact O-N 3.07Å
198	I	92.6	Very high	90.6	Very high	14 Å²	14	12.6 Å²	12.6	7%	0.072	7%	0.07	C	C	.	.	H	α-helix	trans	-65.5	-36.9	179.2	-168.7	60.7	0	0	0	111.6	G194 V201 L202 L315 V319 L460	G194-I198 VanDerWaalsContact O-CG2 3.26Å; G194-I198 WeakPolarHBondContact O-CG2 3.27Å; G194-I198 PolarHBondContact O-N 3.39Å; I198-V201 PolarHBondContact O-N 3.44Å; I198-L202 HydrophobicContact CD1-CD1 4.28Å; I198-L202 HydrophobicContact CD1-CG 4.14Å; I198-L202 HydrophobicContact CG1-CD1 3.78Å; I198-L202 HydrophobicContact CG1-CG 4.07Å; I198-L202 WeakPolarHBondContact O-CB 3.43Å; I198-L202 VanDerWaalsContact O-CG 3.24Å; I198-L202 WeakPolarHBondContact O-CG 3.31Å; I198-L202 PolarHBondContact O-N 3.18Å; I198-L315 HydrophobicContact CG2-CD1 3.52Å; I198-V319 HydrophobicContact CG2-CG2 4.25Å; I198-L460 HydrophobicContact CD1-CD2 4.05Å
199	A	92.1	Very high	90.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-68	-36.4	177.5	0	0	0	0	0	112.2	L195 G197 V201 L202 F203 L207 L315	L195-A199 WeakPolarHBondContact O-CB 3.48Å; L195-A199 PolarHBondContact O-N 2.96Å; G197-A199 VanDerWaalsContact C-N 3.33Å; G197-A199 PolarHBondContact O-N 3.4Å; A199-V201 VanDerWaalsContact C-N 3.3Å; A199-V201 PolarHBondContact O-N 2.85Å; A199-L202 PolarHBondContact O-N 3.35Å; A199-F203 HydrophobicContact CB-CD2 3.9Å; A199-F203 HydrophobicContact CB-CE2 4.22Å; A199-F203 WeakPolarHBondContact O-CA 3.35Å; A199-F203 VanDerWaalsContact O-CB 3.32Å; A199-F203 WeakPolarHBondContact O-CB 3.25Å; A199-F203 WeakPolarHBondContact O-CD2 3.44Å; A199-F203 PolarHBondContact O-N 2.97Å; A199-L207 HydrophobicContact CB-CD1 3.21Å; A199-L207 HydrophobicContact CB-CD2 4.19Å; A199-L207 HydrophobicContact CB-CG 3.49Å; A199-L207 VanDerWaalsContact CB-CG 3.49Å; A199-L315 HydrophobicContact CB-CD1 4.35Å
200	A	90.9	Very high	90.2	Very high	2 Å²	2	11.5 Å²	11.5	2%	0.017	6%	0.061	C	C	.	.	H	α-helix	trans	-64.8	-36.5	173.4	0	0	0	0	0	111.4	T157 V161 E196 G197 G204 S205	T157-A200 HydrophobicContact CG2-CB 3.48Å; T157-A200 VanDerWaalsContact CG2-CB 3.48Å; V161-A200 HydrophobicContact CG2-CB 4.09Å; E196-A200 VanDerWaalsContact O-CB 3.23Å; E196-A200 WeakPolarHBondContact O-CB 3.47Å; E196-A200 PolarHBondContact O-N 3.08Å; G197-A200 PolarHBondContact O-N 2.64Å; A200-G204 WeakPolarHBondContact O-CA 3.5Å; A200-G204 PolarHBondContact O-N 3.41Å; A200-S205 VanDerWaalsContact CA-O 3.26Å; A200-S205 WeakPolarHBondContact CA-O 3.39Å; A200-S205 PolarHBondContact N-O 2.75Å
201	V	90.2	Very high	89.9	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-72.8	-43.4	175.9	171.9	0	0	0	0	112.4	Y154 L158 G197 I198 A199 H292 L293 L460	Y154-V201 HydrophobicContact CD1-CB 4.34Å; Y154-V201 HydrophobicContact CD1-CG1 3.8Å; Y154-V201 HydrophobicContact CD1-CG2 4.13Å; Y154-V201 HydrophobicContact CD2-CG1 4.22Å; Y154-V201 HydrophobicContact CE1-CG1 3.74Å; Y154-V201 HydrophobicContact CE2-CG1 4.15Å; Y154-V201 HydrophobicContact CG-CG1 4.04Å; Y154-V201 HydrophobicContact CG-CG2 4.11Å; L158-V201 HydrophobicContact CD2-CG2 4.13Å; L158-V201 HydrophobicContact CG-CG2 4.46Å; G197-V201 WeakPolarHBondContact O-CG2 3.38Å; G197-V201 PolarHBondContact O-N 2.88Å; G197-V201 VanDerWaalsContact O-N 3.07Å; I198-V201 PolarHBondContact O-N 3.44Å; A199-V201 VanDerWaalsContact C-N 3.3Å; A199-V201 PolarHBondContact O-N 2.85Å; V201-H292 WeakPolarHBondContact O-CA 3.13Å; V201-L293 PolarHBondContact O-N 3.08Å; V201-L460 HydrophobicContact CB-CD2 4.31Å; V201-L460 HydrophobicContact CG1-CD1 4.46Å; V201-L460 HydrophobicContact CG1-CD2 3.84Å; V201-L460 HydrophobicContact CG2-CD1 3.98Å; V201-L460 HydrophobicContact CG2-CD2 4.15Å
202	L	89	Confident	89.3	Confident	2 Å²	2	20 Å²	20	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-72.6	-48.1	-177	-69.8	177.7	0	0	0	111.8	I198 A199 L293 T294 V311 L314 L315	I198-L202 HydrophobicContact CD1-CD1 4.28Å; I198-L202 HydrophobicContact CD1-CG 4.14Å; I198-L202 HydrophobicContact CG1-CD1 3.78Å; I198-L202 HydrophobicContact CG1-CG 4.07Å; I198-L202 WeakPolarHBondContact O-CB 3.43Å; I198-L202 VanDerWaalsContact O-CG 3.24Å; I198-L202 WeakPolarHBondContact O-CG 3.31Å; I198-L202 PolarHBondContact O-N 3.18Å; A199-L202 PolarHBondContact O-N 3.35Å; L202-L293 HydrophobicContact CD2-CB 4.02Å; L202-L293 HydrophobicContact CD2-CD2 3.44Å; L202-L293 VanDerWaalsContact CD2-CD2 3.44Å; L202-L293 HydrophobicContact CD2-CG 4.33Å; L202-L293 PolarHBondContact O-N 3.15Å; L202-T294 WeakPolarHBondContact O-CB 3.34Å; L202-T294 PolarHBondContact O-N 3.24Å; L202-T294 PolarHBondContact O-OG1 2.95Å; L202-V311 HydrophobicContact CD1-CG1 4.33Å; L202-L314 HydrophobicContact CD1-CB 4.07Å; L202-L314 HydrophobicContact CD2-CB 4.03Å; L202-L314 HydrophobicContact CD2-CD1 4.01Å; L202-L315 HydrophobicContact CD1-CB 3.87Å; L202-L315 HydrophobicContact CD1-CD1 4.4Å
203	F	86	Confident	88.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-109	-6	-170.2	-50.9	-67.6	0	0	0	113.6	A199 S205 H267 V268 R271 H292 V311 L315	A199-F203 HydrophobicContact CB-CD2 3.9Å; A199-F203 HydrophobicContact CB-CE2 4.22Å; A199-F203 WeakPolarHBondContact O-CA 3.35Å; A199-F203 VanDerWaalsContact O-CB 3.32Å; A199-F203 WeakPolarHBondContact O-CB 3.25Å; A199-F203 WeakPolarHBondContact O-CD2 3.44Å; A199-F203 PolarHBondContact O-N 2.97Å; F203-S205 WeakPolarHBondContact CB-OG 3.47Å; F203-S205 PolarHBondContact O-N 3.31Å; F203-S205 PolarHBondContact O-OG 2.79Å; F203-H267 HydrophobicContact CD1-CB 3.84Å; F203-H267 HydrophobicContact CD2-CB 4.24Å; F203-H267 HydrophobicContact CE1-CB 3.72Å; F203-H267 HydrophobicContact CE2-CB 4.18Å; F203-H267 HydrophobicContact CG-CB 4.08Å; F203-H267 HydrophobicContact CZ-CB 3.92Å; F203-V268 HydrophobicContact CD1-CG2 4.5Å; F203-V268 HydrophobicContact CE1-CG2 3.96Å; F203-R271 VanDerWaalsContact O-CD 3.32Å; F203-R271 WeakPolarHBondContact O-CD 3.43Å; F203-R271 PolarHBondContact O-NE 2.91Å; F203-H292 PolarHBondContact O-CD2 3.24Å; F203-V311 HydrophobicContact CD1-CG1 4.28Å; F203-V311 HydrophobicContact CE1-CG1 3.28Å; F203-V311 HydrophobicContact CZ-CG1 3.41Å; F203-V311 VanDerWaalsContact CZ-CG1 3.41Å; F203-L315 HydrophobicContact CE2-CD1 4.44Å; F203-L315 HydrophobicContact CE2-CD2 4.25Å; F203-L315 HydrophobicContact CZ-CD2 4.36Å
204	G	81.9	Confident	88.3	Confident	36 Å²	36	27.3 Å²	27.3	37%	0.371	15%	0.153	S	C	.	.	S	Bend	trans	58.2	21.5	-170.7	0	0	0	0	0	113.1	A200 R271 H292	A200-G204 WeakPolarHBondContact O-CA 3.5Å; A200-G204 PolarHBondContact O-N 3.41Å; G204-R271 VanDerWaalsContact C-NH2 3.34Å; G204-R271 PolarHBondContact O-NH2 3.33Å; G204-H292 PolarHBondContact N-CD2 3.03Å
205	S	79.6	Confident	88	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.007	17%	0.167	C	C	.	.			trans	-112.1	146.8	-177.5	-40.7	0	0	0	0	111.8	A200 F203 R270 R271	A200-S205 VanDerWaalsContact CA-O 3.26Å; A200-S205 WeakPolarHBondContact CA-O 3.39Å; A200-S205 PolarHBondContact N-O 2.75Å; F203-S205 WeakPolarHBondContact CB-OG 3.47Å; F203-S205 PolarHBondContact O-N 3.31Å; F203-S205 PolarHBondContact O-OG 2.79Å; S205-R270 VanDerWaalsContact CB-NH2 3.26Å; S205-R270 PolarHBondContact OG-NH2 3.01Å; S205-R271 PolarHBondContact OG-NE 3.49Å; S205-R271 PolarHBondContact OG-NH2 2.99Å
206	R	86.8	Confident	87.7	Confident	93 Å²	93	34.3 Å²	34.3	35%	0.351	20%	0.198	S	C	.	.			trans	-80.7	132.8	156.1	-54.8	-53.9	-55.7	-82.4	-14.7	109	D164 E196	D164-R206 IonicContact OD2-CZ 3.73Å; D164-R206 IonicContact OD2-NH1 3.36Å; D164-R206 PolarHBondContact OD2-NH1 2.92Å; D164-R206 IonicContact OD2-NH2 3.44Å; D164-R206 PolarHBondContact OD2-NH2 3.19Å; E196-R206 VanDerWaalsContact OE1-CA 3.22Å; E196-R206 WeakPolarHBondContact OE1-CA 3.47Å; E196-R206 WeakPolarHBondContact OE1-CB 3.46Å; E196-R206 IonicContact OE1-CZ 3.51Å; E196-R206 IonicContact OE1-NE 3.75Å; E196-R206 PolarHBondContact OE1-NE 3.39Å; E196-R206 IonicContact OE1-NH2 2.79Å; E196-R206 PolarHBondContact OE1-NH2 2.98Å; E196-R206 VanDerWaalsContact OE1-NH2 3.1Å
207	L	87.8	Confident	87.2	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.063	22%	0.217	C	C	.	.			trans	-92.9	-12.6	174.7	-66.3	-177.6	0	0	0	111.8	L195 E196 A199 C209 P215 F263 H267	L195-L207 HydrophobicContact CD1-CD1 3.93Å; L195-L207 HydrophobicContact CD2-CD1 4.44Å; L195-L207 HydrophobicContact CG-CD1 3.82Å; E196-L207 PolarHBondContact OE1-N 3.23Å; E196-L207 WeakPolarHBondContact OE2-CB 3.41Å; E196-L207 PolarHBondContact OE2-N 3.2Å; A199-L207 HydrophobicContact CB-CD1 3.21Å; A199-L207 HydrophobicContact CB-CD2 4.19Å; A199-L207 HydrophobicContact CB-CG 3.49Å; A199-L207 VanDerWaalsContact CB-CG 3.49Å; L207-C209 VanDerWaalsContact C-N 3.32Å; L207-C209 VanDerWaalsContact CB-SG 3.54Å; L207-P215 WeakPolarHBondContact O-CG 3.5Å; L207-F263 HydrophobicContact CD1-CE1 4.23Å; L207-F263 HydrophobicContact CD1-CZ 3.85Å; L207-F263 HydrophobicContact CD2-CE1 4.41Å; L207-F263 HydrophobicContact CD2-CZ 3.85Å; L207-F263 HydrophobicContact CG-CZ 4.48Å; L207-H267 WeakPolarHBondContact CD2-CE1 3.38Å; L207-H267 WeakPolarHBondContact CD2-NE2 3.22Å
208	G	88.3	Confident	86.8	Confident	5 Å²	5	38.1 Å²	38.1	5%	0.052	22%	0.218	C	C	.	.			trans	76	17.4	-177.2	0	0	0	0	0	113.3	E196 L210 E211	E196-G208 PolarHBondContact OE1-N 3.41Å; E196-G208 PolarHBondContact OE2-N 3.17Å; G208-L210 PolarHBondContact O-N 3.4Å; G208-L210 VanDerWaalsContact O-N 3.17Å; G208-E211 WeakPolarHBondContact O-CB 3.43Å; G208-E211 PolarHBondContact O-N 3.46Å
209	C	87.8	Confident	86.5	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.8	-179.1	-49.3	0	0	0	0	112.5	K192 E196 L207 T218	K192-C209 HydrophobicContact CB-CB 3.93Å; K192-C209 WeakPolarHBondContact CD-O 3.5Å; K192-C209 WeakPolarHBondContact O-CB 3.44Å; E196-C209 HydrophobicContact CB-CB 4.21Å; E196-C209 WeakPolarHBondContact OE2-CB 3.44Å; E196-C209 PolarHBondContact OE2-N 3.1Å; E196-C209 PolarHBondContact OE2-SG 3.4Å; L207-C209 VanDerWaalsContact C-N 3.32Å; L207-C209 VanDerWaalsContact CB-SG 3.54Å; C209-T218 HydrophobicContact CB-CG2 4.38Å; C209-T218 WeakPolarHBondContact SG-CG2 3.31Å
210	L	90.4	Very high	86.3	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.063	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-3.4	-176.6	-60.2	176.9	0	0	0	113.1	V161 D164 L165 R168 K192 F193 E196 G208	V161-L210 HydrophobicContact CG1-CD1 3.9Å; V161-L210 WeakPolarHBondContact O-CD1 3.35Å; D164-L210 HydrophobicContact CB-CB 4.12Å; D164-L210 HydrophobicContact CB-CD1 3.72Å; L165-L210 HydrophobicContact CB-CD1 4.47Å; R168-L210 WeakPolarHBondContact CD-O 3.17Å; R168-L210 PolarHBondContact NH1-O 3.02Å; K192-L210 HydrophobicContact CB-CD2 4.14Å; F193-L210 HydrophobicContact CB-CD2 4.17Å; F193-L210 HydrophobicContact CD2-CD1 4.39Å; E196-L210 HydrophobicContact CB-CD1 4.25Å; E196-L210 HydrophobicContact CB-CG 4.28Å; E196-L210 HydrophobicContact CG-CD1 4.11Å; E196-L210 HydrophobicContact CG-CG 4.3Å; G208-L210 PolarHBondContact O-N 3.4Å; G208-L210 VanDerWaalsContact O-N 3.17Å
211	E	88.3	Confident	86.2	Confident	118 Å²	118	43.8 Å²	43.8	55%	0.551	25%	0.248	S	C	*	.	S	Bend	trans	-76.7	160.5	177.1	-63.6	-179.3	-160.1	0	0	112.5	R168 G208 Q213	R168-E211 PolarHBondContact NH1-O 2.99Å; G208-E211 WeakPolarHBondContact O-CB 3.43Å; G208-E211 PolarHBondContact O-N 3.46Å; E211-Q213 PolarHBondContact O-N 2.83Å
212	A	81.1	Confident	86	Confident	87 Å²	87	45.5 Å²	45.5	72%	0.719	26%	0.257	S	S	*	.	S	Bend	trans	-54.1	-33.9	-175	0	0	0	0	0	113.5
213	Q	82.9	Confident	85.9	Confident	169 Å²	169	53.6 Å²	53.6	79%	0.79	29%	0.287	S	S	*	.	S	Bend	trans	-118.1	123.6	172.9	-63.7	178.8	29.9	0	0	108.8	E211	E211-Q213 PolarHBondContact O-N 2.83Å
214	V	84.6	Confident	86.1	Confident	22 Å²	22	53.7 Å²	53.7	13%	0.133	29%	0.288	C	S	.	.			trans	-80.5	133.2	178.2	-178.7	0	0	0	0	108.5	K192 T218 E219	K192-V214 HydrophobicContact CD-CG2 4.11Å; V214-T218 HydrophobicContact CG1-CG2 3.92Å; V214-E219 HydrophobicContact CB-CG 4.08Å; V214-E219 HydrophobicContact CG1-CG 3.81Å
215	P	87.2	Confident	86.3	Confident	45 Å²	45	52 Å²	52	29%	0.292	27%	0.27	S	S	.	.			trans	-57.8	138.8	176.7	-28.3	37.2	0	0	0	112.3	L207 D217 T218 E219	L207-P215 WeakPolarHBondContact O-CG 3.5Å; P215-D217 PolarHBondContact O-N 3.05Å; P215-D217 VanDerWaalsContact O-N 3.16Å; P215-T218 WeakPolarHBondContact O-CB 2.73Å; P215-T218 PolarHBondContact O-N 3.08Å; P215-E219 PolarHBondContact O-N 3.25Å
216	P	86.3	Confident	86.5	Confident	101 Å²	101	52.9 Å²	52.9	66%	0.656	28%	0.28	S	S	*	.	H	α-helix	trans	-57.4	-33.4	-177.4	-27.1	34.1	0	0	0	114.3	E219 T220	P216-E219 PolarHBondContact O-N 3.45Å; P216-T220 PolarHBondContact O-N 2.85Å; P216-T220 PolarHBondContact O-OG1 3Å
217	D	84.1	Confident	86.4	Confident	76 Å²	76	49.6 Å²	49.6	41%	0.406	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-44.3	176.1	-79.8	-41.7	0	0	0	112.2	P215 T220 F221 R266	P215-D217 PolarHBondContact O-N 3.05Å; P215-D217 VanDerWaalsContact O-N 3.16Å; D217-T220 WeakPolarHBondContact O-CB 3.26Å; D217-T220 PolarHBondContact O-N 3.45Å; D217-F221 PolarHBondContact O-N 3.31Å; D217-R266 IonicContact OD1-CZ 2.91Å; D217-R266 IonicContact OD1-NH1 3.38Å; D217-R266 PolarHBondContact OD1-NH1 3.11Å; D217-R266 IonicContact OD1-NH2 3.75Å; D217-R266 PolarHBondContact OD1-NH2 2.83Å; D217-R266 IonicContact OD2-CZ 3.7Å; D217-R266 IonicContact OD2-NH1 3.27Å; D217-R266 PolarHBondContact OD2-NH1 3.46Å; D217-R266 IonicContact OD2-NH2 2.57Å
218	T	84.8	Confident	86.5	Confident	4 Å²	4	49 Å²	49	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-41.5	177	-57.3	0	0	0	0	110.6	L195 C209 V214 P215 T220 F221 I222	L195-T218 HydrophobicContact CD2-CG2 3.66Å; C209-T218 HydrophobicContact CB-CG2 4.38Å; C209-T218 WeakPolarHBondContact SG-CG2 3.31Å; V214-T218 HydrophobicContact CG1-CG2 3.92Å; P215-T218 WeakPolarHBondContact O-CB 2.73Å; P215-T218 PolarHBondContact O-N 3.08Å; T218-T220 VanDerWaalsContact C-N 3.3Å; T218-T220 PolarHBondContact O-N 3.47Å; T218-F221 WeakPolarHBondContact O-CB 3.29Å; T218-F221 PolarHBondContact O-N 2.89Å; T218-I222 HydrophobicContact CG2-CD1 4.09Å; T218-I222 VanDerWaalsContact O-CG1 3.27Å; T218-I222 WeakPolarHBondContact O-CG1 3.17Å; T218-I222 PolarHBondContact O-N 3.36Å
219	E	85.8	Confident	86.3	Confident	75 Å²	75	49.6 Å²	49.6	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-60.5	-41.2	174	-70.3	-162.7	178.7	0	0	112.5	V214 P215 P216 F221 I222 R223	V214-E219 HydrophobicContact CB-CG 4.08Å; V214-E219 HydrophobicContact CG1-CG 3.81Å; P215-E219 PolarHBondContact O-N 3.25Å; P216-E219 PolarHBondContact O-N 3.45Å; E219-F221 VanDerWaalsContact C-N 3.3Å; E219-F221 PolarHBondContact O-N 2.96Å; E219-I222 PolarHBondContact O-N 2.81Å; E219-R223 WeakPolarHBondContact O-CG 3.41Å; E219-R223 PolarHBondContact O-N 3.38Å; E219-R223 IonicContact OE2-CZ 3.34Å; E219-R223 IonicContact OE2-NH2 2.66Å; E219-R223 PolarHBondContact OE2-NH2 3.43Å
220	T	88	Confident	86.1	Confident	58 Å²	58	52.6 Å²	52.6	36%	0.356	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-43.5	177	-58.1	0	0	0	0	110.4	P216 D217 T218 R223 A224 Q259	P216-T220 PolarHBondContact O-N 2.85Å; P216-T220 PolarHBondContact O-OG1 3Å; D217-T220 WeakPolarHBondContact O-CB 3.26Å; D217-T220 PolarHBondContact O-N 3.45Å; T218-T220 VanDerWaalsContact C-N 3.3Å; T218-T220 PolarHBondContact O-N 3.47Å; T220-R223 PolarHBondContact O-N 3.2Å; T220-A224 WeakPolarHBondContact O-CB 3.4Å; T220-A224 PolarHBondContact O-N 3.29Å; T220-Q259 HydrophobicContact CG2-CG 4.42Å
221	F	88.5	Confident	85.9	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.013	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-46.6	174.6	-175.2	-91.1	0	0	0	112.5	L195 D217 T218 E219 R223 A224 V225 M260 F263 L315	L195-F221 HydrophobicContact CD1-CD1 3.76Å; L195-F221 HydrophobicContact CD1-CE1 3.6Å; L195-F221 HydrophobicContact CD2-CD1 3.94Å; D217-F221 PolarHBondContact O-N 3.31Å; T218-F221 WeakPolarHBondContact O-CB 3.29Å; T218-F221 PolarHBondContact O-N 2.89Å; E219-F221 VanDerWaalsContact C-N 3.3Å; E219-F221 PolarHBondContact O-N 2.96Å; F221-R223 VanDerWaalsContact C-N 3.32Å; F221-R223 PolarHBondContact O-N 3.02Å; F221-A224 WeakPolarHBondContact O-CB 3.29Å; F221-A224 PolarHBondContact O-N 2.93Å; F221-V225 HydrophobicContact CD1-CG2 4.07Å; F221-V225 HydrophobicContact CE1-CG2 3.48Å; F221-V225 VanDerWaalsContact CE1-CG2 3.48Å; F221-V225 HydrophobicContact CE2-CG2 4.37Å; F221-V225 HydrophobicContact CZ-CG2 3.63Å; F221-V225 PolarHBondContact O-N 3.28Å; F221-M260 HydrophobicContact CD2-CB 4.32Å; F221-M260 HydrophobicContact CD2-CG 3.97Å; F221-M260 HydrophobicContact CE2-CB 3.79Å; F221-M260 HydrophobicContact CE2-CG 3.56Å; F221-M260 HydrophobicContact CE2-SD 4.35Å; F221-M260 HydrophobicContact CZ-CG 4.23Å; F221-M260 HydrophobicContact CZ-SD 4.46Å; F221-F263 HydrophobicContact CB-CD1 4.44Å; F221-F263 HydrophobicContact CB-CD2 3.9Å; F221-F263 HydrophobicContact CB-CE2 4.14Å; F221-F263 HydrophobicContact CB-CG 4.06Å; F221-F263 HydrophobicContact CD2-CB 3.67Å; F221-F263 AromaticContact CD2-CD1 3.5Å; F221-F263 HydrophobicContact CD2-CD1 3.5Å; F221-F263 HydrophobicContact CD2-CD2 4.26Å; F221-F263 HydrophobicContact CD2-CE1 4.2Å; F221-F263 AromaticContact CD2-CG 3.54Å; F221-F263 HydrophobicContact CD2-CG 3.54Å; F221-F263 HydrophobicContact CE2-CB 4.38Å; F221-F263 AromaticContact CE2-CD1 3.91Å; F221-F263 HydrophobicContact CE2-CD1 3.91Å; F221-F263 HydrophobicContact CE2-CG 4.33Å; F221-F263 AromaticContact CG-CD1 3.96Å; F221-F263 HydrophobicContact CG-CD1 3.96Å; F221-F263 HydrophobicContact CG-CD2 4.3Å; F221-F263 HydrophobicContact CG-CE1 4.24Å; F221-F263 AromaticContact CG-CG 4Å; F221-F263 HydrophobicContact CG-CG 4Å; F221-L315 HydrophobicContact CD2-CD2 4.43Å; F221-L315 HydrophobicContact CE1-CD2 3.95Å; F221-L315 HydrophobicContact CE1-CG 3.91Å; F221-L315 HydrophobicContact CE2-CD2 3.55Å; F221-L315 HydrophobicContact CE2-CG 4.23Å; F221-L315 HydrophobicContact CZ-CB 4.43Å; F221-L315 HydrophobicContact CZ-CD1 4.48Å; F221-L315 HydrophobicContact CZ-CD2 3.3Å; F221-L315 HydrophobicContact CZ-CG 3.46Å; F221-L315 VanDerWaalsContact CZ-CG 3.46Å
222	I	86.4	Confident	85.7	Confident	36 Å²	36	46.7 Å²	46.7	19%	0.185	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-47.1	177.2	-69.6	166.3	0	0	0	110.6	Y191 K192 L195 T218 E219 A224 V225 G226	Y191-I222 HydrophobicContact CD1-CG1 4.13Å; Y191-I222 HydrophobicContact CD1-CG2 3.93Å; Y191-I222 HydrophobicContact CE1-CB 4.01Å; Y191-I222 HydrophobicContact CE1-CG1 3.81Å; Y191-I222 HydrophobicContact CE1-CG2 3.6Å; Y191-I222 PolarHBondContact OH-O 2.83Å; K192-I222 HydrophobicContact CG-CD1 4.35Å; L195-I222 HydrophobicContact CD2-CD1 4.03Å; L195-I222 HydrophobicContact CD2-CG1 3.55Å; T218-I222 HydrophobicContact CG2-CD1 4.09Å; T218-I222 VanDerWaalsContact O-CG1 3.27Å; T218-I222 WeakPolarHBondContact O-CG1 3.17Å; T218-I222 PolarHBondContact O-N 3.36Å; E219-I222 PolarHBondContact O-N 2.81Å; I222-A224 PolarHBondContact O-N 3.26Å; I222-V225 PolarHBondContact O-N 3.39Å; I222-G226 PolarHBondContact O-N 3.46Å; I222-G226 VanDerWaalsContact O-N 3.08Å
223	R	87.3	Confident	85.7	Confident	173 Å²	173	44.3 Å²	44.3	65%	0.653	24%	0.235	S	C	*	.	H	α-helix	trans	-64	-40.7	178.4	-68.2	177.2	-160.7	-174	9.3	111.9	E219 T220 F221 G226 S227	E219-R223 WeakPolarHBondContact O-CG 3.41Å; E219-R223 PolarHBondContact O-N 3.38Å; E219-R223 IonicContact OE2-CZ 3.34Å; E219-R223 IonicContact OE2-NH2 2.66Å; E219-R223 PolarHBondContact OE2-NH2 3.43Å; T220-R223 PolarHBondContact O-N 3.2Å; F221-R223 VanDerWaalsContact C-N 3.32Å; F221-R223 PolarHBondContact O-N 3.02Å; R223-G226 PolarHBondContact O-N 2.96Å; R223-S227 WeakPolarHBondContact O-CB 3.21Å; R223-S227 PolarHBondContact O-N 2.86Å; R223-S227 VanDerWaalsContact O-N 3.08Å
224	A	89.8	Confident	85.6	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-47.2	178.1	0	0	0	0	0	111.7	T220 F221 I222 S227 V228 D256 Q259 M260	T220-A224 WeakPolarHBondContact O-CB 3.4Å; T220-A224 PolarHBondContact O-N 3.29Å; F221-A224 WeakPolarHBondContact O-CB 3.29Å; F221-A224 PolarHBondContact O-N 2.93Å; I222-A224 PolarHBondContact O-N 3.26Å; A224-S227 PolarHBondContact O-N 3.17Å; A224-V228 WeakPolarHBondContact O-CB 3.43Å; A224-V228 PolarHBondContact O-N 3.06Å; A224-D256 HydrophobicContact CB-CB 4.22Å; A224-Q259 HydrophobicContact CB-CB 4.25Å; A224-M260 HydrophobicContact CB-CG 4.07Å
225	V	87	Confident	85.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-45.2	177.5	171.6	0	0	0	0	111.6	Y191 F221 I222 S227 V228 F229 M260 L316	Y191-V225 WeakPolarHBondContact OH-CB 3.42Å; Y191-V225 WeakPolarHBondContact OH-CG1 3.48Å; F221-V225 HydrophobicContact CD1-CG2 4.07Å; F221-V225 HydrophobicContact CE1-CG2 3.48Å; F221-V225 VanDerWaalsContact CE1-CG2 3.48Å; F221-V225 HydrophobicContact CE2-CG2 4.37Å; F221-V225 HydrophobicContact CZ-CG2 3.63Å; F221-V225 PolarHBondContact O-N 3.28Å; I222-V225 PolarHBondContact O-N 3.39Å; V225-S227 PolarHBondContact O-N 3.13Å; V225-V228 WeakPolarHBondContact O-CG1 3.44Å; V225-V228 PolarHBondContact O-N 2.91Å; V225-F229 HydrophobicContact CG1-CD2 4.48Å; V225-F229 HydrophobicContact CG1-CE2 3.88Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; V225-M260 HydrophobicContact CG2-CG 4.32Å; V225-M260 HydrophobicContact CG2-SD 3.58Å; V225-M260 VanDerWaalsContact CG2-SD 3.58Å; V225-L316 HydrophobicContact CB-CD1 4.14Å; V225-L316 HydrophobicContact CG1-CD1 3.51Å; V225-L316 HydrophobicContact CG2-CD1 3.86Å
226	G	82.8	Confident	85.2	Confident	21 Å²	21	40.3 Å²	40.3	22%	0.216	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-34.6	177.6	0	0	0	0	0	113.3	I222 R223	I222-G226 PolarHBondContact O-N 3.46Å; I222-G226 VanDerWaalsContact O-N 3.08Å; R223-G226 PolarHBondContact O-N 2.96Å
227	S	86.3	Confident	84.7	Confident	24 Å²	24	36.9 Å²	36.9	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-81.2	-33.1	179.4	173.4	0	0	0	0	113.5	R223 A224 V225 F229 V230 S231 R252 D256	R223-S227 WeakPolarHBondContact O-CB 3.21Å; R223-S227 PolarHBondContact O-N 2.86Å; R223-S227 VanDerWaalsContact O-N 3.08Å; A224-S227 PolarHBondContact O-N 3.17Å; V225-S227 PolarHBondContact O-N 3.13Å; S227-F229 VanDerWaalsContact C-N 3.33Å; S227-F229 PolarHBondContact O-N 3.39Å; S227-V230 PolarHBondContact O-N 2.8Å; S227-S231 PolarHBondContact O-N 3.13Å; S227-S231 PolarHBondContact O-OG 2.78Å; S227-R252 VanDerWaalsContact OG-CD 3.25Å; S227-R252 WeakPolarHBondContact OG-CD 3.49Å; S227-R252 WeakPolarHBondContact OG-CG 3.27Å; S227-D256 WeakPolarHBondContact CB-OD2 3.38Å; S227-D256 PolarHBondContact OG-OD2 3.5Å
228	V	88.7	Confident	84.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-36.8	-173.3	83.9	0	0	0	0	112.1	A224 V225 S231 T232 D256 W257 M260 L316	A224-V228 WeakPolarHBondContact O-CB 3.43Å; A224-V228 PolarHBondContact O-N 3.06Å; V225-V228 WeakPolarHBondContact O-CG1 3.44Å; V225-V228 PolarHBondContact O-N 2.91Å; V228-S231 WeakPolarHBondContact CA-OG 3.3Å; V228-S231 PolarHBondContact O-OG 3.2Å; V228-S231 VanDerWaalsContact O-OG 3.05Å; V228-T232 VanDerWaalsContact O-CB 3.24Å; V228-T232 WeakPolarHBondContact O-CB 3.34Å; V228-T232 PolarHBondContact O-N 3.45Å; V228-T232 PolarHBondContact O-OG1 3.11Å; V228-D256 HydrophobicContact CB-CB 4.1Å; V228-D256 HydrophobicContact CG2-CB 4.2Å; V228-D256 PolarHBondContact N-OD2 3.5Å; V228-W257 HydrophobicContact CG2-CD2 4.5Å; V228-W257 HydrophobicContact CG2-CG 4.42Å; V228-M260 HydrophobicContact CB-CE 4Å; V228-M260 HydrophobicContact CG1-CE 3.99Å; V228-M260 HydrophobicContact CG2-CE 3.84Å; V228-L316 HydrophobicContact CG1-CD1 3.95Å
229	F	84.4	Confident	84	Confident	16 Å²	16	37.8 Å²	37.8	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-43.4	179.8	-71.8	-60.9	0	0	0	112.3	V225 S227 T232 L233 L316 D320 T493	V225-F229 HydrophobicContact CG1-CD2 4.48Å; V225-F229 HydrophobicContact CG1-CE2 3.88Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; S227-F229 VanDerWaalsContact C-N 3.33Å; S227-F229 PolarHBondContact O-N 3.39Å; F229-T232 WeakPolarHBondContact O-CB 3.23Å; F229-T232 PolarHBondContact O-N 3.16Å; F229-L233 PolarHBondContact O-N 2.81Å; F229-L233 VanDerWaalsContact O-N 3.16Å; F229-L316 HydrophobicContact CE2-CD1 4.05Å; F229-L316 HydrophobicContact CZ-CD1 3.82Å; F229-L316 HydrophobicContact CZ-CG 4.23Å; F229-D320 HydrophobicContact CE2-CB 4.36Å; F229-T493 HydrophobicContact CD1-CG2 3.77Å; F229-T493 HydrophobicContact CE1-CG2 4.33Å; F229-T493 PolarHBondContact O-OG1 3.45Å
230	V	82.8	Confident	83.6	Confident	64 Å²	64	40.8 Å²	40.8	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-66.6	-48.7	178	179.8	0	0	0	0	110.6	S227 T232 L233 L234 R492	S227-V230 PolarHBondContact O-N 2.8Å; V230-T232 PolarHBondContact O-N 2.73Å; V230-L233 PolarHBondContact O-N 3.23Å; V230-L234 HydrophobicContact CG1-CD1 4.11Å; V230-L234 WeakPolarHBondContact O-CG 3.31Å; V230-L234 PolarHBondContact O-N 3.33Å; V230-L234 VanDerWaalsContact O-N 3.11Å; V230-R492 HydrophobicContact CG2-CG 3.59Å
231	S	86.3	Confident	83.3	Confident	3 Å²	3	46 Å²	46	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-30.8	179.1	62	0	0	0	0	112.2	S227 V228 T235	S227-S231 PolarHBondContact O-N 3.13Å; S227-S231 PolarHBondContact O-OG 2.78Å; V228-S231 WeakPolarHBondContact CA-OG 3.3Å; V228-S231 PolarHBondContact O-OG 3.2Å; V228-S231 VanDerWaalsContact O-OG 3.05Å; S231-T235 WeakPolarHBondContact O-CB 3.28Å; S231-T235 PolarHBondContact O-N 2.83Å; S231-T235 PolarHBondContact O-OG1 2.71Å
232	T	85.6	Confident	82.9	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-52.7	173.5	-61.2	0	0	0	0	111.6	F110 W113 V228 F229 V230 L234 T235 M236 L253	F110-T232 HydrophobicContact CD1-CG2 4.49Å; W113-T232 HydrophobicContact CZ2-CG2 4.19Å; W113-T232 VanDerWaalsContact NE1-CG2 3.3Å; W113-T232 PolarHBondContact NE1-OG1 3.31Å; V228-T232 VanDerWaalsContact O-CB 3.24Å; V228-T232 WeakPolarHBondContact O-CB 3.34Å; V228-T232 PolarHBondContact O-N 3.45Å; V228-T232 PolarHBondContact O-OG1 3.11Å; F229-T232 WeakPolarHBondContact O-CB 3.23Å; F229-T232 PolarHBondContact O-N 3.16Å; V230-T232 PolarHBondContact O-N 2.73Å; T232-L234 VanDerWaalsContact C-N 3.33Å; T232-L234 PolarHBondContact O-N 3.15Å; T232-T235 PolarHBondContact O-N 2.9Å; T232-M236 HydrophobicContact CG2-CG 4.26Å; T232-M236 HydrophobicContact CG2-SD 3.86Å; T232-M236 WeakPolarHBondContact O-CB 3.47Å; T232-M236 WeakPolarHBondContact O-CG 3.25Å; T232-M236 PolarHBondContact O-N 3.25Å; T232-L253 WeakPolarHBondContact OG1-CD1 3.29Å
233	L	79.8	Confident	82.7	Confident	38 Å²	38	48.3 Å²	48.3	20%	0.199	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-45.9	179	-72.2	176.2	0	0	0	111.8	L58 F229 V230 T235 M236 A237 T493	L58-L233 HydrophobicContact CD1-CB 4.46Å; F229-L233 PolarHBondContact O-N 2.81Å; F229-L233 VanDerWaalsContact O-N 3.16Å; V230-L233 PolarHBondContact O-N 3.23Å; L233-T235 VanDerWaalsContact C-N 3.34Å; L233-T235 PolarHBondContact O-N 3.04Å; L233-M236 PolarHBondContact O-N 3.33Å; L233-A237 VanDerWaalsContact O-CB 3.3Å; L233-A237 WeakPolarHBondContact O-CB 3.39Å; L233-A237 PolarHBondContact O-N 2.87Å; L233-T493 WeakPolarHBondContact CD1-OG1 3.42Å; L233-T493 VanDerWaalsContact CG-OG1 3.27Å; L233-T493 WeakPolarHBondContact CG-OG1 3.27Å
234	L	80.6	Confident	82.4	Confident	75 Å²	75	51 Å²	51	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-43.4	177.4	-66.6	174.6	0	0	0	111.5	V230 T232 A237 M238 P249	V230-L234 HydrophobicContact CG1-CD1 4.11Å; V230-L234 WeakPolarHBondContact O-CG 3.31Å; V230-L234 PolarHBondContact O-N 3.33Å; V230-L234 VanDerWaalsContact O-N 3.11Å; T232-L234 VanDerWaalsContact C-N 3.33Å; T232-L234 PolarHBondContact O-N 3.15Å; L234-A237 PolarHBondContact O-N 3.48Å; L234-M238 VanDerWaalsContact O-CG 3.27Å; L234-M238 WeakPolarHBondContact O-CG 3.19Å; L234-M238 PolarHBondContact O-N 3.37Å; L234-P249 HydrophobicContact CB-CB 4.08Å; L234-P249 HydrophobicContact CB-CG 4.46Å; L234-P249 HydrophobicContact CD1-CB 4.48Å; L234-P249 HydrophobicContact CD1-CG 4.43Å
235	T	83.3	Confident	82.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-72.4	-32.6	-178.3	-58	0	0	0	0	113.1	P112 S231 T232 L233 R243 W250	P112-T235 HydrophobicContact CB-CG2 3.76Å; P112-T235 HydrophobicContact CG-CG2 3.68Å; S231-T235 WeakPolarHBondContact O-CB 3.28Å; S231-T235 PolarHBondContact O-N 2.83Å; S231-T235 PolarHBondContact O-OG1 2.71Å; T232-T235 PolarHBondContact O-N 2.9Å; L233-T235 VanDerWaalsContact C-N 3.34Å; L233-T235 PolarHBondContact O-N 3.04Å; T235-R243 PolarHBondContact O-NH2 2.81Å; T235-W250 HydrophobicContact CG2-CE3 3.65Å; T235-W250 HydrophobicContact CG2-CZ3 4.19Å
236	M	80.1	Confident	82.1	Confident	76 Å²	76	60 Å²	60	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-69.4	-36.5	172	-73.1	-177.6	69.4	0	0	111.1	F110 P112 T232 L233	F110-M236 HydrophobicContact CD1-SD 4.34Å; P112-M236 HydrophobicContact CG-CG 3.73Å; T232-M236 HydrophobicContact CG2-CG 4.26Å; T232-M236 HydrophobicContact CG2-SD 3.86Å; T232-M236 WeakPolarHBondContact O-CB 3.47Å; T232-M236 WeakPolarHBondContact O-CG 3.25Å; T232-M236 PolarHBondContact O-N 3.25Å; L233-M236 PolarHBondContact O-N 3.33Å
237	A	75.9	Confident	82.3	Confident	30 Å²	30	62.9 Å²	62.9	25%	0.248	31%	0.314	C	S	.	.	H	α-helix	trans	-74.7	-31.5	-179.1	0	0	0	0	0	113.4	F80 L233 L234	F80-A237 HydrophobicContact CE1-CB 3.77Å; F80-A237 HydrophobicContact CZ-CB 3.9Å; L233-A237 VanDerWaalsContact O-CB 3.3Å; L233-A237 WeakPolarHBondContact O-CB 3.39Å; L233-A237 PolarHBondContact O-N 2.87Å; L234-A237 PolarHBondContact O-N 3.48Å
238	M	76.3	Confident	82.4	Confident	34 Å²	34	63.8 Å²	63.8	17%	0.167	33%	0.326	C	S	.	.	S	Bend	trans	-82.4	130.6	-178	-71.6	-174.3	-58.7	0	0	113	L234 L242 P249	L234-M238 VanDerWaalsContact O-CG 3.27Å; L234-M238 WeakPolarHBondContact O-CG 3.19Å; L234-M238 PolarHBondContact O-N 3.37Å; M238-L242 HydrophobicContact CB-CD2 4.45Å; M238-L242 HydrophobicContact CG-CD2 4.2Å; M238-L242 HydrophobicContact SD-CD2 4.41Å; M238-P249 HydrophobicContact CE-CB 3.63Å; M238-P249 HydrophobicContact CE-CG 3.62Å; M238-P249 HydrophobicContact SD-CG 4.44Å
239	P	77.8	Confident	82.4	Confident	64 Å²	64	64.8 Å²	64.8	42%	0.416	33%	0.333	S	S	.	.			trans	-55.7	147.2	168.5	-24.8	34.2	0	0	0	112.3	W241 L242	P239-W241 VanDerWaalsContact C-N 3.29Å; P239-W241 HydrophobicContact CB-CG 4.42Å; P239-W241 PolarHBondContact O-N 3.39Å; P239-L242 WeakPolarHBondContact O-CB 3.39Å; P239-L242 PolarHBondContact O-N 2.91Å
240	Q	79.1	Confident	82.7	Confident	139 Å²	139	65.5 Å²	65.5	65%	0.65	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.9	-174.2	-67.2	-176	-3.5	0	0	113.7	L242 R243	Q240-L242 VanDerWaalsContact C-N 3.28Å; Q240-L242 PolarHBondContact O-N 3.5Å; Q240-R243 VanDerWaalsContact O-CB 3.32Å; Q240-R243 WeakPolarHBondContact O-CB 3.21Å; Q240-R243 PolarHBondContact O-N 3.01Å
241	W	81.1	Confident	83.1	Confident	168 Å²	168	63.5 Å²	63.5	64%	0.636	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-33.7	178.3	63.9	-99.7	0	0	0	112.1	P239 R243 R244 L245	P239-W241 VanDerWaalsContact C-N 3.29Å; P239-W241 HydrophobicContact CB-CG 4.42Å; P239-W241 PolarHBondContact O-N 3.39Å; W241-R243 PolarHBondContact O-N 3.41Å; W241-R244 PolarHBondContact O-N 3.41Å; W241-L245 HydrophobicContact CE3-CD1 4.36Å; W241-L245 HydrophobicContact CZ3-CD1 3.98Å
242	L	80.8	Confident	83.4	Confident	47 Å²	47	69.3 Å²	69.3	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-69.3	-21.3	-179.9	-170.8	62.9	0	0	0	112	M238 P239 Q240 R244 L245 V246	M238-L242 HydrophobicContact CB-CD2 4.45Å; M238-L242 HydrophobicContact CG-CD2 4.2Å; M238-L242 HydrophobicContact SD-CD2 4.41Å; P239-L242 WeakPolarHBondContact O-CB 3.39Å; P239-L242 PolarHBondContact O-N 2.91Å; Q240-L242 VanDerWaalsContact C-N 3.28Å; Q240-L242 PolarHBondContact O-N 3.5Å; L242-R244 PolarHBondContact O-N 3Å; L242-L245 HydrophobicContact CD1-CB 4.34Å; L242-L245 HydrophobicContact CD1-CD1 4.2Å; L242-L245 PolarHBondContact O-N 2.99Å; L242-V246 HydrophobicContact CD1-CG2 4.36Å; L242-V246 HydrophobicContact CG-CG2 4.44Å; L242-V246 PolarHBondContact O-N 3.11Å
243	R	81.5	Confident	83.7	Confident	39 Å²	39	69.2 Å²	69.2	15%	0.147	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-25.5	175.1	-58.6	179.5	-174.7	176.4	1.7	112.9	T235 Q240 W241 L245 V246 P247	T235-R243 PolarHBondContact O-NH2 2.81Å; Q240-R243 VanDerWaalsContact O-CB 3.32Å; Q240-R243 WeakPolarHBondContact O-CB 3.21Å; Q240-R243 PolarHBondContact O-N 3.01Å; W241-R243 PolarHBondContact O-N 3.41Å; R243-L245 VanDerWaalsContact C-N 3.34Å; R243-V246 CarbonylContact O-C 3.56Å; R243-P247 WeakPolarHBondContact O-CA 3.34Å
244	R	81.1	Confident	84.4	Confident	229 Å²	229	68.2 Å²	68.2	86%	0.864	35%	0.345	S	S	*	.	H	α-helix	trans	-70.4	-33.5	174.9	-65.6	-175.7	-179.7	-179.6	0.1	111.7	W241 L242	W241-R244 PolarHBondContact O-N 3.41Å; L242-R244 PolarHBondContact O-N 3Å
245	L	84.3	Confident	85	Confident	126 Å²	126	71 Å²	71	66%	0.66	35%	0.35	S	S	*	.	H	α-helix	trans	-87.5	-34.3	-179.5	-60.2	174.8	0	0	0	111.9	W241 L242 R243 P247	W241-L245 HydrophobicContact CE3-CD1 4.36Å; W241-L245 HydrophobicContact CZ3-CD1 3.98Å; L242-L245 HydrophobicContact CD1-CB 4.34Å; L242-L245 HydrophobicContact CD1-CD1 4.2Å; L242-L245 PolarHBondContact O-N 2.99Å; R243-L245 VanDerWaalsContact C-N 3.34Å; L245-P247 VanDerWaalsContact C-CD 3.49Å; L245-P247 WeakPolarHBondContact O-CD 3.22Å
246	V	86.3	Confident	85.6	Confident	66 Å²	66	71.5 Å²	71.5	40%	0.4	35%	0.352	S	S	.	.			trans	-123.1	75.2	179.7	-168.6	0	0	0	0	109.5	L242 R243 G248	L242-V246 HydrophobicContact CD1-CG2 4.36Å; L242-V246 HydrophobicContact CG-CG2 4.44Å; L242-V246 PolarHBondContact O-N 3.11Å; R243-V246 CarbonylContact O-C 3.56Å; V246-G248 PolarHBondContact O-N 2.81Å
247	P	86.1	Confident	86.3	Confident	81 Å²	81	67.9 Å²	67.9	53%	0.526	34%	0.335	S	S	.	.			trans	-73.8	-12.2	-175.4	29.6	-35.9	0	0	0	113.6	R243 L245 W250 G251	R243-P247 WeakPolarHBondContact O-CA 3.34Å; L245-P247 VanDerWaalsContact C-CD 3.49Å; L245-P247 WeakPolarHBondContact O-CD 3.22Å; P247-W250 PolarHBondContact O-N 3.32Å; P247-G251 PolarHBondContact O-N 3.07Å
248	G	88.8	Confident	87.2	Confident	42 Å²	42	68 Å²	68	43%	0.433	33%	0.331	S	S	.	.	H	α-helix	trans	-53.7	-57.3	-172.6	0	0	0	0	0	114.8	V246 W250 G251 R252	V246-G248 PolarHBondContact O-N 2.81Å; G248-W250 PolarHBondContact O-N 3.24Å; G248-G251 PolarHBondContact O-N 3.3Å; G248-R252 WeakPolarHBondContact O-CB 3.44Å; G248-R252 PolarHBondContact O-N 2.96Å
249	P	88.4	Confident	88	Confident	22 Å²	22	70.3 Å²	70.3	14%	0.143	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-42.1	-178.7	-25.8	36.3	0	0	0	113.4	L234 M238 R252 L253	L234-P249 HydrophobicContact CB-CB 4.08Å; L234-P249 HydrophobicContact CB-CG 4.46Å; L234-P249 HydrophobicContact CD1-CB 4.48Å; L234-P249 HydrophobicContact CD1-CG 4.43Å; M238-P249 HydrophobicContact CE-CB 3.63Å; M238-P249 HydrophobicContact CE-CG 3.62Å; M238-P249 HydrophobicContact SD-CG 4.44Å; P249-R252 PolarHBondContact O-N 2.76Å; P249-L253 WeakPolarHBondContact O-CB 3.43Å; P249-L253 PolarHBondContact O-N 3.46Å
250	W	90.3	Very high	88.8	Confident	30 Å²	30	67.2 Å²	67.2	11%	0.114	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-46.7	176.7	175.3	-107.5	0	0	0	111.9	P112 E115 T235 P247 G248 R252 L253 C254	P112-W250 HydrophobicContact CB-CZ3 4Å; P112-W250 WeakPolarHBondContact O-CZ3 3.36Å; E115-W250 HydrophobicContact CB-CH2 3.91Å; E115-W250 HydrophobicContact CG-CH2 3.55Å; E115-W250 HydrophobicContact CG-CZ2 3.99Å; T235-W250 HydrophobicContact CG2-CE3 3.65Å; T235-W250 HydrophobicContact CG2-CZ3 4.19Å; P247-W250 PolarHBondContact O-N 3.32Å; G248-W250 PolarHBondContact O-N 3.24Å; W250-R252 VanDerWaalsContact C-N 3.3Å; W250-R252 PolarHBondContact O-N 3.28Å; W250-L253 HydrophobicContact CE3-CD2 4.05Å; W250-L253 HydrophobicContact CH2-CD2 4.48Å; W250-L253 HydrophobicContact CZ3-CD2 3.79Å; W250-L253 PolarHBondContact O-N 3.5Å; W250-C254 PolarHBondContact O-N 3.29Å; W250-C254 PolarHBondContact O-SG 3.08Å
251	G	91.4	Very high	89.5	Confident	22 Å²	22	60.7 Å²	60.7	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-38.7	177.5	0	0	0	0	0	112.3	P247 G248 R255	P247-G251 PolarHBondContact O-N 3.07Å; G248-G251 PolarHBondContact O-N 3.3Å; G251-R255 WeakPolarHBondContact O-CG 3.16Å; G251-R255 PolarHBondContact O-N 3.46Å
252	R	92.9	Very high	90.1	Very high	125 Å²	125	54.7 Å²	54.7	47%	0.472	28%	0.277	S	S	.	.	H	α-helix	trans	-63	-49	173	-174.2	177.6	-65	-84.3	3.9	111.4	S227 G248 P249 W250 C254 R255 D256	S227-R252 VanDerWaalsContact OG-CD 3.25Å; S227-R252 WeakPolarHBondContact OG-CD 3.49Å; S227-R252 WeakPolarHBondContact OG-CG 3.27Å; G248-R252 WeakPolarHBondContact O-CB 3.44Å; G248-R252 PolarHBondContact O-N 2.96Å; P249-R252 PolarHBondContact O-N 2.76Å; W250-R252 VanDerWaalsContact C-N 3.3Å; W250-R252 PolarHBondContact O-N 3.28Å; R252-C254 VanDerWaalsContact C-N 3.33Å; R252-C254 PolarHBondContact O-N 2.9Å; R252-R255 PolarHBondContact O-N 3.08Å; R252-R255 VanDerWaalsContact O-N 3.16Å; R252-D256 WeakPolarHBondContact O-CB 3.23Å; R252-D256 PolarHBondContact O-N 2.95Å
253	L	92.2	Very high	90.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.5	-45.1	176.4	-177.8	137	0	0	0	112.2	P112 T232 P249 W250 W257	P112-L253 HydrophobicContact CB-CD1 4.06Å; P112-L253 HydrophobicContact CB-CD2 4.31Å; T232-L253 WeakPolarHBondContact OG1-CD1 3.29Å; P249-L253 WeakPolarHBondContact O-CB 3.43Å; P249-L253 PolarHBondContact O-N 3.46Å; W250-L253 HydrophobicContact CE3-CD2 4.05Å; W250-L253 HydrophobicContact CH2-CD2 4.48Å; W250-L253 HydrophobicContact CZ3-CD2 3.79Å; W250-L253 PolarHBondContact O-N 3.5Å; L253-W257 WeakPolarHBondContact O-CB 3.4Å; L253-W257 VanDerWaalsContact O-CD1 3.26Å; L253-W257 PolarHBondContact O-N 3.38Å
254	C	93.8	Very high	91.2	Very high	18 Å²	18	50.7 Å²	50.7	12%	0.122	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-44	176.6	-67.3	0	0	0	0	112.4	W250 R252 W257 D258	W250-C254 PolarHBondContact O-N 3.29Å; W250-C254 PolarHBondContact O-SG 3.08Å; R252-C254 VanDerWaalsContact C-N 3.33Å; R252-C254 PolarHBondContact O-N 2.9Å; C254-W257 PolarHBondContact O-N 3.47Å; C254-D258 WeakPolarHBondContact O-CB 3.26Å; C254-D258 PolarHBondContact O-N 3.29Å
255	R	94.6	Very high	91.7	Very high	132 Å²	132	43.6 Å²	43.6	50%	0.498	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-46.6	177.4	-75.4	-171.7	-56	-103.7	0.6	112	G251 R252 W257 D258 Q259	G251-R255 WeakPolarHBondContact O-CG 3.16Å; G251-R255 PolarHBondContact O-N 3.46Å; R252-R255 PolarHBondContact O-N 3.08Å; R252-R255 VanDerWaalsContact O-N 3.16Å; R255-W257 VanDerWaalsContact C-N 3.34Å; R255-W257 PolarHBondContact O-N 3.01Å; R255-D258 PolarHBondContact O-N 3.22Å; R255-Q259 WeakPolarHBondContact O-CG 3.5Å; R255-Q259 PolarHBondContact O-N 3.41Å
256	D	94.3	Very high	92.1	Very high	11 Å²	11	42.9 Å²	42.9	6%	0.059	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-44.5	-179.3	-62.9	-17.3	0	0	0	110.1	A224 S227 V228 R252 Q259 M260	A224-D256 HydrophobicContact CB-CB 4.22Å; S227-D256 WeakPolarHBondContact CB-OD2 3.38Å; S227-D256 PolarHBondContact OG-OD2 3.5Å; V228-D256 HydrophobicContact CB-CB 4.1Å; V228-D256 HydrophobicContact CG2-CB 4.2Å; V228-D256 PolarHBondContact N-OD2 3.5Å; R252-D256 WeakPolarHBondContact O-CB 3.23Å; R252-D256 PolarHBondContact O-N 2.95Å; D256-Q259 PolarHBondContact O-N 3.41Å; D256-M260 WeakPolarHBondContact O-CG 3.42Å; D256-M260 PolarHBondContact O-N 3.26Å
257	W	94.6	Very high	92.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-41.5	173.4	-83.9	115.2	0	0	0	113.2	W113 H116 V228 L253 C254 R255 Q259 M260 F261 T312 E313 L316	W113-W257 HydrophobicContact CB-CZ2 4.49Å; W113-W257 AromaticContact CD1-NE1 3.44Å; W113-W257 HydrophobicContact CD2-CH2 4.39Å; W113-W257 AromaticContact CD2-CZ2 3.41Å; W113-W257 HydrophobicContact CD2-CZ2 3.41Å; W113-W257 VanDerWaalsContact CD2-CZ2 3.41Å; W113-W257 AromaticContact CE2-CZ2 3.62Å; W113-W257 HydrophobicContact CE3-CH2 4.11Å; W113-W257 AromaticContact CE3-CZ2 3.54Å; W113-W257 HydrophobicContact CE3-CZ2 3.54Å; W113-W257 AromaticContact CG-CZ2 3.85Å; W113-W257 HydrophobicContact CG-CZ2 3.85Å; W113-W257 AromaticContact CG-NE1 3.76Å; W113-W257 HydrophobicContact CH2-CZ2 4.08Å; W113-W257 AromaticContact CZ2-CZ2 3.97Å; W113-W257 HydrophobicContact CZ2-CZ2 3.97Å; W113-W257 HydrophobicContact CZ3-CH2 4.21Å; W113-W257 AromaticContact CZ3-CZ2 3.88Å; W113-W257 HydrophobicContact CZ3-CZ2 3.88Å; W113-W257 AromaticContact NE1-NE1 3.63Å; H116-W257 VanDerWaalsContact CE1-CB 3.4Å; H116-W257 WeakPolarHBondContact CE1-CB 2.99Å; H116-W257 WeakPolarHBondContact NE2-CB 3.33Å; V228-W257 HydrophobicContact CG2-CD2 4.5Å; V228-W257 HydrophobicContact CG2-CG 4.42Å; L253-W257 WeakPolarHBondContact O-CB 3.4Å; L253-W257 VanDerWaalsContact O-CD1 3.26Å; L253-W257 PolarHBondContact O-N 3.38Å; C254-W257 PolarHBondContact O-N 3.47Å; R255-W257 VanDerWaalsContact C-N 3.34Å; R255-W257 PolarHBondContact O-N 3.01Å; W257-Q259 VanDerWaalsContact C-N 3.3Å; W257-Q259 PolarHBondContact O-N 2.84Å; W257-M260 HydrophobicContact CD2-CE 3.51Å; W257-M260 HydrophobicContact CE3-CE 3.37Å; W257-M260 HydrophobicContact CG-CE 4.05Å; W257-M260 HydrophobicContact CH2-CE 4.18Å; W257-M260 HydrophobicContact CZ2-CE 4.29Å; W257-M260 HydrophobicContact CZ3-CE 3.71Å; W257-M260 PolarHBondContact O-N 2.99Å; W257-F261 HydrophobicContact CE3-CD2 4.05Å; W257-F261 AromaticContact CE3-CE2 3.71Å; W257-F261 HydrophobicContact CE3-CE2 3.71Å; W257-F261 HydrophobicContact CZ3-CE2 4.09Å; W257-F261 VanDerWaalsContact O-CD2 3.3Å; W257-F261 WeakPolarHBondContact O-CD2 2.95Å; W257-F261 PolarHBondContact O-N 2.87Å; W257-T312 HydrophobicContact CE3-CG2 4.45Å; W257-T312 HydrophobicContact CZ3-CG2 4.05Å; W257-E313 HydrophobicContact CH2-CG 4.3Å; W257-L316 HydrophobicContact CH2-CD2 3.41Å; W257-L316 VanDerWaalsContact CH2-CD2 3.41Å; W257-L316 HydrophobicContact CZ2-CD2 3.85Å; W257-L316 HydrophobicContact CZ3-CD2 4.27Å
258	D	95	Very high	92.3	Very high	33 Å²	33	37.5 Å²	37.5	18%	0.176	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-39	178.2	-71	-21.2	0	0	0	111.8	H116 R120 R122 C254 R255 A262	H116-D258 IonicContact CD2-OD1 2.85Å; H116-D258 IonicContact CE1-OD1 2.77Å; H116-D258 IonicContact NE2-OD1 3.26Å; H116-D258 PolarHBondContact NE2-OD1 2.86Å; R120-D258 IonicContact CZ-OD2 3.25Å; R120-D258 IonicContact NE-OD1 2.88Å; R120-D258 PolarHBondContact NE-OD1 3.06Å; R120-D258 IonicContact NE-OD2 3.62Å; R120-D258 PolarHBondContact NE-OD2 2.91Å; R120-D258 VanDerWaalsContact NE-OD2 3.1Å; R120-D258 IonicContact NH2-OD2 2.72Å; R120-D258 PolarHBondContact NH2-OD2 3.16Å; R122-D258 IonicContact CZ-OD1 2.79Å; R122-D258 IonicContact NH1-OD1 3.45Å; R122-D258 PolarHBondContact NH1-OD1 3.02Å; R122-D258 IonicContact NH2-OD1 2.65Å; C254-D258 WeakPolarHBondContact O-CB 3.26Å; C254-D258 PolarHBondContact O-N 3.29Å; R255-D258 PolarHBondContact O-N 3.22Å; D258-A262 WeakPolarHBondContact O-CB 2.98Å; D258-A262 PolarHBondContact O-N 3.42Å
259	Q	94.5	Very high	92.2	Very high	82 Å²	82	40 Å²	40	38%	0.383	19%	0.189	S	C	.	.	H	α-helix	trans	-64.9	-44.8	173.7	-72	176.5	0	0	0	112.3	T220 A224 R255 D256 W257 F261 A262 F263	T220-Q259 HydrophobicContact CG2-CG 4.42Å; A224-Q259 HydrophobicContact CB-CB 4.25Å; R255-Q259 WeakPolarHBondContact O-CG 3.5Å; R255-Q259 PolarHBondContact O-N 3.41Å; D256-Q259 PolarHBondContact O-N 3.41Å; W257-Q259 VanDerWaalsContact C-N 3.3Å; W257-Q259 PolarHBondContact O-N 2.84Å; Q259-F261 PolarHBondContact O-N 3.18Å; Q259-A262 PolarHBondContact O-N 2.85Å; Q259-F263 WeakPolarHBondContact O-CB 3.34Å; Q259-F263 PolarHBondContact O-N 3.4Å
260	M	93.9	Very high	92.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-41.5	178.5	-71.2	-171.7	-72.9	0	0	112.3	F221 A224 V225 V228 D256 W257 F263 A264 T312 L316	F221-M260 HydrophobicContact CD2-CB 4.32Å; F221-M260 HydrophobicContact CD2-CG 3.97Å; F221-M260 HydrophobicContact CE2-CB 3.79Å; F221-M260 HydrophobicContact CE2-CG 3.56Å; F221-M260 HydrophobicContact CE2-SD 4.35Å; F221-M260 HydrophobicContact CZ-CG 4.23Å; F221-M260 HydrophobicContact CZ-SD 4.46Å; A224-M260 HydrophobicContact CB-CG 4.07Å; V225-M260 HydrophobicContact CG2-CG 4.32Å; V225-M260 HydrophobicContact CG2-SD 3.58Å; V225-M260 VanDerWaalsContact CG2-SD 3.58Å; V228-M260 HydrophobicContact CB-CE 4Å; V228-M260 HydrophobicContact CG1-CE 3.99Å; V228-M260 HydrophobicContact CG2-CE 3.84Å; D256-M260 WeakPolarHBondContact O-CG 3.42Å; D256-M260 PolarHBondContact O-N 3.26Å; W257-M260 HydrophobicContact CD2-CE 3.51Å; W257-M260 HydrophobicContact CE3-CE 3.37Å; W257-M260 HydrophobicContact CG-CE 4.05Å; W257-M260 HydrophobicContact CH2-CE 4.18Å; W257-M260 HydrophobicContact CZ2-CE 4.29Å; W257-M260 HydrophobicContact CZ3-CE 3.71Å; W257-M260 PolarHBondContact O-N 2.99Å; M260-F263 PolarHBondContact O-N 3.25Å; M260-A264 PolarHBondContact O-N 2.88Å; M260-T312 HydrophobicContact CB-CG2 3.94Å; M260-L316 HydrophobicContact SD-CD1 4.07Å
261	F	94.6	Very high	91.5	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-42.6	175	-90.6	-94	0	0	0	112.2	R117 R122 W257 Q259 F263 A264 Q265 L308 T312	R117-F261 VanDerWaalsContact CZ-CZ 3.48Å; R122-F261 HydrophobicContact CB-CE1 4.28Å; R122-F261 HydrophobicContact CG-CD1 4.41Å; R122-F261 HydrophobicContact CG-CE1 4.37Å; R122-F261 VanDerWaalsContact CZ-CB 3.41Å; W257-F261 HydrophobicContact CE3-CD2 4.05Å; W257-F261 AromaticContact CE3-CE2 3.71Å; W257-F261 HydrophobicContact CE3-CE2 3.71Å; W257-F261 HydrophobicContact CZ3-CE2 4.09Å; W257-F261 VanDerWaalsContact O-CD2 3.3Å; W257-F261 WeakPolarHBondContact O-CD2 2.95Å; W257-F261 PolarHBondContact O-N 2.87Å; Q259-F261 PolarHBondContact O-N 3.18Å; F261-F263 VanDerWaalsContact C-N 3.28Å; F261-F263 PolarHBondContact O-N 2.86Å; F261-A264 PolarHBondContact O-N 3.08Å; F261-Q265 WeakPolarHBondContact O-CB 3.09Å; F261-Q265 PolarHBondContact O-N 3.18Å; F261-L308 HydrophobicContact CD1-CD1 4.45Å; F261-L308 HydrophobicContact CD1-CD2 3.9Å; F261-L308 HydrophobicContact CD1-CG 3.78Å; F261-L308 HydrophobicContact CE1-CD2 4.49Å; F261-L308 HydrophobicContact CE1-CG 4.09Å; F261-T312 HydrophobicContact CD2-CG2 3.84Å; F261-T312 HydrophobicContact CE2-CG2 3.8Å; F261-T312 HydrophobicContact CG-CG2 4.3Å; F261-T312 HydrophobicContact CZ-CG2 4.29Å
262	A	93.6	Very high	90.9	Very high	42 Å²	42	46.8 Å²	46.8	35%	0.347	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-37.5	177.3	0	0	0	0	0	111.7	D258 Q259 R266	D258-A262 WeakPolarHBondContact O-CB 2.98Å; D258-A262 PolarHBondContact O-N 3.42Å; Q259-A262 PolarHBondContact O-N 2.85Å; A262-R266 WeakPolarHBondContact O-CG 3.49Å; A262-R266 PolarHBondContact O-N 2.84Å; A262-R266 PolarHBondContact O-NE 3Å
263	F	93	Very high	90.3	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-53.2	173.2	-176.8	-91	0	0	0	111.5	L207 F221 Q259 M260 F261 Q265 R266 H267 L315	L207-F263 HydrophobicContact CD1-CE1 4.23Å; L207-F263 HydrophobicContact CD1-CZ 3.85Å; L207-F263 HydrophobicContact CD2-CE1 4.41Å; L207-F263 HydrophobicContact CD2-CZ 3.85Å; L207-F263 HydrophobicContact CG-CZ 4.48Å; F221-F263 HydrophobicContact CB-CD1 4.44Å; F221-F263 HydrophobicContact CB-CD2 3.9Å; F221-F263 HydrophobicContact CB-CE2 4.14Å; F221-F263 HydrophobicContact CB-CG 4.06Å; F221-F263 HydrophobicContact CD2-CB 3.67Å; F221-F263 AromaticContact CD2-CD1 3.5Å; F221-F263 HydrophobicContact CD2-CD1 3.5Å; F221-F263 HydrophobicContact CD2-CD2 4.26Å; F221-F263 HydrophobicContact CD2-CE1 4.2Å; F221-F263 AromaticContact CD2-CG 3.54Å; F221-F263 HydrophobicContact CD2-CG 3.54Å; F221-F263 HydrophobicContact CE2-CB 4.38Å; F221-F263 AromaticContact CE2-CD1 3.91Å; F221-F263 HydrophobicContact CE2-CD1 3.91Å; F221-F263 HydrophobicContact CE2-CG 4.33Å; F221-F263 AromaticContact CG-CD1 3.96Å; F221-F263 HydrophobicContact CG-CD1 3.96Å; F221-F263 HydrophobicContact CG-CD2 4.3Å; F221-F263 HydrophobicContact CG-CE1 4.24Å; F221-F263 AromaticContact CG-CG 4Å; F221-F263 HydrophobicContact CG-CG 4Å; Q259-F263 WeakPolarHBondContact O-CB 3.34Å; Q259-F263 PolarHBondContact O-N 3.4Å; M260-F263 PolarHBondContact O-N 3.25Å; F261-F263 VanDerWaalsContact C-N 3.28Å; F261-F263 PolarHBondContact O-N 2.86Å; F263-Q265 VanDerWaalsContact C-N 3.33Å; F263-Q265 PolarHBondContact O-N 3.43Å; F263-R266 PolarHBondContact O-N 2.88Å; F263-H267 AromaticContact CD1-CD2 3.86Å; F263-H267 AromaticContact CE1-CD2 3.5Å; F263-H267 AromaticContact CE1-NE2 3.78Å; F263-H267 AromaticContact CE2-CD2 3.93Å; F263-H267 AromaticContact CE2-NE2 3.53Å; F263-H267 AromaticContact CZ-CD2 3.54Å; F263-H267 AromaticContact CZ-NE2 3.29Å; F263-H267 VanDerWaalsContact CZ-NE2 3.29Å; F263-H267 WeakPolarHBondContact CZ-NE2 3.27Å; F263-H267 PolarHBondContact O-CD2 2.7Å; F263-H267 VanDerWaalsContact O-CD2 3.29Å; F263-H267 PolarHBondContact O-N 3.19Å; F263-L315 HydrophobicContact CD1-CD2 3.86Å; F263-L315 HydrophobicContact CE1-CD2 3.91Å
264	A	92.1	Very high	89.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-42.6	179.5	0	0	0	0	0	111.9	M260 F261 R266 H267 V268 L308 T312	M260-A264 PolarHBondContact O-N 2.88Å; F261-A264 PolarHBondContact O-N 3.08Å; A264-R266 PolarHBondContact O-N 2.93Å; A264-H267 PolarHBondContact O-N 3.28Å; A264-V268 VanDerWaalsContact O-CG2 3.31Å; A264-V268 WeakPolarHBondContact O-CG2 3.45Å; A264-V268 PolarHBondContact O-N 3.46Å; A264-L308 HydrophobicContact CB-CD1 3.65Å; A264-T312 VanDerWaalsContact CB-OG1 3.24Å; A264-T312 WeakPolarHBondContact CB-OG1 3.38Å
265	Q	92.1	Very high	88.5	Confident	80 Å²	80	47.3 Å²	47.3	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-58.7	-49.5	179.6	-179.8	174	-10	0	0	111.6	F261 F263 H267 V268 E269 L308	F261-Q265 WeakPolarHBondContact O-CB 3.09Å; F261-Q265 PolarHBondContact O-N 3.18Å; F263-Q265 VanDerWaalsContact C-N 3.33Å; F263-Q265 PolarHBondContact O-N 3.43Å; Q265-H267 VanDerWaalsContact C-N 3.28Å; Q265-H267 PolarHBondContact O-N 3.08Å; Q265-V268 PolarHBondContact O-N 3.09Å; Q265-V268 VanDerWaalsContact O-N 3.16Å; Q265-E269 HydrophobicContact CG-CG 4.22Å; Q265-E269 WeakPolarHBondContact CG-OE1 3.37Å; Q265-E269 PolarHBondContact NE2-OE1 3.21Å; Q265-E269 WeakPolarHBondContact O-CB 3.34Å; Q265-E269 WeakPolarHBondContact O-CG 3.33Å; Q265-E269 PolarHBondContact O-N 3.22Å; Q265-L308 HydrophobicContact CB-CD1 3.93Å; Q265-L308 HydrophobicContact CB-CD2 4.11Å; Q265-L308 HydrophobicContact CG-CD2 4.48Å
266	R	91.3	Very high	87.5	Confident	110 Å²	110	43.4 Å²	43.4	42%	0.415	23%	0.226	S	C	.	.	H	α-helix	trans	-57.3	-40.8	177.3	-73.4	-174.2	-68	166.8	-5.5	112.7	D217 A262 F263 A264 R270	D217-R266 IonicContact OD1-CZ 2.91Å; D217-R266 IonicContact OD1-NH1 3.38Å; D217-R266 PolarHBondContact OD1-NH1 3.11Å; D217-R266 IonicContact OD1-NH2 3.75Å; D217-R266 PolarHBondContact OD1-NH2 2.83Å; D217-R266 IonicContact OD2-CZ 3.7Å; D217-R266 IonicContact OD2-NH1 3.27Å; D217-R266 PolarHBondContact OD2-NH1 3.46Å; D217-R266 IonicContact OD2-NH2 2.57Å; A262-R266 WeakPolarHBondContact O-CG 3.49Å; A262-R266 PolarHBondContact O-N 2.84Å; A262-R266 PolarHBondContact O-NE 3Å; F263-R266 PolarHBondContact O-N 2.88Å; A264-R266 PolarHBondContact O-N 2.93Å; R266-R270 VanDerWaalsContact O-CB 3.31Å; R266-R270 WeakPolarHBondContact O-CB 3.47Å; R266-R270 PolarHBondContact O-N 2.9Å
267	H	88.9	Confident	86.5	Confident	24 Å²	24	49.3 Å²	49.3	11%	0.111	26%	0.255	C	S	.	.	H	α-helix	trans	-72.8	-34.1	179	-79.2	-69.7	0	0	0	113.2	F203 L207 F263 A264 Q265 R271	F203-H267 HydrophobicContact CD1-CB 3.84Å; F203-H267 HydrophobicContact CD2-CB 4.24Å; F203-H267 HydrophobicContact CE1-CB 3.72Å; F203-H267 HydrophobicContact CE2-CB 4.18Å; F203-H267 HydrophobicContact CG-CB 4.08Å; F203-H267 HydrophobicContact CZ-CB 3.92Å; L207-H267 WeakPolarHBondContact CD2-CE1 3.38Å; L207-H267 WeakPolarHBondContact CD2-NE2 3.22Å; F263-H267 AromaticContact CD1-CD2 3.86Å; F263-H267 AromaticContact CE1-CD2 3.5Å; F263-H267 AromaticContact CE1-NE2 3.78Å; F263-H267 AromaticContact CE2-CD2 3.93Å; F263-H267 AromaticContact CE2-NE2 3.53Å; F263-H267 AromaticContact CZ-CD2 3.54Å; F263-H267 AromaticContact CZ-NE2 3.29Å; F263-H267 VanDerWaalsContact CZ-NE2 3.29Å; F263-H267 WeakPolarHBondContact CZ-NE2 3.27Å; F263-H267 PolarHBondContact O-CD2 2.7Å; F263-H267 VanDerWaalsContact O-CD2 3.29Å; F263-H267 PolarHBondContact O-N 3.19Å; A264-H267 PolarHBondContact O-N 3.28Å; Q265-H267 VanDerWaalsContact C-N 3.28Å; Q265-H267 PolarHBondContact O-N 3.08Å; H267-R271 VanDerWaalsContact O-CG 3.25Å; H267-R271 WeakPolarHBondContact O-CG 3.43Å; H267-R271 PolarHBondContact O-N 3.22Å
268	V	87.5	Confident	85.1	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-51.4	173.1	173.6	0	0	0	0	110.5	F203 A264 Q265 R270 R271 E272 T294 F298 V311	F203-V268 HydrophobicContact CD1-CG2 4.5Å; F203-V268 HydrophobicContact CE1-CG2 3.96Å; A264-V268 VanDerWaalsContact O-CG2 3.31Å; A264-V268 WeakPolarHBondContact O-CG2 3.45Å; A264-V268 PolarHBondContact O-N 3.46Å; Q265-V268 PolarHBondContact O-N 3.09Å; Q265-V268 VanDerWaalsContact O-N 3.16Å; V268-R270 PolarHBondContact O-N 3.02Å; V268-R271 WeakPolarHBondContact O-CA 3.34Å; V268-R271 WeakPolarHBondContact O-CB 3.33Å; V268-R271 PolarHBondContact O-N 3.17Å; V268-E272 HydrophobicContact CG1-CG 4.49Å; V268-E272 PolarHBondContact O-N 3.36Å; V268-T294 HydrophobicContact CG1-CG2 4.33Å; V268-T294 HydrophobicContact CG2-CG2 4.23Å; V268-F298 HydrophobicContact CG1-CE2 4.24Å; V268-F298 HydrophobicContact CG1-CZ 3.64Å; V268-V311 HydrophobicContact CG2-CG1 4.42Å
269	E	88.1	Confident	83.5	Confident	93 Å²	93	62.6 Å²	62.6	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-59.9	-43.1	-179.4	-72.4	170.7	174.5	0	0	112	Q265 R271 E272 A273	Q265-E269 HydrophobicContact CG-CG 4.22Å; Q265-E269 WeakPolarHBondContact CG-OE1 3.37Å; Q265-E269 PolarHBondContact NE2-OE1 3.21Å; Q265-E269 WeakPolarHBondContact O-CB 3.34Å; Q265-E269 WeakPolarHBondContact O-CG 3.33Å; Q265-E269 PolarHBondContact O-N 3.22Å; E269-R271 PolarHBondContact O-N 2.8Å; E269-E272 PolarHBondContact O-N 3.38Å; E269-A273 WeakPolarHBondContact O-CB 3.37Å; E269-A273 PolarHBondContact O-N 3.26Å
270	R	85.4	Confident	81.8	Confident	104 Å²	104	69 Å²	69	39%	0.392	33%	0.334	S	S	.	.	H	α-helix	trans	-56.6	-39.4	174.6	-174	180	72.5	176.6	0.9	111.4	S205 R266 V268 A273 E274	S205-R270 VanDerWaalsContact CB-NH2 3.26Å; S205-R270 PolarHBondContact OG-NH2 3.01Å; R266-R270 VanDerWaalsContact O-CB 3.31Å; R266-R270 WeakPolarHBondContact O-CB 3.47Å; R266-R270 PolarHBondContact O-N 2.9Å; V268-R270 PolarHBondContact O-N 3.02Å; R270-A273 PolarHBondContact O-N 2.96Å; R270-E274 WeakPolarHBondContact CG-OE1 3.45Å; R270-E274 IonicContact NE-OE1 3.41Å; R270-E274 WeakPolarHBondContact O-CG 3.41Å; R270-E274 PolarHBondContact O-N 2.91Å
271	R	78.4	Confident	79.8	Confident	36 Å²	36	71.7 Å²	71.7	14%	0.136	36%	0.362	C	S	.	.	H	α-helix	trans	-75.5	-39.5	-178.3	-72.1	-68.3	174.1	-170.3	-3	113.1	F203 G204 S205 H267 V268 E269 A273 E274 A275	F203-R271 VanDerWaalsContact O-CD 3.32Å; F203-R271 WeakPolarHBondContact O-CD 3.43Å; F203-R271 PolarHBondContact O-NE 2.91Å; G204-R271 VanDerWaalsContact C-NH2 3.34Å; G204-R271 PolarHBondContact O-NH2 3.33Å; S205-R271 PolarHBondContact OG-NE 3.49Å; S205-R271 PolarHBondContact OG-NH2 2.99Å; H267-R271 VanDerWaalsContact O-CG 3.25Å; H267-R271 WeakPolarHBondContact O-CG 3.43Å; H267-R271 PolarHBondContact O-N 3.22Å; V268-R271 WeakPolarHBondContact O-CA 3.34Å; V268-R271 WeakPolarHBondContact O-CB 3.33Å; V268-R271 PolarHBondContact O-N 3.17Å; E269-R271 PolarHBondContact O-N 2.8Å; R271-A273 VanDerWaalsContact C-N 3.28Å; R271-A273 PolarHBondContact O-N 3.46Å; R271-E274 IonicContact CZ-OE2 3.32Å; R271-E274 IonicContact NE-OE2 3.92Å; R271-E274 IonicContact NH1-OE2 3.1Å; R271-E274 PolarHBondContact NH1-OE2 3.48Å; R271-E274 PolarHBondContact O-N 3.03Å; R271-A275 WeakPolarHBondContact O-CB 3.49Å; R271-A275 PolarHBondContact O-N 3.26Å
272	E	77.6	Confident	77.4	Confident	77 Å²	77	80.2 Å²	80.2	36%	0.36	40%	0.401	S	S	.	.	H	α-helix	trans	-57.2	-45.4	170.5	-70.6	180	160.9	0	0	110.8	V268 E269 A275 A276 F298	V268-E272 HydrophobicContact CG1-CG 4.49Å; V268-E272 PolarHBondContact O-N 3.36Å; E269-E272 PolarHBondContact O-N 3.38Å; E272-A275 PolarHBondContact O-N 3.24Å; E272-A276 WeakPolarHBondContact O-CB 3.47Å; E272-A276 PolarHBondContact O-N 3.28Å; E272-F298 HydrophobicContact CG-CE1 4.1Å; E272-F298 HydrophobicContact CG-CE2 3.71Å; E272-F298 HydrophobicContact CG-CZ 3.41Å; E272-F298 VanDerWaalsContact CG-CZ 3.41Å; E272-F298 WeakPolarHBondContact OE1-CE1 3.44Å; E272-F298 WeakPolarHBondContact OE1-CZ 3.4Å
273	A	81.6	Confident	75.1	Confident	55 Å²	55	84 Å²	84	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-45.3	177.7	0	0	0	0	0	112.4	E269 R270 R271 A275 A276 M277	E269-A273 WeakPolarHBondContact O-CB 3.37Å; E269-A273 PolarHBondContact O-N 3.26Å; R270-A273 PolarHBondContact O-N 2.96Å; R271-A273 VanDerWaalsContact C-N 3.28Å; R271-A273 PolarHBondContact O-N 3.46Å; A273-A275 PolarHBondContact O-N 3.07Å; A273-A276 PolarHBondContact O-N 3.45Å; A273-M277 VanDerWaalsContact O-CG 3.24Å; A273-M277 WeakPolarHBondContact O-CG 3.31Å; A273-M277 PolarHBondContact O-N 3.42Å
274	E	77.1	Confident	73	Confident	60 Å²	60	89.9 Å²	89.9	28%	0.28	45%	0.454	S	S	.	.	H	α-helix	trans	-62.3	-41.7	176.4	-74.4	173.3	-156.4	0	0	112.4	R270 R271 M277 R278	R270-E274 WeakPolarHBondContact CG-OE1 3.45Å; R270-E274 IonicContact NE-OE1 3.41Å; R270-E274 WeakPolarHBondContact O-CG 3.41Å; R270-E274 PolarHBondContact O-N 2.91Å; R271-E274 IonicContact CZ-OE2 3.32Å; R271-E274 IonicContact NE-OE2 3.92Å; R271-E274 IonicContact NH1-OE2 3.1Å; R271-E274 PolarHBondContact NH1-OE2 3.48Å; R271-E274 PolarHBondContact O-N 3.03Å; E274-M277 PolarHBondContact O-N 2.99Å; E274-R278 WeakPolarHBondContact O-CG 3.46Å; E274-R278 PolarHBondContact O-N 2.84Å; E274-R278 VanDerWaalsContact O-N 3.1Å
275	A	71.2	Confident	70.6	Confident	39 Å²	39	99.2 Å²	99.2	32%	0.322	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-42.7	177.4	0	0	0	0	0	112	R271 E272 A273 M277 R278 N279	R271-A275 WeakPolarHBondContact O-CB 3.49Å; R271-A275 PolarHBondContact O-N 3.26Å; E272-A275 PolarHBondContact O-N 3.24Å; A273-A275 PolarHBondContact O-N 3.07Å; A275-M277 VanDerWaalsContact C-N 3.29Å; A275-M277 PolarHBondContact O-N 3.48Å; A275-R278 PolarHBondContact O-N 2.93Å; A275-N279 PolarHBondContact O-N 2.89Å
276	A	73.6	Confident	68.2	Low	50 Å²	50	101.6 Å²	101.6	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-35.1	176.6	0	0	0	0	0	112.5	E272 A273	E272-A276 WeakPolarHBondContact O-CB 3.47Å; E272-A276 PolarHBondContact O-N 3.28Å; A273-A276 PolarHBondContact O-N 3.45Å
277	M	71.9	Confident	65.9	Low	136 Å²	136	101.7 Å²	101.7	67%	0.67	52%	0.521	S	S	*	.	H	α-helix	trans	-71	-37.2	174.9	-69.6	-69.7	-79.7	0	0	112.3	A273 E274 A275 R280	A273-M277 VanDerWaalsContact O-CG 3.24Å; A273-M277 WeakPolarHBondContact O-CG 3.31Å; A273-M277 PolarHBondContact O-N 3.42Å; E274-M277 PolarHBondContact O-N 2.99Å; A275-M277 VanDerWaalsContact C-N 3.29Å; A275-M277 PolarHBondContact O-N 3.48Å; M277-R280 PolarHBondContact O-N 3.03Å
278	R	66.3	Low	63.8	Low	166 Å²	166	108.9 Å²	108.9	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-70.2	-39.6	178.3	-74.3	175.4	-177.6	-176.3	0.7	113.2	E274 A275 R280 G281	E274-R278 WeakPolarHBondContact O-CG 3.46Å; E274-R278 PolarHBondContact O-N 2.84Å; E274-R278 VanDerWaalsContact O-N 3.1Å; A275-R278 PolarHBondContact O-N 2.93Å; R278-R280 PolarHBondContact O-N 2.91Å; R278-R280 VanDerWaalsContact O-N 3.09Å; R278-G281 PolarHBondContact O-N 3.49Å
279	N	60.8	Low	61.7	Low	145 Å²	145	112.4 Å²	112.4	78%	0.775	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-13.2	176.8	-75.8	-6.5	0	0	0	113.8	A275	A275-N279 PolarHBondContact O-N 2.89Å
280	R	58.4	Low	59.9	Low	218 Å²	218	109.6 Å²	109.6	82%	0.823	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-1.2	174	-70.2	178.1	178.9	174.6	0.4	113.5	M277 R278	M277-R280 PolarHBondContact O-N 3.03Å; R278-R280 PolarHBondContact O-N 2.91Å; R278-R280 VanDerWaalsContact O-N 3.09Å
281	G	51.5	Low	58.7	Low	56 Å²	56	105.8 Å²	105.8	58%	0.577	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	-35.1	-163	0	0	0	0	0	119.1	R278	R278-G281 PolarHBondContact O-N 3.49Å
282	Q	45.8	Very low	58.4	Low	179 Å²	179	105.2 Å²	105.2	84%	0.836	57%	0.565	S	S	*	*			trans	-171.1	152.6	-177.8	-110	162.4	11.4	0	0	112.9
283	P	44.6	Very low	58.4	Low	123 Å²	123	101.5 Å²	101.5	80%	0.799	55%	0.548	S	S	*	.			trans	-77.2	150.8	174.5	7.1	9.4	0	0	0	112.9	E285	P283-E285 PolarHBondContact O-N 3.39Å
284	D	49.5	Very low	58	Low	126 Å²	126	98.9 Å²	98.9	67%	0.674	53%	0.527	S	S	*	.			trans	-53.6	112.8	-173.8	-104.1	-33.9	0	0	0	115.7	L287	D284-L287 WeakPolarHBondContact OD1-CD1 3.47Å; D284-L287 WeakPolarHBondContact OD2-CD1 3.45Å
285	E	41.5	Very low	57.9	Low	196 Å²	196	99.4 Å²	99.4	92%	0.916	53%	0.529	S	S	*	.	S	Bend	trans	-124.5	-7.3	154	-74.9	-168.2	161.1	0	0	113.2	P283	P283-E285 PolarHBondContact O-N 3.39Å
286	D	40.9	Very low	57.9	Low	129 Å²	129	98.9 Å²	98.9	69%	0.69	52%	0.519	S	S	*	.			trans	-114.8	33.2	-171.1	-109.4	-3.2	0	0	0	113.7	E288 S289	D286-E288 PolarHBondContact O-N 2.96Å; D286-S289 PolarHBondContact O-N 3.16Å
287	L	44	Very low	58	Low	112 Å²	112	96.6 Å²	96.6	59%	0.586	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-16.9	177.9	-146.9	86.2	0	0	0	113.2	D284	D284-L287 WeakPolarHBondContact OD1-CD1 3.47Å; D284-L287 WeakPolarHBondContact OD2-CD1 3.45Å
288	E	44.4	Very low	58	Low	175 Å²	175	93.1 Å²	93.1	82%	0.818	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-17.8	179.7	-64.5	-163.7	154.5	0	0	114.5	D286	D286-E288 PolarHBondContact O-N 2.96Å
289	S	42.3	Very low	58.2	Low	85 Å²	85	90.7 Å²	90.7	59%	0.594	48%	0.477	S	S	*	.	S	Bend	trans	-96.5	-1.5	-174.7	-150.8	0	0	0	0	114.1	D286	D286-S289 PolarHBondContact O-N 3.16Å
290	G	51.1	Low	58.9	Low	34 Å²	34	89.4 Å²	89.4	35%	0.351	47%	0.467	S	S	.	.			trans	-134	8.3	-168.6	0	0	0	0	0	117.7	H292	G290-H292 VanDerWaalsContact C-N 3.29Å; G290-H292 PolarHBondContact O-N 3.02Å
291	A	59.9	Low	59.6	Low	24 Å²	24	87.5 Å²	87.5	20%	0.198	47%	0.467	C	S	.	.			trans	-76.2	69	-174.9	0	0	0	0	0	113.5	Y154 F296	Y154-A291 WeakPolarHBondContact CE1-O 3.44Å; A291-F296 HydrophobicContact CB-CE2 3.93Å; A291-F296 HydrophobicContact CB-CZ 3.78Å
292	H	72.9	Confident	61	Low	24 Å²	24	85.4 Å²	85.4	11%	0.111	44%	0.443	C	S	.	.			trans	-92.9	152.4	175	62.6	34.6	0	0	0	112.1	V201 F203 G204 G290 T294 H295 F296	V201-H292 WeakPolarHBondContact O-CA 3.13Å; F203-H292 PolarHBondContact O-CD2 3.24Å; G204-H292 PolarHBondContact N-CD2 3.03Å; G290-H292 VanDerWaalsContact C-N 3.29Å; G290-H292 PolarHBondContact O-N 3.02Å; H292-T294 VanDerWaalsContact C-N 3.27Å; H292-T294 PolarHBondContact O-N 3.4Å; H292-T294 VanDerWaalsContact O-N 3.16Å; H292-H295 WeakPolarHBondContact CE1-CB 3.18Å; H292-H295 PolarHBondContact CE1-N 3.05Å; H292-H295 VanDerWaalsContact CE1-N 3.28Å; H292-H295 WeakPolarHBondContact ND1-CB 3.47Å; H292-H295 PolarHBondContact ND1-N 3.3Å; H292-H295 WeakPolarHBondContact O-CB 3.35Å; H292-H295 PolarHBondContact O-N 3.28Å; H292-F296 WeakPolarHBondContact O-CD2 3.48Å
293	L	76.4	Confident	62.8	Low	0 Å²	0	80.6 Å²	80.6	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-56	-40.8	-171.8	-170.6	66.4	0	0	0	112.9	L141 L144 L145 V201 L202 H295 F296 L297 L314	L141-L293 HydrophobicContact CD2-CD1 4.11Å; L141-L293 HydrophobicContact CD2-CD2 4.02Å; L141-L293 HydrophobicContact CD2-CG 4.38Å; L144-L293 HydrophobicContact CB-CD1 3.94Å; L144-L293 HydrophobicContact CD1-CD1 3.72Å; L144-L293 HydrophobicContact CG-CD1 4.47Å; L145-L293 HydrophobicContact CD1-CD2 4.13Å; L145-L293 HydrophobicContact CD2-CD1 4.33Å; L145-L293 HydrophobicContact CG-CD1 4.36Å; V201-L293 PolarHBondContact O-N 3.08Å; L202-L293 HydrophobicContact CD2-CB 4.02Å; L202-L293 HydrophobicContact CD2-CD2 3.44Å; L202-L293 VanDerWaalsContact CD2-CD2 3.44Å; L202-L293 HydrophobicContact CD2-CG 4.33Å; L202-L293 PolarHBondContact O-N 3.15Å; L293-H295 PolarHBondContact O-N 2.84Å; L293-F296 PolarHBondContact O-N 3.05Å; L293-F296 VanDerWaalsContact O-N 3.16Å; L293-L297 HydrophobicContact CG-CD1 4.49Å; L293-L297 HydrophobicContact CG-CG 4.45Å; L293-L297 WeakPolarHBondContact O-CG 3.38Å; L293-L297 PolarHBondContact O-N 3.11Å; L293-L297 VanDerWaalsContact O-N 3.07Å; L293-L314 HydrophobicContact CD2-CD1 3.53Å
294	T	74.3	Confident	64.8	Low	0 Å²	0	77.7 Å²	77.7	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-60.9	-31.8	-178.7	-48.7	0	0	0	0	112.4	L202 V268 H292 L297 F298 I307	L202-T294 WeakPolarHBondContact O-CB 3.34Å; L202-T294 PolarHBondContact O-N 3.24Å; L202-T294 PolarHBondContact O-OG1 2.95Å; V268-T294 HydrophobicContact CG1-CG2 4.33Å; V268-T294 HydrophobicContact CG2-CG2 4.23Å; H292-T294 VanDerWaalsContact C-N 3.27Å; H292-T294 PolarHBondContact O-N 3.4Å; H292-T294 VanDerWaalsContact O-N 3.16Å; T294-L297 PolarHBondContact O-N 3.34Å; T294-F298 HydrophobicContact CG2-CD2 3.99Å; T294-F298 HydrophobicContact CG2-CE2 3.42Å; T294-F298 VanDerWaalsContact CG2-CE2 3.42Å; T294-F298 HydrophobicContact CG2-CZ 4.07Å; T294-F298 WeakPolarHBondContact O-CD2 3.33Å; T294-F298 PolarHBondContact O-N 2.87Å; T294-I307 HydrophobicContact CG2-CG2 3.81Å
295	H	73.9	Confident	66.5	Low	70 Å²	70	77.7 Å²	77.7	32%	0.324	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-46.4	177.9	-178.6	74.7	0	0	0	110.6	H292 L293 L297 F298 Q299	H292-H295 WeakPolarHBondContact CE1-CB 3.18Å; H292-H295 PolarHBondContact CE1-N 3.05Å; H292-H295 VanDerWaalsContact CE1-N 3.28Å; H292-H295 WeakPolarHBondContact ND1-CB 3.47Å; H292-H295 PolarHBondContact ND1-N 3.3Å; H292-H295 WeakPolarHBondContact O-CB 3.35Å; H292-H295 PolarHBondContact O-N 3.28Å; L293-H295 PolarHBondContact O-N 2.84Å; H295-L297 VanDerWaalsContact C-N 3.28Å; H295-L297 PolarHBondContact O-N 2.62Å; H295-F298 WeakPolarHBondContact O-CB 3.3Å; H295-F298 PolarHBondContact O-N 3.05Å; H295-F298 VanDerWaalsContact O-N 3.17Å; H295-Q299 PolarHBondContact NE2-NE2 2.87Å; H295-Q299 PolarHBondContact O-N 3.15Å; H295-Q299 VanDerWaalsContact O-N 3.08Å
296	F	72.1	Confident	68.7	Low	29 Å²	29	68.9 Å²	68.9	13%	0.127	37%	0.369	C	S	.	.	H	α-helix	trans	-62.3	-38.7	176	-63.8	-66.9	0	0	0	111.5	L144 A291 H292 L293 F298 Q299 E300	L144-F296 HydrophobicContact CD1-CB 3.71Å; L144-F296 HydrophobicContact CD1-CG 4.29Å; L144-F296 HydrophobicContact CD2-CB 4.34Å; L144-F296 HydrophobicContact CD2-CD1 4.34Å; L144-F296 HydrophobicContact CD2-CD2 4.39Å; L144-F296 HydrophobicContact CD2-CG 4.1Å; A291-F296 HydrophobicContact CB-CE2 3.93Å; A291-F296 HydrophobicContact CB-CZ 3.78Å; H292-F296 WeakPolarHBondContact O-CD2 3.48Å; L293-F296 PolarHBondContact O-N 3.05Å; L293-F296 VanDerWaalsContact O-N 3.16Å; F296-F298 VanDerWaalsContact C-N 3.28Å; F296-F298 PolarHBondContact O-N 3.32Å; F296-Q299 PolarHBondContact O-N 3.41Å; F296-E300 WeakPolarHBondContact O-CG 3.39Å; F296-E300 PolarHBondContact O-N 3.16Å
297	L	75.4	Confident	71	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-33.6	176.6	-63.7	-176	0	0	0	112.9	L140 L141 L293 T294 H295 L302 I307 V311	L140-L297 HydrophobicContact CD2-CD2 3.3Å; L141-L297 HydrophobicContact CD2-CD2 3.79Å; L293-L297 HydrophobicContact CG-CD1 4.49Å; L293-L297 HydrophobicContact CG-CG 4.45Å; L293-L297 WeakPolarHBondContact O-CG 3.38Å; L293-L297 PolarHBondContact O-N 3.11Å; L293-L297 VanDerWaalsContact O-N 3.07Å; T294-L297 PolarHBondContact O-N 3.34Å; H295-L297 VanDerWaalsContact C-N 3.28Å; H295-L297 PolarHBondContact O-N 2.62Å; L297-L302 HydrophobicContact CB-CD1 4.39Å; L297-L302 HydrophobicContact CD2-CD1 3.97Å; L297-I307 HydrophobicContact CB-CD1 4.15Å; L297-I307 HydrophobicContact CB-CG1 4.04Å; L297-I307 HydrophobicContact CB-CG2 4.25Å; L297-I307 HydrophobicContact CD1-CG2 4.15Å; L297-V311 HydrophobicContact CD1-CG2 4.13Å
298	F	71.3	Confident	73.2	Confident	62 Å²	62	58.4 Å²	58.4	27%	0.272	31%	0.314	S	S	.	.	H	α-helix	trans	-70.5	-38	173.2	-74.5	-58.3	0	0	0	112.9	V268 E272 T294 H295 F296 E300 E301 I307	V268-F298 HydrophobicContact CG1-CE2 4.24Å; V268-F298 HydrophobicContact CG1-CZ 3.64Å; E272-F298 HydrophobicContact CG-CE1 4.1Å; E272-F298 HydrophobicContact CG-CE2 3.71Å; E272-F298 HydrophobicContact CG-CZ 3.41Å; E272-F298 VanDerWaalsContact CG-CZ 3.41Å; E272-F298 WeakPolarHBondContact OE1-CE1 3.44Å; E272-F298 WeakPolarHBondContact OE1-CZ 3.4Å; T294-F298 HydrophobicContact CG2-CD2 3.99Å; T294-F298 HydrophobicContact CG2-CE2 3.42Å; T294-F298 VanDerWaalsContact CG2-CE2 3.42Å; T294-F298 HydrophobicContact CG2-CZ 4.07Å; T294-F298 WeakPolarHBondContact O-CD2 3.33Å; T294-F298 PolarHBondContact O-N 2.87Å; H295-F298 WeakPolarHBondContact O-CB 3.3Å; H295-F298 PolarHBondContact O-N 3.05Å; H295-F298 VanDerWaalsContact O-N 3.17Å; F296-F298 VanDerWaalsContact C-N 3.28Å; F296-F298 PolarHBondContact O-N 3.32Å; F298-E300 PolarHBondContact O-N 3.45Å; F298-E301 PolarHBondContact O-N 3Å; F298-E301 VanDerWaalsContact O-N 3.16Å; F298-I307 HydrophobicContact CD1-CD1 3.29Å; F298-I307 HydrophobicContact CE1-CD1 3.36Å; F298-I307 HydrophobicContact CG-CD1 3.98Å; F298-I307 HydrophobicContact CZ-CD1 4.13Å; F298-I307 HydrophobicContact CZ-CG2 4.41Å
299	Q	72.2	Confident	75.5	Confident	115 Å²	115	50.1 Å²	50.1	54%	0.537	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-28.4	177.6	-71.8	-179.7	-23	0	0	112.9	H295 F296 E301	H295-Q299 PolarHBondContact NE2-NE2 2.87Å; H295-Q299 PolarHBondContact O-N 3.15Å; H295-Q299 VanDerWaalsContact O-N 3.08Å; F296-Q299 PolarHBondContact O-N 3.41Å; Q299-E301 PolarHBondContact O-N 3.3Å
300	E	74.6	Confident	77.9	Confident	119 Å²	119	46.1 Å²	46.1	56%	0.556	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	13.6	177.2	-63.3	-72.4	149.8	0	0	113.4	L140 F296 F298 L302	L140-E300 HydrophobicContact CD1-CB 3.73Å; L140-E300 HydrophobicContact CD1-CG 3.96Å; L140-E300 HydrophobicContact CD2-CG 4.44Å; L140-E300 HydrophobicContact CG-CB 4.45Å; L140-E300 HydrophobicContact CG-CG 4.15Å; F296-E300 WeakPolarHBondContact O-CG 3.39Å; F296-E300 PolarHBondContact O-N 3.16Å; F298-E300 PolarHBondContact O-N 3.45Å; E300-L302 HydrophobicContact CB-CG 4.45Å; E300-L302 PolarHBondContact O-N 3.19Å
301	E	74.1	Confident	79.8	Confident	178 Å²	178	44.5 Å²	44.5	83%	0.832	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	33.9	178.9	-60.8	-174.1	169.9	0	0	114	F298 Q299	F298-E301 PolarHBondContact O-N 3Å; F298-E301 VanDerWaalsContact O-N 3.16Å; Q299-E301 PolarHBondContact O-N 3.3Å
302	L	79.1	Confident	81.4	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.063	22%	0.221	C	C	.	.			trans	-69.4	142	175.3	-70.4	179.3	0	0	0	110.9	L140 L297 E300 A304 I307	L140-L302 HydrophobicContact CD1-CD1 3.8Å; L140-L302 HydrophobicContact CD1-CD2 4Å; L140-L302 HydrophobicContact CD1-CG 4.01Å; L140-L302 HydrophobicContact CD2-CD1 4.14Å; L297-L302 HydrophobicContact CB-CD1 4.39Å; L297-L302 HydrophobicContact CD2-CD1 3.97Å; E300-L302 HydrophobicContact CB-CG 4.45Å; E300-L302 PolarHBondContact O-N 3.19Å; L302-A304 PolarHBondContact O-N 2.6Å; L302-I307 HydrophobicContact CB-CD1 4.13Å; L302-I307 HydrophobicContact CB-CG1 3.77Å
303	P	85.4	Confident	82.4	Confident	78 Å²	78	42.3 Å²	42.3	51%	0.506	22%	0.216	S	C	.	.			trans	-56.6	136.7	171.9	-23.1	32.4	0	0	0	110.7	Q305 S306 I307	P303-Q305 PolarHBondContact O-N 3.39Å; P303-S306 WeakPolarHBondContact O-CA 3.26Å; P303-S306 VanDerWaalsContact O-CB 3.26Å; P303-S306 WeakPolarHBondContact O-CB 3.24Å; P303-S306 PolarHBondContact O-N 3.04Å; P303-I307 PolarHBondContact O-N 2.83Å; P303-I307 VanDerWaalsContact O-N 3.16Å
304	A	84.8	Confident	83.2	Confident	62 Å²	62	43.1 Å²	43.1	51%	0.512	22%	0.22	S	C	.	.	H	α-helix	trans	-52.3	-36.7	-177.8	0	0	0	0	0	113.2	L302 S306 I307 L308	L302-A304 PolarHBondContact O-N 2.6Å; A304-S306 VanDerWaalsContact C-N 3.32Å; A304-S306 PolarHBondContact O-N 2.96Å; A304-I307 PolarHBondContact O-N 2.76Å; A304-L308 WeakPolarHBondContact O-CB 3.33Å; A304-L308 PolarHBondContact O-N 2.95Å
305	Q	86.2	Confident	84	Confident	125 Å²	125	43.1 Å²	43.1	58%	0.584	22%	0.22	S	C	*	.	H	α-helix	trans	-62.4	-36.9	175.3	-66.6	-173.6	-9.3	0	0	113	A123 P303 G309	A123-Q305 HydrophobicContact CB-CB 4.24Å; A123-Q305 WeakPolarHBondContact CB-O 3.1Å; P303-Q305 PolarHBondContact O-N 3.39Å; Q305-G309 PolarHBondContact O-N 2.83Å
306	S	87.8	Confident	84.9	Confident	12 Å²	12	39.9 Å²	39.9	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-69.3	-41.4	176.3	-177.2	0	0	0	0	111.5	P303 A304 L308 G309 N310	P303-S306 WeakPolarHBondContact O-CA 3.26Å; P303-S306 VanDerWaalsContact O-CB 3.26Å; P303-S306 WeakPolarHBondContact O-CB 3.24Å; P303-S306 PolarHBondContact O-N 3.04Å; A304-S306 VanDerWaalsContact C-N 3.32Å; A304-S306 PolarHBondContact O-N 2.96Å; S306-L308 VanDerWaalsContact C-N 3.35Å; S306-G309 PolarHBondContact O-N 2.84Å; S306-N310 PolarHBondContact O-N 3.13Å; S306-N310 PolarHBondContact O-ND2 2.94Å
307	I	88.1	Confident	85.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-50	174.2	-60.8	-179.9	0	0	0	109.5	T294 L297 F298 L302 P303 A304 G309 N310 V311	T294-I307 HydrophobicContact CG2-CG2 3.81Å; L297-I307 HydrophobicContact CB-CD1 4.15Å; L297-I307 HydrophobicContact CB-CG1 4.04Å; L297-I307 HydrophobicContact CB-CG2 4.25Å; L297-I307 HydrophobicContact CD1-CG2 4.15Å; F298-I307 HydrophobicContact CD1-CD1 3.29Å; F298-I307 HydrophobicContact CE1-CD1 3.36Å; F298-I307 HydrophobicContact CG-CD1 3.98Å; F298-I307 HydrophobicContact CZ-CD1 4.13Å; F298-I307 HydrophobicContact CZ-CG2 4.41Å; L302-I307 HydrophobicContact CB-CD1 4.13Å; L302-I307 HydrophobicContact CB-CG1 3.77Å; P303-I307 PolarHBondContact O-N 2.83Å; P303-I307 VanDerWaalsContact O-N 3.16Å; A304-I307 PolarHBondContact O-N 2.76Å; I307-G309 PolarHBondContact O-N 3.23Å; I307-N310 PolarHBondContact O-N 2.6Å; I307-V311 HydrophobicContact CG2-CG2 4.14Å; I307-V311 WeakPolarHBondContact O-CB 3.05Å; I307-V311 VanDerWaalsContact O-CG2 3.28Å; I307-V311 WeakPolarHBondContact O-CG2 3.27Å; I307-V311 PolarHBondContact O-N 3.28Å
308	L	91.2	Very high	86.5	Confident	21 Å²	21	40.6 Å²	40.6	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-43.7	178.9	-177.5	59.9	0	0	0	112.5	F261 A264 Q265 A304 S306 T312	F261-L308 HydrophobicContact CD1-CD1 4.45Å; F261-L308 HydrophobicContact CD1-CD2 3.9Å; F261-L308 HydrophobicContact CD1-CG 3.78Å; F261-L308 HydrophobicContact CE1-CD2 4.49Å; F261-L308 HydrophobicContact CE1-CG 4.09Å; A264-L308 HydrophobicContact CB-CD1 3.65Å; Q265-L308 HydrophobicContact CB-CD1 3.93Å; Q265-L308 HydrophobicContact CB-CD2 4.11Å; Q265-L308 HydrophobicContact CG-CD2 4.48Å; A304-L308 WeakPolarHBondContact O-CB 3.33Å; A304-L308 PolarHBondContact O-N 2.95Å; S306-L308 VanDerWaalsContact C-N 3.35Å; L308-T312 VanDerWaalsContact O-CB 3.31Å; L308-T312 WeakPolarHBondContact O-CB 3.49Å; L308-T312 PolarHBondContact O-N 2.99Å; L308-T312 PolarHBondContact O-OG1 3.15Å
309	G	92.4	Very high	87.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-48.6	176.1	0	0	0	0	0	112.6	Q305 S306 I307 E313	Q305-G309 PolarHBondContact O-N 2.83Å; S306-G309 PolarHBondContact O-N 2.84Å; I307-G309 PolarHBondContact O-N 3.23Å; G309-E313 WeakPolarHBondContact O-CG 3.26Å; G309-E313 PolarHBondContact O-N 2.96Å
310	N	92.1	Very high	88.1	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.011	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-47	179.4	-80.1	-81.1	0	0	0	112.6	L126 L137 S306 I307 T312 E313 L314	L126-N310 PolarHBondContact N-OD1 3.37Å; L137-N310 VanDerWaalsContact CD2-ND2 3.31Å; L137-N310 WeakPolarHBondContact CD2-ND2 3.37Å; S306-N310 PolarHBondContact O-N 3.13Å; S306-N310 PolarHBondContact O-ND2 2.94Å; I307-N310 PolarHBondContact O-N 2.6Å; N310-T312 VanDerWaalsContact C-N 3.34Å; N310-T312 PolarHBondContact O-N 3.11Å; N310-E313 PolarHBondContact O-N 3.13Å; N310-L314 WeakPolarHBondContact O-CB 3.43Å; N310-L314 VanDerWaalsContact O-CG 3.25Å; N310-L314 WeakPolarHBondContact O-CG 3.27Å; N310-L314 PolarHBondContact O-N 3.06Å
311	V	92.1	Very high	88.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-42.7	179.9	168.1	0	0	0	0	111	L202 F203 V268 L297 I307 E313 L314 L315	L202-V311 HydrophobicContact CD1-CG1 4.33Å; F203-V311 HydrophobicContact CD1-CG1 4.28Å; F203-V311 HydrophobicContact CE1-CG1 3.28Å; F203-V311 HydrophobicContact CZ-CG1 3.41Å; F203-V311 VanDerWaalsContact CZ-CG1 3.41Å; V268-V311 HydrophobicContact CG2-CG1 4.42Å; L297-V311 HydrophobicContact CD1-CG2 4.13Å; I307-V311 HydrophobicContact CG2-CG2 4.14Å; I307-V311 WeakPolarHBondContact O-CB 3.05Å; I307-V311 VanDerWaalsContact O-CG2 3.28Å; I307-V311 WeakPolarHBondContact O-CG2 3.27Å; I307-V311 PolarHBondContact O-N 3.28Å; V311-E313 VanDerWaalsContact C-N 3.34Å; V311-E313 PolarHBondContact O-N 3.38Å; V311-L314 PolarHBondContact O-N 3.45Å; V311-L315 WeakPolarHBondContact O-CB 3.39Å; V311-L315 PolarHBondContact O-N 2.85Å
312	T	93.7	Very high	90	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-42.1	177.8	-53.2	0	0	0	0	111.6	W257 M260 F261 A264 L308 N310 L316	W257-T312 HydrophobicContact CE3-CG2 4.45Å; W257-T312 HydrophobicContact CZ3-CG2 4.05Å; M260-T312 HydrophobicContact CB-CG2 3.94Å; F261-T312 HydrophobicContact CD2-CG2 3.84Å; F261-T312 HydrophobicContact CE2-CG2 3.8Å; F261-T312 HydrophobicContact CG-CG2 4.3Å; F261-T312 HydrophobicContact CZ-CG2 4.29Å; A264-T312 VanDerWaalsContact CB-OG1 3.24Å; A264-T312 WeakPolarHBondContact CB-OG1 3.38Å; L308-T312 VanDerWaalsContact O-CB 3.31Å; L308-T312 WeakPolarHBondContact O-CB 3.49Å; L308-T312 PolarHBondContact O-N 2.99Å; L308-T312 PolarHBondContact O-OG1 3.15Å; N310-T312 VanDerWaalsContact C-N 3.34Å; N310-T312 PolarHBondContact O-N 3.11Å; T312-L316 PolarHBondContact O-N 3.12Å
313	E	93.1	Very high	90.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-75.2	-35.2	-179.4	-72.2	-178.7	-166.4	0	0	113.3	R117 G125 L126 L127 T128 W257 G309 N310 V311 A317	R117-E313 IonicContact CZ-OE1 3.47Å; R117-E313 IonicContact NE-OE1 3.38Å; R117-E313 IonicContact NH2-OE1 3.57Å; R117-E313 PolarHBondContact NH2-OE1 3.45Å; G125-E313 VanDerWaalsContact CA-CD 3.42Å; G125-E313 WeakPolarHBondContact CA-OE2 3.41Å; G125-E313 PolarHBondContact N-OE1 2.96Å; G125-E313 PolarHBondContact N-OE2 3.43Å; L126-E313 PolarHBondContact N-OE2 2.75Å; L127-E313 WeakPolarHBondContact CA-OE2 3.23Å; L127-E313 WeakPolarHBondContact CB-OE2 3.36Å; L127-E313 HydrophobicContact CD1-CB 4.18Å; L127-E313 PolarHBondContact N-OE2 3.29Å; T128-E313 WeakPolarHBondContact CG2-OE1 3.27Å; T128-E313 PolarHBondContact N-OE2 2.98Å; T128-E313 PolarHBondContact OG1-OE1 3.21Å; T128-E313 VanDerWaalsContact OG1-OE1 3.05Å; W257-E313 HydrophobicContact CH2-CG 4.3Å; G309-E313 WeakPolarHBondContact O-CG 3.26Å; G309-E313 PolarHBondContact O-N 2.96Å; N310-E313 PolarHBondContact O-N 3.13Å; V311-E313 VanDerWaalsContact C-N 3.34Å; V311-E313 PolarHBondContact O-N 3.38Å; E313-A317 WeakPolarHBondContact O-CB 3.26Å; E313-A317 PolarHBondContact O-N 2.88Å
314	L	93.1	Very high	91.2	Very high	17 Å²	17	16.8 Å²	16.8	9%	0.089	11%	0.105	C	C	.	.	H	α-helix	trans	-66.8	-39.8	172.3	-71.4	172.8	0	0	0	111.4	L141 L202 L293 N310 V311 A317 G318	L141-L314 HydrophobicContact CD1-CD1 4.4Å; L202-L314 HydrophobicContact CD1-CB 4.07Å; L202-L314 HydrophobicContact CD2-CB 4.03Å; L202-L314 HydrophobicContact CD2-CD1 4.01Å; L293-L314 HydrophobicContact CD2-CD1 3.53Å; N310-L314 WeakPolarHBondContact O-CB 3.43Å; N310-L314 VanDerWaalsContact O-CG 3.25Å; N310-L314 WeakPolarHBondContact O-CG 3.27Å; N310-L314 PolarHBondContact O-N 3.06Å; V311-L314 PolarHBondContact O-N 3.45Å; L314-A317 PolarHBondContact O-N 2.79Å; L314-G318 PolarHBondContact O-N 2.73Å
315	L	92.3	Very high	91.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.1	-53.1	174.2	-176.7	61	0	0	0	109.7	L195 I198 A199 L202 F203 F221 F263 V311 A317 G318 V319	L195-L315 HydrophobicContact CD1-CD1 3.64Å; L195-L315 HydrophobicContact CD1-CG 4.37Å; I198-L315 HydrophobicContact CG2-CD1 3.52Å; A199-L315 HydrophobicContact CB-CD1 4.35Å; L202-L315 HydrophobicContact CD1-CB 3.87Å; L202-L315 HydrophobicContact CD1-CD1 4.4Å; F203-L315 HydrophobicContact CE2-CD1 4.44Å; F203-L315 HydrophobicContact CE2-CD2 4.25Å; F203-L315 HydrophobicContact CZ-CD2 4.36Å; F221-L315 HydrophobicContact CD2-CD2 4.43Å; F221-L315 HydrophobicContact CE1-CD2 3.95Å; F221-L315 HydrophobicContact CE1-CG 3.91Å; F221-L315 HydrophobicContact CE2-CD2 3.55Å; F221-L315 HydrophobicContact CE2-CG 4.23Å; F221-L315 HydrophobicContact CZ-CB 4.43Å; F221-L315 HydrophobicContact CZ-CD1 4.48Å; F221-L315 HydrophobicContact CZ-CD2 3.3Å; F221-L315 HydrophobicContact CZ-CG 3.46Å; F221-L315 VanDerWaalsContact CZ-CG 3.46Å; F263-L315 HydrophobicContact CD1-CD2 3.86Å; F263-L315 HydrophobicContact CE1-CD2 3.91Å; V311-L315 WeakPolarHBondContact O-CB 3.39Å; V311-L315 PolarHBondContact O-N 2.85Å; L315-A317 VanDerWaalsContact C-N 3.32Å; L315-A317 PolarHBondContact O-N 2.75Å; L315-G318 PolarHBondContact O-N 3.13Å; L315-V319 VanDerWaalsContact O-CG2 3.26Å; L315-V319 WeakPolarHBondContact O-CG2 3.34Å
316	L	91.7	Very high	92.4	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.016	5%	0.054	C	C	.	.	H	α-helix	trans	-54.2	-45.3	175.2	174.8	66.5	0	0	0	112.6	W113 V225 V228 F229 W257 M260 T312 G318	W113-L316 HydrophobicContact CH2-CD2 3.69Å; W113-L316 HydrophobicContact CZ2-CD2 4.35Å; W113-L316 HydrophobicContact CZ3-CD2 4.06Å; V225-L316 HydrophobicContact CB-CD1 4.14Å; V225-L316 HydrophobicContact CG1-CD1 3.51Å; V225-L316 HydrophobicContact CG2-CD1 3.86Å; V228-L316 HydrophobicContact CG1-CD1 3.95Å; F229-L316 HydrophobicContact CE2-CD1 4.05Å; F229-L316 HydrophobicContact CZ-CD1 3.82Å; F229-L316 HydrophobicContact CZ-CG 4.23Å; W257-L316 HydrophobicContact CH2-CD2 3.41Å; W257-L316 VanDerWaalsContact CH2-CD2 3.41Å; W257-L316 HydrophobicContact CZ2-CD2 3.85Å; W257-L316 HydrophobicContact CZ3-CD2 4.27Å; M260-L316 HydrophobicContact SD-CD1 4.07Å; T312-L316 PolarHBondContact O-N 3.12Å; L316-G318 PolarHBondContact O-N 2.76Å
317	A	91.1	Very high	92.9	Very high	33 Å²	33	7.6 Å²	7.6	27%	0.273	5%	0.05	S	C	.	.	H	α-helix	trans	-70.6	-28.7	-176.3	0	0	0	0	0	113.6	L127 E313 L314 L315 T321	L127-A317 HydrophobicContact CD1-CB 4.41Å; L127-A317 HydrophobicContact CD2-CB 4.3Å; E313-A317 WeakPolarHBondContact O-CB 3.26Å; E313-A317 PolarHBondContact O-N 2.88Å; L314-A317 PolarHBondContact O-N 2.79Å; L315-A317 VanDerWaalsContact C-N 3.32Å; L315-A317 PolarHBondContact O-N 2.75Å; A317-T321 WeakPolarHBondContact O-CG2 3.35Å; A317-T321 PolarHBondContact O-OG1 2.97Å
318	G	89.7	Confident	93.3	Very high	12 Å²	12	7.7 Å²	7.7	12%	0.124	5%	0.051	C	C	.	.	H	α-helix	trans	-79.1	-23.5	-175.9	0	0	0	0	0	115	L314 L315 L316	L314-G318 PolarHBondContact O-N 2.73Å; L315-G318 PolarHBondContact O-N 3.13Å; L316-G318 PolarHBondContact O-N 2.76Å
319	V	89.1	Confident	93.7	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-78.9	-66.8	-171	-168.2	0	0	0	0	113.1	Y191 L195 I198 L315 T321 S323	Y191-V319 HydrophobicContact CD1-CG1 3.52Å; Y191-V319 HydrophobicContact CD2-CG1 4.06Å; Y191-V319 HydrophobicContact CE1-CB 4.48Å; Y191-V319 HydrophobicContact CE1-CG1 3.32Å; Y191-V319 HydrophobicContact CE2-CG1 3.93Å; Y191-V319 HydrophobicContact CG-CG1 3.89Å; Y191-V319 WeakPolarHBondContact O-CG1 3.09Å; L195-V319 HydrophobicContact CB-CG1 3.95Å; L195-V319 HydrophobicContact CB-CG2 4.08Å; L195-V319 HydrophobicContact CD1-CG2 3.89Å; I198-V319 HydrophobicContact CG2-CG2 4.25Å; L315-V319 VanDerWaalsContact O-CG2 3.26Å; L315-V319 WeakPolarHBondContact O-CG2 3.34Å; V319-T321 PolarHBondContact O-N 3.29Å; V319-S323 WeakPolarHBondContact O-CB 3.49Å; V319-S323 PolarHBondContact O-N 3.06Å; V319-S323 PolarHBondContact O-OG 2.94Å
320	D	88	Confident	94	Very high	2 Å²	2	6.8 Å²	6.8	1%	0.011	5%	0.046	C	C	.	.	H	α-helix	trans	-64	-29	-174.4	-76.7	45.2	0	0	0	111.8	Y191 F229 S323 N324 R492 V494	Y191-D320 WeakPolarHBondContact CE2-OD1 3.47Å; Y191-D320 PolarHBondContact OH-OD1 3.47Å; F229-D320 HydrophobicContact CE2-CB 4.36Å; D320-S323 VanDerWaalsContact CA-OG 3.29Å; D320-S323 WeakPolarHBondContact CA-OG 3.32Å; D320-S323 PolarHBondContact O-OG 2.83Å; D320-S323 VanDerWaalsContact O-OG 3.13Å; D320-N324 VanDerWaalsContact O-CB 3.31Å; D320-N324 WeakPolarHBondContact O-CB 3.24Å; D320-N324 PolarHBondContact O-N 2.87Å; D320-N324 VanDerWaalsContact O-N 3.14Å; D320-N324 PolarHBondContact O-ND2 2.97Å; D320-R492 IonicContact OD2-NH2 3.35Å; D320-V494 HydrophobicContact CB-CG2 4.33Å
321	T	93.1	Very high	94.3	Very high	47 Å²	47	7.4 Å²	7.4	29%	0.288	5%	0.048	S	C	.	.	H	α-helix	trans	-71.2	-52.8	-171.9	56.4	0	0	0	0	112.6	A317 V319 T325 V383	A317-T321 WeakPolarHBondContact O-CG2 3.35Å; A317-T321 PolarHBondContact O-OG1 2.97Å; V319-T321 PolarHBondContact O-N 3.29Å; T321-T325 WeakPolarHBondContact O-CB 3.42Å; T321-T325 PolarHBondContact O-N 3.33Å; T321-T325 PolarHBondContact O-OG1 2.84Å; T321-V383 HydrophobicContact CG2-CG1 3.82Å
322	V	95.3	Very high	94.6	Very high	3 Å²	3	7.8 Å²	7.8	2%	0.018	5%	0.05	C	C	.	.	H	α-helix	trans	-69.4	-43.5	179.1	174	0	0	0	0	110.5	F193 N324 T325 L326 A461 E464 L465	F193-V322 HydrophobicContact CE1-CG1 4.2Å; V322-N324 PolarHBondContact O-N 2.85Å; V322-T325 PolarHBondContact O-N 2.86Å; V322-L326 WeakPolarHBondContact O-CB 3.45Å; V322-L326 PolarHBondContact O-N 3.04Å; V322-A461 HydrophobicContact CG2-CB 3.99Å; V322-E464 HydrophobicContact CG1-CG 3.99Å; V322-L465 HydrophobicContact CG1-CD2 3.96Å; V322-L465 HydrophobicContact CG1-CG 4.25Å
323	S	94.8	Very high	94.8	Very high	2 Å²	2	7.8 Å²	7.8	1%	0.014	5%	0.05	C	C	.	.	H	α-helix	trans	-58.9	-51.2	-179.2	56.3	0	0	0	0	112.6	F190 V319 D320 T325 L326 S327	F190-S323 VanDerWaalsContact O-CB 3.25Å; F190-S323 WeakPolarHBondContact O-CB 3.4Å; V319-S323 WeakPolarHBondContact O-CB 3.49Å; V319-S323 PolarHBondContact O-N 3.06Å; V319-S323 PolarHBondContact O-OG 2.94Å; D320-S323 VanDerWaalsContact CA-OG 3.29Å; D320-S323 WeakPolarHBondContact CA-OG 3.32Å; D320-S323 PolarHBondContact O-OG 2.83Å; D320-S323 VanDerWaalsContact O-OG 3.13Å; S323-T325 VanDerWaalsContact C-N 3.34Å; S323-T325 PolarHBondContact O-N 3.46Å; S323-L326 PolarHBondContact O-N 3.44Å; S323-S327 PolarHBondContact O-N 2.65Å; S323-S327 PolarHBondContact O-OG 2.97Å
324	N	95.1	Very high	95.1	Very high	11 Å²	11	8 Å²	8	6%	0.059	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-40.3	177.9	-76.4	-63.4	0	0	0	112.1	D320 V322 S327 W328 P497	D320-N324 VanDerWaalsContact O-CB 3.31Å; D320-N324 WeakPolarHBondContact O-CB 3.24Å; D320-N324 PolarHBondContact O-N 2.87Å; D320-N324 VanDerWaalsContact O-N 3.14Å; D320-N324 PolarHBondContact O-ND2 2.97Å; V322-N324 PolarHBondContact O-N 2.85Å; N324-S327 PolarHBondContact O-N 3.32Å; N324-W328 PolarHBondContact O-N 3.5Å; N324-P497 WeakPolarHBondContact OD1-CD 3.32Å
325	T	97.9	Very high	95.3	Very high	6 Å²	6	12.5 Å²	12.5	4%	0.037	7%	0.068	C	C	.	.	H	α-helix	trans	-64.5	-43.4	179.1	-53.4	0	0	0	0	111	T321 V322 S323 W328 A329 V377 L378 V383 L465	T321-T325 WeakPolarHBondContact O-CB 3.42Å; T321-T325 PolarHBondContact O-N 3.33Å; T321-T325 PolarHBondContact O-OG1 2.84Å; V322-T325 PolarHBondContact O-N 2.86Å; S323-T325 VanDerWaalsContact C-N 3.34Å; S323-T325 PolarHBondContact O-N 3.46Å; T325-W328 PolarHBondContact O-N 3.03Å; T325-A329 WeakPolarHBondContact O-CB 3.29Å; T325-A329 PolarHBondContact O-N 3.05Å; T325-V377 HydrophobicContact CG2-CG1 4.16Å; T325-L378 HydrophobicContact CG2-CD2 3.69Å; T325-L378 HydrophobicContact CG2-CG 3.94Å; T325-V383 VanDerWaalsContact OG1-CG2 3.27Å; T325-V383 WeakPolarHBondContact OG1-CG2 3.45Å; T325-L465 HydrophobicContact CG2-CD1 3.62Å; T325-L465 HydrophobicContact CG2-CD2 3.95Å; T325-L465 HydrophobicContact CG2-CG 4.46Å
326	L	98.3	Very high	95.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.8	-40.3	176.4	-175.7	58.8	0	0	0	111.8	L165 F190 F193 V322 S323 A329 L330 L465 A468 L469	L165-L326 HydrophobicContact CD2-CD2 4.19Å; F190-L326 HydrophobicContact CB-CD2 4.27Å; F190-L326 HydrophobicContact CD1-CD2 3.78Å; F190-L326 HydrophobicContact CD1-CG 4.41Å; F190-L326 HydrophobicContact CD2-CB 4.08Å; F190-L326 HydrophobicContact CD2-CD2 4.01Å; F190-L326 HydrophobicContact CD2-CG 3.79Å; F190-L326 HydrophobicContact CE1-CD2 4.13Å; F190-L326 HydrophobicContact CE2-CD2 4.38Å; F190-L326 HydrophobicContact CE2-CG 3.98Å; F190-L326 HydrophobicContact CG-CB 4.43Å; F190-L326 HydrophobicContact CG-CD2 3.75Å; F190-L326 HydrophobicContact CG-CG 4.07Å; F190-L326 HydrophobicContact CZ-CD2 4.45Å; F190-L326 HydrophobicContact CZ-CG 4.37Å; F193-L326 HydrophobicContact CD1-CD2 4.12Å; F193-L326 HydrophobicContact CE1-CD2 4.14Å; V322-L326 WeakPolarHBondContact O-CB 3.45Å; V322-L326 PolarHBondContact O-N 3.04Å; S323-L326 PolarHBondContact O-N 3.44Å; L326-A329 PolarHBondContact O-N 2.88Å; L326-L330 HydrophobicContact CD1-CD1 4.2Å; L326-L330 HydrophobicContact CD1-CG 4.38Å; L326-L330 HydrophobicContact CG-CD1 4.36Å; L326-L330 PolarHBondContact O-N 2.77Å; L326-L465 HydrophobicContact CB-CD2 3.94Å; L326-A468 HydrophobicContact CD1-CB 4.11Å; L326-A468 HydrophobicContact CD2-CB 3.88Å; L326-L469 HydrophobicContact CD1-CD2 3.66Å; L326-L469 HydrophobicContact CD1-CG 3.82Å
327	S	97.9	Very high	95.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.9	-49.7	174.9	-61.6	0	0	0	0	112	A187 F190 S323 N324 A329 L330 Y331	A187-S327 VanDerWaalsContact CA-OG 3.3Å; A187-S327 WeakPolarHBondContact CA-OG 3.39Å; F190-S327 WeakPolarHBondContact CD2-OG 3.49Å; S323-S327 PolarHBondContact O-N 2.65Å; S323-S327 PolarHBondContact O-OG 2.97Å; N324-S327 PolarHBondContact O-N 3.32Å; S327-A329 VanDerWaalsContact C-N 3.33Å; S327-A329 PolarHBondContact O-N 3.44Å; S327-L330 PolarHBondContact O-N 3.49Å; S327-Y331 VanDerWaalsContact O-CB 3.23Å; S327-Y331 WeakPolarHBondContact O-CB 3.38Å; S327-Y331 PolarHBondContact O-N 2.6Å
328	W	98.3	Very high	96.1	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-66.3	-35.9	178.3	-74.7	118.4	0	0	0	112.4	N324 T325 Y331 E332 V377 Y381 I487 P489 P497	N324-W328 PolarHBondContact O-N 3.5Å; T325-W328 PolarHBondContact O-N 3.03Å; W328-Y331 AromaticContact CE3-CD1 3.73Å; W328-Y331 HydrophobicContact CE3-CD1 3.73Å; W328-Y331 HydrophobicContact CE3-CE1 4.36Å; W328-Y331 HydrophobicContact CE3-CG 4.3Å; W328-Y331 AromaticContact CZ3-CD1 3.78Å; W328-Y331 HydrophobicContact CZ3-CD1 3.78Å; W328-Y331 AromaticContact CZ3-CE1 3.95Å; W328-Y331 HydrophobicContact CZ3-CE1 3.95Å; W328-Y331 HydrophobicContact CZ3-CG 4.44Å; W328-Y331 PolarHBondContact O-N 3.04Å; W328-E332 WeakPolarHBondContact O-CG 3.21Å; W328-E332 PolarHBondContact O-N 2.95Å; W328-V377 HydrophobicContact CB-CG1 3.72Å; W328-Y381 HydrophobicContact CB-CD2 3.73Å; W328-Y381 HydrophobicContact CB-CE2 4.4Å; W328-Y381 HydrophobicContact CB-CG 3.92Å; W328-Y381 AromaticContact CD1-CG 3.88Å; W328-Y381 AromaticContact CD2-CD1 3.44Å; W328-Y381 HydrophobicContact CD2-CD1 3.44Å; W328-Y381 VanDerWaalsContact CD2-CD1 3.44Å; W328-Y381 AromaticContact CD2-CD2 3.96Å; W328-Y381 HydrophobicContact CD2-CD2 3.96Å; W328-Y381 AromaticContact CD2-CE1 3.79Å; W328-Y381 HydrophobicContact CD2-CE1 3.79Å; W328-Y381 HydrophobicContact CD2-CE2 4.28Å; W328-Y381 AromaticContact CD2-CG 3.54Å; W328-Y381 HydrophobicContact CD2-CG 3.54Å; W328-Y381 AromaticContact CE2-CD1 3.54Å; W328-Y381 AromaticContact CE2-CG 3.95Å; W328-Y381 AromaticContact CE3-CD1 3.65Å; W328-Y381 HydrophobicContact CE3-CD1 3.65Å; W328-Y381 HydrophobicContact CE3-CD2 4.08Å; W328-Y381 AromaticContact CE3-CE1 3.44Å; W328-Y381 HydrophobicContact CE3-CE1 3.44Å; W328-Y381 VanDerWaalsContact CE3-CE1 3.44Å; W328-Y381 AromaticContact CE3-CE2 3.91Å; W328-Y381 HydrophobicContact CE3-CE2 3.91Å; W328-Y381 AromaticContact CE3-CG 3.96Å; W328-Y381 HydrophobicContact CE3-CG 3.96Å; W328-Y381 AromaticContact CE3-CZ 3.6Å; W328-Y381 AromaticContact CG-CD1 3.94Å; W328-Y381 HydrophobicContact CG-CD1 3.94Å; W328-Y381 AromaticContact CG-CD2 3.83Å; W328-Y381 HydrophobicContact CG-CD2 3.83Å; W328-Y381 AromaticContact CG-CG 3.51Å; W328-Y381 HydrophobicContact CG-CG 3.51Å; W328-Y381 HydrophobicContact CH2-CD1 4.05Å; W328-Y381 AromaticContact CH2-CE1 3.78Å; W328-Y381 HydrophobicContact CH2-CE1 3.78Å; W328-Y381 AromaticContact CZ2-CD1 3.85Å; W328-Y381 HydrophobicContact CZ2-CD1 3.85Å; W328-Y381 HydrophobicContact CZ2-CE1 4.08Å; W328-Y381 AromaticContact CZ3-CD1 3.95Å; W328-Y381 HydrophobicContact CZ3-CD1 3.95Å; W328-Y381 AromaticContact CZ3-CE1 3.45Å; W328-Y381 HydrophobicContact CZ3-CE1 3.45Å; W328-Y381 VanDerWaalsContact CZ3-CE1 3.45Å; W328-Y381 AromaticContact CZ3-CZ 3.83Å; W328-I487 HydrophobicContact CH2-CG2 4.12Å; W328-P489 HydrophobicContact CH2-CB 4.42Å; W328-P489 HydrophobicContact CZ2-CB 3.99Å; W328-P497 HydrophobicContact CH2-CB 4.36Å; W328-P497 HydrophobicContact CZ2-CB 4.03Å; W328-P497 HydrophobicContact CZ2-CG 3.88Å
329	A	98.6	Very high	96.6	Very high	2 Å²	2	22.2 Å²	22.2	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-49	176.7	0	0	0	0	0	112.2	T325 L326 S327 E332 L333 V377 L469	T325-A329 WeakPolarHBondContact O-CB 3.29Å; T325-A329 PolarHBondContact O-N 3.05Å; L326-A329 PolarHBondContact O-N 2.88Å; S327-A329 VanDerWaalsContact C-N 3.33Å; S327-A329 PolarHBondContact O-N 3.44Å; A329-E332 PolarHBondContact O-N 3.41Å; A329-L333 WeakPolarHBondContact O-CB 3.25Å; A329-L333 WeakPolarHBondContact O-CG 3.41Å; A329-L333 PolarHBondContact O-N 3.44Å; A329-V377 HydrophobicContact CB-CB 4.48Å; A329-V377 HydrophobicContact CB-CG1 4.2Å; A329-V377 HydrophobicContact CB-CG2 3.79Å; A329-L469 HydrophobicContact CB-CD1 4.18Å; A329-L469 HydrophobicContact CB-CD2 3.87Å
330	L	98.6	Very high	97	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-72.4	-31.3	178.5	-67.8	174.1	0	0	0	112.5	F190 L326 S327 L333 S334 L469 I472 V478 L503 F505	F190-L330 HydrophobicContact CE1-CD1 4.35Å; F190-L330 HydrophobicContact CE2-CD1 3.64Å; F190-L330 HydrophobicContact CZ-CD1 3.34Å; L326-L330 HydrophobicContact CD1-CD1 4.2Å; L326-L330 HydrophobicContact CD1-CG 4.38Å; L326-L330 HydrophobicContact CG-CD1 4.36Å; L326-L330 PolarHBondContact O-N 2.77Å; S327-L330 PolarHBondContact O-N 3.49Å; L330-L333 HydrophobicContact CD2-CD1 4.31Å; L330-S334 VanDerWaalsContact O-CB 3.26Å; L330-S334 WeakPolarHBondContact O-CB 3.17Å; L330-S334 PolarHBondContact O-N 2.84Å; L330-S334 PolarHBondContact O-OG 2.67Å; L330-L469 HydrophobicContact CD2-CD2 3.8Å; L330-L469 HydrophobicContact CG-CD2 4.05Å; L330-I472 HydrophobicContact CD1-CD1 3.73Å; L330-I472 HydrophobicContact CD1-CG2 4.18Å; L330-I472 HydrophobicContact CD2-CG2 3.97Å; L330-V478 HydrophobicContact CD2-CG2 4.25Å; L330-L503 HydrophobicContact CB-CD1 3.74Å; L330-F505 HydrophobicContact CD1-CE1 4.48Å
331	Y	98.4	Very high	97.5	Very high	15 Å²	15	25.8 Å²	25.8	6%	0.059	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-51	170.7	177.8	-102.8	0	0	0	111.5	S327 W328 S334 R335 P486 I487 I501	S327-Y331 VanDerWaalsContact O-CB 3.23Å; S327-Y331 WeakPolarHBondContact O-CB 3.38Å; S327-Y331 PolarHBondContact O-N 2.6Å; W328-Y331 AromaticContact CE3-CD1 3.73Å; W328-Y331 HydrophobicContact CE3-CD1 3.73Å; W328-Y331 HydrophobicContact CE3-CE1 4.36Å; W328-Y331 HydrophobicContact CE3-CG 4.3Å; W328-Y331 AromaticContact CZ3-CD1 3.78Å; W328-Y331 HydrophobicContact CZ3-CD1 3.78Å; W328-Y331 AromaticContact CZ3-CE1 3.95Å; W328-Y331 HydrophobicContact CZ3-CE1 3.95Å; W328-Y331 HydrophobicContact CZ3-CG 4.44Å; W328-Y331 PolarHBondContact O-N 3.04Å; Y331-S334 PolarHBondContact O-N 3.17Å; Y331-S334 PolarHBondContact O-OG 2.8Å; Y331-R335 WeakPolarHBondContact O-CG 3.46Å; Y331-R335 PolarHBondContact O-N 2.97Å; Y331-R335 PolarHBondContact OH-NH1 3.33Å; Y331-P486 WeakPolarHBondContact OH-CA 3.26Å; Y331-I487 HydrophobicContact CD2-CD1 4.36Å; Y331-I487 HydrophobicContact CE2-CB 4.24Å; Y331-I487 HydrophobicContact CE2-CD1 3.91Å; Y331-I487 HydrophobicContact CE2-CG1 4.14Å; Y331-I487 PolarHBondContact OH-N 3.32Å; Y331-I501 HydrophobicContact CD2-CG1 4.43Å; Y331-I501 HydrophobicContact CD2-CG2 4.04Å
332	E	98.4	Very high	97.7	Very high	7 Å²	7	25.8 Å²	25.8	3%	0.033	14%	0.139	C	C	.	.	H	α-helix	trans	-66.4	-45.4	178.3	-71.2	-52.1	134.4	0	0	112.1	W328 A329 S334 R335 H336 Y381 F428	W328-E332 WeakPolarHBondContact O-CG 3.21Å; W328-E332 PolarHBondContact O-N 2.95Å; A329-E332 PolarHBondContact O-N 3.41Å; E332-S334 VanDerWaalsContact C-N 3.26Å; E332-S334 PolarHBondContact O-N 2.95Å; E332-R335 PolarHBondContact O-N 3.48Å; E332-H336 PolarHBondContact O-N 3.43Å; E332-H336 VanDerWaalsContact O-N 3.16Å; E332-H336 PolarHBondContact O-ND1 3.21Å; E332-H336 IonicContact OE2-CE1 3.57Å; E332-H336 PolarHBondContact OE2-CE1 3.39Å; E332-H336 IonicContact OE2-ND1 3.63Å; E332-Y381 HydrophobicContact CG-CE2 3.79Å; E332-Y381 PolarHBondContact OE1-OH 3.07Å; E332-F428 HydrophobicContact CB-CB 4.45Å; E332-F428 HydrophobicContact CB-CD1 3.94Å; E332-F428 HydrophobicContact CB-CD2 3.86Å; E332-F428 HydrophobicContact CB-CE1 4.05Å; E332-F428 HydrophobicContact CB-CE2 4.01Å; E332-F428 HydrophobicContact CB-CG 3.82Å; E332-F428 HydrophobicContact CB-CZ 4.08Å; E332-F428 HydrophobicContact CG-CB 4.33Å; E332-F428 HydrophobicContact CG-CD2 3.98Å; E332-F428 HydrophobicContact CG-CE2 4.47Å; E332-F428 HydrophobicContact CG-CG 4.09Å; E332-F428 WeakPolarHBondContact OE2-CB 3.45Å
333	L	98.6	Very high	97.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.1	-34.1	177.9	-72.6	168.4	0	0	0	112.9	A329 L330 R335 H336 V339 Q340 L343 V373 F428 L469 L473	A329-L333 WeakPolarHBondContact O-CB 3.25Å; A329-L333 WeakPolarHBondContact O-CG 3.41Å; A329-L333 PolarHBondContact O-N 3.44Å; L330-L333 HydrophobicContact CD2-CD1 4.31Å; L333-R335 PolarHBondContact O-N 2.99Å; L333-H336 CarbonylContact O-C 3.14Å; L333-H336 PolarHBondContact O-N 3.29Å; L333-V339 HydrophobicContact CD2-CG1 3.96Å; L333-Q340 HydrophobicContact CB-CB 4.46Å; L333-Q340 HydrophobicContact CB-CG 4.35Å; L333-Q340 HydrophobicContact CD2-CB 4.34Å; L333-Q340 PolarHBondContact O-NE2 3.43Å; L333-L343 HydrophobicContact CD1-CD2 4.18Å; L333-L343 HydrophobicContact CD2-CD2 4.16Å; L333-V373 HydrophobicContact CD1-CG1 4.3Å; L333-V373 HydrophobicContact CD2-CG1 4.39Å; L333-V373 HydrophobicContact CD2-CG2 4.42Å; L333-V373 HydrophobicContact CG-CG1 4.44Å; L333-F428 HydrophobicContact CD2-CE1 4.47Å; L333-F428 HydrophobicContact CD2-CZ 4.5Å; L333-L469 HydrophobicContact CD1-CD2 4.12Å; L333-L473 HydrophobicContact CD1-CD1 4.09Å
334	S	98	Very high	97.9	Very high	7 Å²	7	27.5 Å²	27.5	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-29	176.3	77.3	0	0	0	0	112.5	L330 Y331 E332 V478 P480	L330-S334 VanDerWaalsContact O-CB 3.26Å; L330-S334 WeakPolarHBondContact O-CB 3.17Å; L330-S334 PolarHBondContact O-N 2.84Å; L330-S334 PolarHBondContact O-OG 2.67Å; Y331-S334 PolarHBondContact O-N 3.17Å; Y331-S334 PolarHBondContact O-OG 2.8Å; E332-S334 VanDerWaalsContact C-N 3.26Å; E332-S334 PolarHBondContact O-N 2.95Å; S334-V478 WeakPolarHBondContact CA-O 3.37Å; S334-P480 VanDerWaalsContact O-CD 3.29Å; S334-P480 WeakPolarHBondContact O-CD 3.45Å
335	R	97.1	Very high	97.9	Very high	111 Å²	111	30 Å²	30	42%	0.419	16%	0.164	S	C	.	.	H	α-helix	trans	-93.7	-6.1	-177.8	-64.1	177.3	64.2	-158	-7.9	113.5	Y331 E332 L333	Y331-R335 WeakPolarHBondContact O-CG 3.46Å; Y331-R335 PolarHBondContact O-N 2.97Å; Y331-R335 PolarHBondContact OH-NH1 3.33Å; E332-R335 PolarHBondContact O-N 3.48Å; L333-R335 PolarHBondContact O-N 2.99Å
336	H	98.1	Very high	97.8	Very high	41 Å²	41	31.5 Å²	31.5	19%	0.19	17%	0.171	C	C	.	.			trans	-130.6	69.6	-177.6	-61.9	89	0	0	0	109.4	E332 L333 E338 V339 Q340 F428	E332-H336 PolarHBondContact O-N 3.43Å; E332-H336 VanDerWaalsContact O-N 3.16Å; E332-H336 PolarHBondContact O-ND1 3.21Å; E332-H336 IonicContact OE2-CE1 3.57Å; E332-H336 PolarHBondContact OE2-CE1 3.39Å; E332-H336 IonicContact OE2-ND1 3.63Å; L333-H336 CarbonylContact O-C 3.14Å; L333-H336 PolarHBondContact O-N 3.29Å; H336-E338 VanDerWaalsContact C-OE2 3.29Å; H336-E338 WeakPolarHBondContact CB-OE1 3.5Å; H336-E338 IonicContact CD2-OE1 3.85Å; H336-E338 IonicContact CG-OE1 3.83Å; H336-E338 PolarHBondContact O-N 3.38Å; H336-V339 HydrophobicContact CB-CB 4.14Å; H336-V339 HydrophobicContact CB-CG2 4.07Å; H336-V339 PolarHBondContact O-N 3.27Å; H336-V339 VanDerWaalsContact O-N 3.07Å; H336-Q340 PolarHBondContact O-N 3.29Å; H336-F428 HydrophobicContact CB-CD1 4.15Å; H336-F428 HydrophobicContact CB-CE1 4.38Å; H336-F428 AromaticContact CE1-CD1 3.9Å; H336-F428 AromaticContact CG-CD1 3.71Å; H336-F428 AromaticContact ND1-CD1 3.52Å
337	P	97.6	Very high	97.5	Very high	75 Å²	75	31.5 Å²	31.5	49%	0.487	17%	0.171	S	C	.	.	H	α-helix	trans	-59	-29.6	-174.2	24.3	-34.8	0	0	0	113.2	Q340 T341	P337-Q340 PolarHBondContact O-N 3.38Å; P337-T341 VanDerWaalsContact O-CB 3.3Å; P337-T341 WeakPolarHBondContact O-CB 3.4Å; P337-T341 PolarHBondContact O-N 2.92Å; P337-T341 PolarHBondContact O-OG1 3.4Å
338	E	98.1	Very high	97.2	Very high	112 Å²	112	34 Å²	34	52%	0.523	19%	0.186	S	C	.	.	H	α-helix	trans	-63	-45.2	174.5	70.3	-65.9	160.6	0	0	112	H336 T341 A342	H336-E338 VanDerWaalsContact C-OE2 3.29Å; H336-E338 WeakPolarHBondContact CB-OE1 3.5Å; H336-E338 IonicContact CD2-OE1 3.85Å; H336-E338 IonicContact CG-OE1 3.83Å; H336-E338 PolarHBondContact O-N 3.38Å; E338-T341 PolarHBondContact O-N 3.04Å; E338-A342 WeakPolarHBondContact O-CB 3.16Å; E338-A342 PolarHBondContact O-N 3.49Å
339	V	98.4	Very high	96.8	Very high	23 Å²	23	37.7 Å²	37.7	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-42	176.6	179.2	0	0	0	0	110.2	L333 H336 T341 A342 L343 V373 F428 P430	L333-V339 HydrophobicContact CD2-CG1 3.96Å; H336-V339 HydrophobicContact CB-CB 4.14Å; H336-V339 HydrophobicContact CB-CG2 4.07Å; H336-V339 PolarHBondContact O-N 3.27Å; H336-V339 VanDerWaalsContact O-N 3.07Å; V339-T341 VanDerWaalsContact C-N 3.33Å; V339-T341 PolarHBondContact O-N 3.37Å; V339-A342 PolarHBondContact O-N 3.42Å; V339-L343 VanDerWaalsContact O-CB 3.3Å; V339-L343 WeakPolarHBondContact O-CB 3.29Å; V339-L343 PolarHBondContact O-N 3.47Å; V339-V373 HydrophobicContact CG1-CG2 4.14Å; V339-F428 HydrophobicContact CB-CE1 4.39Å; V339-F428 HydrophobicContact CG1-CE1 3.97Å; V339-F428 HydrophobicContact CG1-CZ 4.48Å; V339-F428 HydrophobicContact CG2-CE1 4.48Å; V339-P430 HydrophobicContact CG1-CG 3.96Å
340	Q	98.6	Very high	96.2	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-42.2	178.2	-165	-171.5	138.3	0	0	111.7	L333 H336 P337 L343 H344 L473 V478	L333-Q340 HydrophobicContact CB-CB 4.46Å; L333-Q340 HydrophobicContact CB-CG 4.35Å; L333-Q340 HydrophobicContact CD2-CB 4.34Å; L333-Q340 PolarHBondContact O-NE2 3.43Å; H336-Q340 PolarHBondContact O-N 3.29Å; P337-Q340 PolarHBondContact O-N 3.38Å; Q340-L343 PolarHBondContact O-N 3.04Å; Q340-H344 WeakPolarHBondContact O-CB 3.26Å; Q340-H344 PolarHBondContact O-N 2.87Å; Q340-L473 HydrophobicContact CG-CD2 3.71Å; Q340-V478 PolarHBondContact NE2-O 3.41Å
341	T	98.1	Very high	95.2	Very high	74 Å²	74	40.6 Å²	40.6	45%	0.454	24%	0.237	S	C	.	.	H	α-helix	trans	-65.3	-47.2	177.6	-59.1	0	0	0	0	110.9	P337 E338 V339 L343 H344 S345	P337-T341 VanDerWaalsContact O-CB 3.3Å; P337-T341 WeakPolarHBondContact O-CB 3.4Å; P337-T341 PolarHBondContact O-N 2.92Å; P337-T341 PolarHBondContact O-OG1 3.4Å; E338-T341 PolarHBondContact O-N 3.04Å; V339-T341 VanDerWaalsContact C-N 3.33Å; V339-T341 PolarHBondContact O-N 3.37Å; T341-L343 VanDerWaalsContact C-N 3.31Å; T341-L343 PolarHBondContact O-N 3.23Å; T341-H344 PolarHBondContact O-N 2.94Å; T341-S345 PolarHBondContact O-N 3.43Å; T341-S345 PolarHBondContact O-OG 3.29Å
342	A	97.8	Very high	93.7	Very high	47 Å²	47	41.6 Å²	41.6	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-41.4	176.6	0	0	0	0	0	112.1	E338 V339 S345 E346 L369	E338-A342 WeakPolarHBondContact O-CB 3.16Å; E338-A342 PolarHBondContact O-N 3.49Å; V339-A342 PolarHBondContact O-N 3.42Å; A342-S345 PolarHBondContact O-N 3.16Å; A342-E346 PolarHBondContact O-N 3.4Å; A342-L369 HydrophobicContact CB-CD2 3.74Å
343	L	97.4	Very high	91.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-42.8	177	179.8	57.1	0	0	0	111.8	L333 V339 Q340 T341 S345 E346 I347 L369 L370 V373 L473	L333-L343 HydrophobicContact CD1-CD2 4.18Å; L333-L343 HydrophobicContact CD2-CD2 4.16Å; V339-L343 VanDerWaalsContact O-CB 3.3Å; V339-L343 WeakPolarHBondContact O-CB 3.29Å; V339-L343 PolarHBondContact O-N 3.47Å; Q340-L343 PolarHBondContact O-N 3.04Å; T341-L343 VanDerWaalsContact C-N 3.31Å; T341-L343 PolarHBondContact O-N 3.23Å; L343-S345 VanDerWaalsContact C-N 3.33Å; L343-S345 PolarHBondContact O-N 3.01Å; L343-E346 PolarHBondContact O-N 3.43Å; L343-I347 HydrophobicContact CD1-CD1 3.93Å; L343-I347 HydrophobicContact CD1-CG1 4.2Å; L343-I347 HydrophobicContact CG-CD1 3.79Å; L343-I347 WeakPolarHBondContact O-CD1 3.48Å; L343-I347 VanDerWaalsContact O-CG1 3.26Å; L343-I347 WeakPolarHBondContact O-CG1 3.31Å; L343-I347 PolarHBondContact O-N 3.48Å; L343-L369 HydrophobicContact CB-CD2 4.11Å; L343-L369 HydrophobicContact CB-CG 4.46Å; L343-L369 HydrophobicContact CD1-CG 4.33Å; L343-L370 HydrophobicContact CD1-CB 3.73Å; L343-L370 HydrophobicContact CD1-CD1 4.08Å; L343-L370 HydrophobicContact CD1-CG 4.49Å; L343-L370 HydrophobicContact CD2-CD1 4.33Å; L343-V373 HydrophobicContact CD2-CG2 4.14Å; L343-L473 HydrophobicContact CB-CD1 4.48Å; L343-L473 HydrophobicContact CD2-CD1 3.34Å; L343-L473 HydrophobicContact CG-CD1 3.74Å
344	H	96.1	Very high	89.5	Confident	40 Å²	40	52.4 Å²	52.4	19%	0.185	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-44.1	173.3	172.8	-98.1	0	0	0	111.6	Q340 T341 I347 T348 L473	Q340-H344 WeakPolarHBondContact O-CB 3.26Å; Q340-H344 PolarHBondContact O-N 2.87Å; T341-H344 PolarHBondContact O-N 2.94Å; H344-I347 PolarHBondContact O-N 2.93Å; H344-T348 WeakPolarHBondContact NE2-CG2 3.43Å; H344-T348 WeakPolarHBondContact O-CB 3.21Å; H344-T348 WeakPolarHBondContact O-CG2 3.15Å; H344-T348 PolarHBondContact O-N 2.87Å; H344-T348 PolarHBondContact O-OG1 3.5Å; H344-L473 PolarHBondContact CD2-O 3.19Å
345	S	95.2	Very high	87.5	Confident	64 Å²	64	54.6 Å²	54.6	45%	0.448	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-42.3	174.8	-65.6	0	0	0	0	112.6	T341 A342 L343 T348 A349	T341-S345 PolarHBondContact O-N 3.43Å; T341-S345 PolarHBondContact O-OG 3.29Å; A342-S345 PolarHBondContact O-N 3.16Å; L343-S345 VanDerWaalsContact C-N 3.33Å; L343-S345 PolarHBondContact O-N 3.01Å; S345-T348 WeakPolarHBondContact CA-OG1 3.23Å; S345-T348 PolarHBondContact O-OG1 3.33Å; S345-A349 VanDerWaalsContact O-CB 3.25Å; S345-A349 WeakPolarHBondContact O-CB 3.13Å; S345-A349 PolarHBondContact O-N 3.29Å
346	E	95.3	Very high	85.4	Confident	38 Å²	38	55.1 Å²	55.1	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-45	175.7	-177.1	-177	-112.6	0	0	111.8	A342 L343 A350 L367 P368 L369 L370	A342-E346 PolarHBondContact O-N 3.4Å; L343-E346 PolarHBondContact O-N 3.43Å; E346-A350 PolarHBondContact O-N 2.94Å; E346-L367 HydrophobicContact CG-CB 4.23Å; E346-L367 HydrophobicContact CG-CD1 4.4Å; E346-L367 HydrophobicContact CG-CD2 4.12Å; E346-L367 HydrophobicContact CG-CG 4.47Å; E346-L367 WeakPolarHBondContact OE2-CB 3.48Å; E346-P368 WeakPolarHBondContact OE1-CD 3.48Å; E346-P368 VanDerWaalsContact OE1-CG 3.24Å; E346-P368 WeakPolarHBondContact OE1-CG 3.39Å; E346-L369 WeakPolarHBondContact OE1-CB 3.19Å; E346-L369 PolarHBondContact OE1-N 3.29Å; E346-L369 WeakPolarHBondContact OE2-CA 3.45Å; E346-L369 VanDerWaalsContact OE2-CB 3.31Å; E346-L369 WeakPolarHBondContact OE2-CB 3.32Å; E346-L369 PolarHBondContact OE2-N 3.48Å; E346-L370 PolarHBondContact OE2-N 2.66Å
347	I	93.3	Very high	83.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-66.6	-45.2	-180	-66.2	157.1	0	0	0	111.1	L343 H344 A350 L351 P359 L367 A470 L473 I474	L343-I347 HydrophobicContact CD1-CD1 3.93Å; L343-I347 HydrophobicContact CD1-CG1 4.2Å; L343-I347 HydrophobicContact CG-CD1 3.79Å; L343-I347 WeakPolarHBondContact O-CD1 3.48Å; L343-I347 VanDerWaalsContact O-CG1 3.26Å; L343-I347 WeakPolarHBondContact O-CG1 3.31Å; L343-I347 PolarHBondContact O-N 3.48Å; H344-I347 PolarHBondContact O-N 2.93Å; I347-A350 WeakPolarHBondContact O-CB 3.4Å; I347-A350 PolarHBondContact O-N 3.42Å; I347-L351 PolarHBondContact O-N 2.99Å; I347-P359 HydrophobicContact CG2-CG 4.34Å; I347-L367 HydrophobicContact CG1-CD1 4.08Å; I347-A470 HydrophobicContact CD1-CB 4.27Å; I347-A470 HydrophobicContact CG1-CB 4.42Å; I347-A470 HydrophobicContact CG2-CB 4.15Å; I347-L473 HydrophobicContact CD1-CB 4.16Å; I347-L473 HydrophobicContact CD1-CD1 4.08Å; I347-I474 HydrophobicContact CG2-CD1 3.71Å; I347-I474 HydrophobicContact CG2-CG1 3.64Å
348	T	90.7	Very high	82.1	Confident	51 Å²	51	54 Å²	54	31%	0.313	37%	0.372	S	S	.	.	H	α-helix	trans	-70.9	-35	-178	49.9	0	0	0	0	112.7	H344 S345 A350 L351	H344-T348 WeakPolarHBondContact NE2-CG2 3.43Å; H344-T348 WeakPolarHBondContact O-CB 3.21Å; H344-T348 WeakPolarHBondContact O-CG2 3.15Å; H344-T348 PolarHBondContact O-N 2.87Å; H344-T348 PolarHBondContact O-OG1 3.5Å; S345-T348 WeakPolarHBondContact CA-OG1 3.23Å; S345-T348 PolarHBondContact O-OG1 3.33Å; T348-A350 PolarHBondContact O-N 2.92Å; T348-L351 HydrophobicContact CG2-CD1 4.49Å; T348-L351 WeakPolarHBondContact O-CB 3.47Å; T348-L351 PolarHBondContact O-N 3.19Å; T348-L351 VanDerWaalsContact O-N 3.14Å
349	A	89.7	Confident	80.8	Confident	80 Å²	80	49 Å²	49	66%	0.661	35%	0.349	S	S	*	.	H	α-helix	trans	-59.7	-32.3	171.5	0	0	0	0	0	112.1	S345 L351	S345-A349 VanDerWaalsContact O-CB 3.25Å; S345-A349 WeakPolarHBondContact O-CB 3.13Å; S345-A349 PolarHBondContact O-N 3.29Å; A349-L351 VanDerWaalsContact C-N 3.33Å; A349-L351 PolarHBondContact O-N 2.85Å
350	A	86.7	Confident	79.9	Confident	32 Å²	32	51.4 Å²	51.4	26%	0.264	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-14.1	179.1	0	0	0	0	0	114.5	E346 I347 T348 G352 V363 L367	E346-A350 PolarHBondContact O-N 2.94Å; I347-A350 WeakPolarHBondContact O-CB 3.4Å; I347-A350 PolarHBondContact O-N 3.42Å; T348-A350 PolarHBondContact O-N 2.92Å; A350-G352 VanDerWaalsContact C-N 3.34Å; A350-V363 HydrophobicContact CB-CG1 3.75Å; A350-L367 HydrophobicContact CB-CD1 4.37Å; A350-L367 HydrophobicContact CB-CD2 3.85Å
351	L	78	Confident	78.9	Confident	31 Å²	31	51.5 Å²	51.5	16%	0.162	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.7	176.6	-74	173.2	0	0	0	113.4	I347 T348 A349 S355 A357 P359 I474	I347-L351 PolarHBondContact O-N 2.99Å; T348-L351 HydrophobicContact CG2-CD1 4.49Å; T348-L351 WeakPolarHBondContact O-CB 3.47Å; T348-L351 PolarHBondContact O-N 3.19Å; T348-L351 VanDerWaalsContact O-N 3.14Å; A349-L351 VanDerWaalsContact C-N 3.33Å; A349-L351 PolarHBondContact O-N 2.85Å; L351-S355 VanDerWaalsContact O-CB 3.24Å; L351-S355 WeakPolarHBondContact O-CB 3.38Å; L351-A357 WeakPolarHBondContact CD2-O 3.38Å; L351-P359 HydrophobicContact CD2-CB 4.06Å; L351-P359 VanDerWaalsContact CD2-CD 3.45Å; L351-P359 HydrophobicContact CD2-CG 3.4Å; L351-P359 VanDerWaalsContact CD2-CG 3.4Å; L351-P359 HydrophobicContact CG-CG 4Å; L351-I474 HydrophobicContact CD1-CD1 4.11Å; L351-I474 HydrophobicContact CD1-CG1 4.3Å
352	G	65.7	Low	77.9	Confident	36 Å²	36	52 Å²	52	37%	0.371	37%	0.37	S	S	.	.			trans	75.7	158.6	-168.8	0	0	0	0	0	112.9	A350 G354	A350-G352 VanDerWaalsContact C-N 3.34Å; G352-G354 PolarHBondContact O-N 2.87Å
353	P	56.1	Low	77.3	Confident	145 Å²	145	52 Å²	52	94%	0.942	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	127.9	-178.6	-17.8	29.9	0	0	0	112	S355	P353-S355 PolarHBondContact O-N 3.02Å
354	G	52.8	Low	76.7	Confident	90 Å²	90	52 Å²	52	93%	0.928	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	5.6	171.1	0	0	0	0	0	116.3	G352	G352-G354 PolarHBondContact O-N 2.87Å
355	S	57.7	Low	76.1	Confident	52 Å²	52	52.4 Å²	52.4	36%	0.364	37%	0.373	S	S	.	.			trans	-89.4	119.7	177.1	-172.5	0	0	0	0	111.6	L351 P353 A357	L351-S355 VanDerWaalsContact O-CB 3.24Å; L351-S355 WeakPolarHBondContact O-CB 3.38Å; P353-S355 PolarHBondContact O-N 3.02Å; S355-A357 WeakPolarHBondContact OG-CB 3.34Å; S355-A357 PolarHBondContact OG-N 3.08Å
356	S	52.4	Low	75.7	Confident	123 Å²	123	56.1 Å²	56.1	86%	0.86	38%	0.383	S	S	*	.			trans	-85.8	6.8	163.4	56.6	0	0	0	0	112.4
357	A	60.9	Low	75.6	Confident	52 Å²	52	55 Å²	55	43%	0.43	38%	0.378	S	S	.	.	S	Bend	trans	-77.8	171.1	-178.7	0	0	0	0	0	111.7	L351 S355	L351-A357 WeakPolarHBondContact CD2-O 3.38Å; S355-A357 WeakPolarHBondContact OG-CB 3.34Å; S355-A357 PolarHBondContact OG-N 3.08Å
358	H	66.2	Low	75.8	Confident	39 Å²	39	58.6 Å²	58.6	18%	0.181	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-88.9	136.4	-180	-62.9	-108.1	0	0	0	108.2	D159 R163 Q471	D159-H358 IonicContact OD1-CG 3.59Å; D159-H358 IonicContact OD1-ND1 3.87Å; R163-H358 PolarHBondContact NH1-CD2 2.77Å; R163-H358 VanDerWaalsContact NH1-CD2 3.29Å; R163-H358 PolarHBondContact NH1-NE2 3.37Å; R163-H358 PolarHBondContact NH2-CD2 2.8Å; R163-H358 PolarHBondContact NH2-NE2 3.36Å; H358-Q471 VanDerWaalsContact CE1-CD 3.49Å; H358-Q471 PolarHBondContact CE1-OE1 3.23Å; H358-Q471 PolarHBondContact ND1-NE2 3Å; H358-Q471 PolarHBondContact ND1-OE1 2.98Å
359	P	70.6	Confident	76.1	Confident	7 Å²	7	57.3 Å²	57.3	5%	0.045	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-63	132.7	176.6	-7.3	20.9	0	0	0	107.8	I347 L351 A361 L364 I474	I347-P359 HydrophobicContact CG2-CG 4.34Å; L351-P359 HydrophobicContact CD2-CB 4.06Å; L351-P359 VanDerWaalsContact CD2-CD 3.45Å; L351-P359 HydrophobicContact CD2-CG 3.4Å; L351-P359 VanDerWaalsContact CD2-CG 3.4Å; L351-P359 HydrophobicContact CG-CG 4Å; P359-A361 PolarHBondContact O-N 2.82Å; P359-L364 HydrophobicContact CB-CD2 3.73Å; P359-L364 HydrophobicContact CB-CG 4Å; P359-L364 HydrophobicContact CG-CD2 3.77Å; P359-L364 HydrophobicContact CG-CG 4.41Å; P359-I474 HydrophobicContact CG-CD1 4.14Å
360	P	77.8	Confident	76.5	Confident	74 Å²	74	53.5 Å²	53.5	48%	0.481	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-53.5	141.4	175	-24.5	32.5	0	0	0	110.2	T362 V363 L364	P360-T362 PolarHBondContact O-N 3.01Å; P360-V363 HydrophobicContact CB-CG2 4.16Å; P360-V363 HydrophobicContact CG-CG2 4.15Å; P360-V363 WeakPolarHBondContact O-CA 3.36Å; P360-V363 WeakPolarHBondContact O-CB 3.29Å; P360-V363 PolarHBondContact O-N 3.35Å; P360-L364 PolarHBondContact O-N 3.37Å; P360-L364 VanDerWaalsContact O-N 3.07Å
361	A	78.3	Confident	77	Confident	7 Å²	7	55.4 Å²	55.4	6%	0.058	36%	0.363	C	S	.	.	H	α-helix	trans	-52.9	-33.2	177.8	0	0	0	0	0	113.4	T155 P359 V363 L364 S365 L463 M467	T155-A361 HydrophobicContact CG2-CB 3.35Å; T155-A361 WeakPolarHBondContact OG1-CB 3.25Å; P359-A361 PolarHBondContact O-N 2.82Å; A361-V363 VanDerWaalsContact C-N 3.3Å; A361-V363 PolarHBondContact O-N 2.93Å; A361-L364 PolarHBondContact O-N 3.18Å; A361-S365 VanDerWaalsContact O-CB 3.29Å; A361-S365 WeakPolarHBondContact O-CB 3.44Å; A361-S365 PolarHBondContact O-N 3.05Å; A361-S365 PolarHBondContact O-OG 3.22Å; A361-L463 HydrophobicContact CB-CD1 3.46Å; A361-L463 VanDerWaalsContact CB-CD1 3.46Å; A361-M467 HydrophobicContact CB-SD 4.29Å
362	T	77.9	Confident	77.9	Confident	83 Å²	83	54 Å²	54	51%	0.509	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-40.4	175	49.5	0	0	0	0	111.8	P360 S365 Q366	P360-T362 PolarHBondContact O-N 3.01Å; T362-S365 PolarHBondContact O-OG 2.79Å; T362-Q366 WeakPolarHBondContact O-CG 3.33Å
363	V	84.6	Confident	79.4	Confident	47 Å²	47	52.3 Å²	52.3	29%	0.285	34%	0.339	S	S	.	.	H	α-helix	trans	-70.3	-47	175.9	179.4	0	0	0	0	110.7	A350 P360 A361 S365 Q366 L367	A350-V363 HydrophobicContact CB-CG1 3.75Å; P360-V363 HydrophobicContact CB-CG2 4.16Å; P360-V363 HydrophobicContact CG-CG2 4.15Å; P360-V363 WeakPolarHBondContact O-CA 3.36Å; P360-V363 WeakPolarHBondContact O-CB 3.29Å; P360-V363 PolarHBondContact O-N 3.35Å; A361-V363 VanDerWaalsContact C-N 3.3Å; A361-V363 PolarHBondContact O-N 2.93Å; V363-S365 PolarHBondContact O-N 3.41Å; V363-Q366 WeakPolarHBondContact O-CA 3.26Å; V363-Q366 WeakPolarHBondContact O-CB 3.44Å; V363-Q366 PolarHBondContact O-N 2.91Å; V363-L367 PolarHBondContact O-N 3.31Å
364	L	85.1	Confident	81.4	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-56.1	-40.7	176.3	-66.1	-179.5	0	0	0	111.9	P359 P360 A361 Q366 L367 L370 M467 A470	P359-L364 HydrophobicContact CB-CD2 3.73Å; P359-L364 HydrophobicContact CB-CG 4Å; P359-L364 HydrophobicContact CG-CD2 3.77Å; P359-L364 HydrophobicContact CG-CG 4.41Å; P360-L364 PolarHBondContact O-N 3.37Å; P360-L364 VanDerWaalsContact O-N 3.07Å; A361-L364 PolarHBondContact O-N 3.18Å; L364-Q366 PolarHBondContact O-N 3.23Å; L364-L367 HydrophobicContact CD2-CD1 3.94Å; L364-L367 PolarHBondContact O-N 3.09Å; L364-L370 HydrophobicContact CB-CD2 4.38Å; L364-L370 HydrophobicContact CD2-CD2 4.27Å; L364-M467 HydrophobicContact CD1-CB 4.43Å; L364-M467 HydrophobicContact CD1-CG 3.93Å; L364-A470 HydrophobicContact CD1-CB 3.97Å; L364-A470 HydrophobicContact CD2-CB 3.55Å; L364-A470 HydrophobicContact CG-CB 4.42Å
365	S	82.4	Confident	83.6	Confident	48 Å²	48	46.5 Å²	46.5	34%	0.336	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	3.2	177.4	81.7	0	0	0	0	113.9	A361 T362 V363 K371	A361-S365 VanDerWaalsContact O-CB 3.29Å; A361-S365 WeakPolarHBondContact O-CB 3.44Å; A361-S365 PolarHBondContact O-N 3.05Å; A361-S365 PolarHBondContact O-OG 3.22Å; T362-S365 PolarHBondContact O-OG 2.79Å; V363-S365 PolarHBondContact O-N 3.41Å; S365-K371 WeakPolarHBondContact O-CE 3.43Å; S365-K371 PolarHBondContact O-NZ 2.65Å
366	Q	87.1	Confident	85.5	Confident	141 Å²	141	44 Å²	44	66%	0.659	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-14.3	175.2	-67.3	178.9	12.2	0	0	112.9	T362 V363 L364 P368	T362-Q366 WeakPolarHBondContact O-CG 3.33Å; V363-Q366 WeakPolarHBondContact O-CA 3.26Å; V363-Q366 WeakPolarHBondContact O-CB 3.44Å; V363-Q366 PolarHBondContact O-N 2.91Å; L364-Q366 PolarHBondContact O-N 3.23Å; Q366-P368 WeakPolarHBondContact O-CD 3.34Å
367	L	94.5	Very high	87.7	Confident	16 Å²	16	38.2 Å²	38.2	8%	0.084	22%	0.215	C	C	.	.			trans	-67.4	114.9	-178.2	-60.3	-172.4	0	0	0	111.8	E346 I347 A350 V363 L364 L370 K371	E346-L367 HydrophobicContact CG-CB 4.23Å; E346-L367 HydrophobicContact CG-CD1 4.4Å; E346-L367 HydrophobicContact CG-CD2 4.12Å; E346-L367 HydrophobicContact CG-CG 4.47Å; E346-L367 WeakPolarHBondContact OE2-CB 3.48Å; I347-L367 HydrophobicContact CG1-CD1 4.08Å; A350-L367 HydrophobicContact CB-CD1 4.37Å; A350-L367 HydrophobicContact CB-CD2 3.85Å; V363-L367 PolarHBondContact O-N 3.31Å; L364-L367 HydrophobicContact CD2-CD1 3.94Å; L364-L367 PolarHBondContact O-N 3.09Å; L367-L370 HydrophobicContact CB-CB 3.84Å; L367-L370 HydrophobicContact CB-CD2 4.42Å; L367-L370 HydrophobicContact CD1-CD2 4.25Å; L367-K371 WeakPolarHBondContact O-CG 3.37Å; L367-K371 PolarHBondContact O-N 2.9Å
368	P	96.3	Very high	89.4	Confident	74 Å²	74	36.1 Å²	36.1	48%	0.481	20%	0.197	S	C	.	.	H	α-helix	trans	-69	-43.5	-172.1	24.9	-33.2	0	0	0	113.5	E346 Q366 K371 A372 L434	E346-P368 WeakPolarHBondContact OE1-CD 3.48Å; E346-P368 VanDerWaalsContact OE1-CG 3.24Å; E346-P368 WeakPolarHBondContact OE1-CG 3.39Å; Q366-P368 WeakPolarHBondContact O-CD 3.34Å; P368-K371 PolarHBondContact O-N 2.98Å; P368-A372 VanDerWaalsContact O-CB 3.32Å; P368-A372 WeakPolarHBondContact O-CB 3.35Å; P368-A372 PolarHBondContact O-N 2.93Å; P368-L434 HydrophobicContact CB-CD2 3.94Å
369	L	97.7	Very high	90.9	Very high	24 Å²	24	34.2 Å²	34.2	13%	0.126	19%	0.188	C	C	.	.	H	α-helix	trans	-70	-39.2	179.9	178.9	61.7	0	0	0	111.3	A342 L343 E346 K371 A372 V373 P430 L434	A342-L369 HydrophobicContact CB-CD2 3.74Å; L343-L369 HydrophobicContact CB-CD2 4.11Å; L343-L369 HydrophobicContact CB-CG 4.46Å; L343-L369 HydrophobicContact CD1-CG 4.33Å; E346-L369 WeakPolarHBondContact OE1-CB 3.19Å; E346-L369 PolarHBondContact OE1-N 3.29Å; E346-L369 WeakPolarHBondContact OE2-CA 3.45Å; E346-L369 VanDerWaalsContact OE2-CB 3.31Å; E346-L369 WeakPolarHBondContact OE2-CB 3.32Å; E346-L369 PolarHBondContact OE2-N 3.48Å; L369-K371 VanDerWaalsContact C-N 3.33Å; L369-K371 PolarHBondContact O-N 3.05Å; L369-A372 WeakPolarHBondContact O-CB 3.25Å; L369-A372 PolarHBondContact O-N 3.44Å; L369-A372 VanDerWaalsContact O-N 3.11Å; L369-V373 HydrophobicContact CD1-CG2 4.35Å; L369-V373 WeakPolarHBondContact O-CG2 3.3Å; L369-V373 PolarHBondContact O-N 3.34Å; L369-P430 HydrophobicContact CD1-CB 4.01Å; L369-L434 HydrophobicContact CD1-CD1 4.39Å
370	L	97.6	Very high	92.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.6	-45.9	173	-178.9	57.9	0	0	0	112.1	L343 E346 L364 L367 A372 V373 V374 Q466 L469	L343-L370 HydrophobicContact CD1-CB 3.73Å; L343-L370 HydrophobicContact CD1-CD1 4.08Å; L343-L370 HydrophobicContact CD1-CG 4.49Å; L343-L370 HydrophobicContact CD2-CD1 4.33Å; E346-L370 PolarHBondContact OE2-N 2.66Å; L364-L370 HydrophobicContact CB-CD2 4.38Å; L364-L370 HydrophobicContact CD2-CD2 4.27Å; L367-L370 HydrophobicContact CB-CB 3.84Å; L367-L370 HydrophobicContact CB-CD2 4.42Å; L367-L370 HydrophobicContact CD1-CD2 4.25Å; L370-A372 VanDerWaalsContact C-N 3.35Å; L370-V373 PolarHBondContact O-N 3.05Å; L370-V374 WeakPolarHBondContact O-CG2 3.47Å; L370-V374 PolarHBondContact O-N 3.08Å; L370-V374 VanDerWaalsContact O-N 3.16Å; L370-Q466 HydrophobicContact CD2-CB 3.91Å; L370-Q466 HydrophobicContact CD2-CG 4.04Å; L370-Q466 HydrophobicContact CG-CB 4.43Å; L370-Q466 HydrophobicContact CG-CG 4.1Å; L370-L469 HydrophobicContact CD1-CB 3.97Å; L370-L469 HydrophobicContact CD1-CD1 4.16Å
371	K	96.7	Very high	93.1	Very high	73 Å²	73	31.5 Å²	31.5	32%	0.317	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-40.8	174.6	-73.5	171.2	-179.6	170	0	112.3	S365 L367 P368 L369 V373 V374 K375	S365-K371 WeakPolarHBondContact O-CE 3.43Å; S365-K371 PolarHBondContact O-NZ 2.65Å; L367-K371 WeakPolarHBondContact O-CG 3.37Å; L367-K371 PolarHBondContact O-N 2.9Å; P368-K371 PolarHBondContact O-N 2.98Å; L369-K371 VanDerWaalsContact C-N 3.33Å; L369-K371 PolarHBondContact O-N 3.05Å; K371-V373 VanDerWaalsContact C-N 3.33Å; K371-V374 PolarHBondContact O-N 2.92Å; K371-K375 WeakPolarHBondContact O-CB 3.27Å; K371-K375 WeakPolarHBondContact O-CG 3.2Å; K371-K375 PolarHBondContact O-N 3.09Å
372	A	97.3	Very high	93.9	Very high	2 Å²	2	31.3 Å²	31.3	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-41.3	179.1	0	0	0	0	0	111.4	P368 L369 L370 K375 E376 P430 W433 L434	P368-A372 VanDerWaalsContact O-CB 3.32Å; P368-A372 WeakPolarHBondContact O-CB 3.35Å; P368-A372 PolarHBondContact O-N 2.93Å; L369-A372 WeakPolarHBondContact O-CB 3.25Å; L369-A372 PolarHBondContact O-N 3.44Å; L369-A372 VanDerWaalsContact O-N 3.11Å; L370-A372 VanDerWaalsContact C-N 3.35Å; A372-K375 PolarHBondContact O-N 3.29Å; A372-E376 VanDerWaalsContact O-CB 3.32Å; A372-E376 WeakPolarHBondContact O-CB 3.33Å; A372-E376 PolarHBondContact O-N 2.81Å; A372-P430 HydrophobicContact CB-CB 4.08Å; A372-P430 WeakPolarHBondContact CB-O 3.36Å; A372-W433 HydrophobicContact CB-CB 3.81Å; A372-L434 HydrophobicContact CB-CD2 3.88Å; A372-L434 HydrophobicContact CB-CG 4.32Å
373	V	98.5	Very high	94.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-51	173.9	166.1	0	0	0	0	110.8	L333 V339 L343 L369 L370 K371 K375 E376 V377 F428 P430	L333-V373 HydrophobicContact CD1-CG1 4.3Å; L333-V373 HydrophobicContact CD2-CG1 4.39Å; L333-V373 HydrophobicContact CD2-CG2 4.42Å; L333-V373 HydrophobicContact CG-CG1 4.44Å; V339-V373 HydrophobicContact CG1-CG2 4.14Å; L343-V373 HydrophobicContact CD2-CG2 4.14Å; L369-V373 HydrophobicContact CD1-CG2 4.35Å; L369-V373 WeakPolarHBondContact O-CG2 3.3Å; L369-V373 PolarHBondContact O-N 3.34Å; L370-V373 PolarHBondContact O-N 3.05Å; K371-V373 VanDerWaalsContact C-N 3.33Å; V373-K375 VanDerWaalsContact C-N 3.31Å; V373-K375 PolarHBondContact O-N 3.16Å; V373-E376 PolarHBondContact O-N 2.8Å; V373-V377 HydrophobicContact CG1-CG2 4.35Å; V373-V377 VanDerWaalsContact O-CG2 3.23Å; V373-V377 WeakPolarHBondContact O-CG2 3.24Å; V373-V377 PolarHBondContact O-N 3.12Å; V373-F428 HydrophobicContact CG1-CZ 4.18Å; V373-F428 HydrophobicContact CG2-CZ 4.25Å; V373-P430 HydrophobicContact CG2-CB 3.94Å; V373-P430 HydrophobicContact CG2-CG 3.75Å
374	V	98.1	Very high	95.1	Very high	8 Å²	8	28.6 Å²	28.6	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-42.2	178.5	174.7	0	0	0	0	111.4	L370 K371 L378 L465 L469	L370-V374 WeakPolarHBondContact O-CG2 3.47Å; L370-V374 PolarHBondContact O-N 3.08Å; L370-V374 VanDerWaalsContact O-N 3.16Å; K371-V374 PolarHBondContact O-N 2.92Å; V374-L378 HydrophobicContact CG1-CD1 3.98Å; V374-L378 WeakPolarHBondContact O-CB 3.42Å; V374-L378 WeakPolarHBondContact O-CG 3.31Å; V374-L378 PolarHBondContact O-N 3.41Å; V374-L465 HydrophobicContact CG1-CD1 4.14Å; V374-L465 HydrophobicContact CG2-CB 4.44Å; V374-L469 HydrophobicContact CG2-CD1 3.82Å
375	K	97.3	Very high	95.4	Very high	105 Å²	105	28.9 Å²	28.9	46%	0.457	15%	0.151	S	C	.	.	H	α-helix	trans	-63.1	-43.4	176	-77.6	-178.8	174.7	-176.3	0	112.6	K371 A372 V373 L378 R379 W433	K371-K375 WeakPolarHBondContact O-CB 3.27Å; K371-K375 WeakPolarHBondContact O-CG 3.2Å; K371-K375 PolarHBondContact O-N 3.09Å; A372-K375 PolarHBondContact O-N 3.29Å; V373-K375 VanDerWaalsContact C-N 3.31Å; V373-K375 PolarHBondContact O-N 3.16Å; K375-L378 PolarHBondContact O-N 2.92Å; K375-R379 PolarHBondContact O-N 2.87Å; K375-W433 HydrophobicContact CB-CD2 4.02Å; K375-W433 HydrophobicContact CB-CG 4.07Å; K375-W433 HydrophobicContact CB-CZ2 4.46Å; K375-W433 HydrophobicContact CD-CB 4.38Å; K375-W433 HydrophobicContact CD-CD2 4.09Å; K375-W433 HydrophobicContact CD-CE3 4.12Å; K375-W433 HydrophobicContact CD-CG 4.23Å
376	E	97.9	Very high	95.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.5	-40.2	-177.9	-173.8	66.3	169.2	0	0	112	A372 V373 L378 R379 L380 F428 H429 P430 R432 W433	A372-E376 VanDerWaalsContact O-CB 3.32Å; A372-E376 WeakPolarHBondContact O-CB 3.33Å; A372-E376 PolarHBondContact O-N 2.81Å; V373-E376 PolarHBondContact O-N 2.8Å; E376-L378 VanDerWaalsContact C-N 3.35Å; E376-L378 PolarHBondContact O-N 3.3Å; E376-R379 WeakPolarHBondContact O-CB 3.49Å; E376-R379 PolarHBondContact O-N 3.45Å; E376-R379 IonicContact OE1-CZ 2.84Å; E376-R379 IonicContact OE1-NE 3.18Å; E376-R379 PolarHBondContact OE1-NE 3.17Å; E376-R379 IonicContact OE1-NH2 3.69Å; E376-R379 PolarHBondContact OE1-NH2 3.22Å; E376-R379 IonicContact OE2-CZ 2.75Å; E376-R379 IonicContact OE2-NE 4Å; E376-R379 PolarHBondContact OE2-NE 3.45Å; E376-R379 IonicContact OE2-NH2 3.88Å; E376-L380 PolarHBondContact O-N 3.29Å; E376-F428 HydrophobicContact CB-CD2 4.28Å; E376-F428 HydrophobicContact CB-CE2 4.03Å; E376-F428 HydrophobicContact CG-CD2 3.58Å; E376-F428 HydrophobicContact CG-CE2 3.85Å; E376-F428 HydrophobicContact CG-CG 4.49Å; E376-H429 PolarHBondContact OE1-N 3.28Å; E376-P430 HydrophobicContact CB-CB 4.47Å; E376-P430 HydrophobicContact CB-CG 4.29Å; E376-P430 HydrophobicContact CG-CG 4.36Å; E376-R432 IonicContact OE1-CZ 2.72Å; E376-R432 IonicContact OE1-NE 3.49Å; E376-R432 PolarHBondContact OE1-NE 2.97Å; E376-R432 IonicContact OE1-NH2 3.62Å; E376-R432 VanDerWaalsContact OE2-CD 3.24Å; E376-R432 WeakPolarHBondContact OE2-CD 3.49Å; E376-R432 IonicContact OE2-NE 3.4Å; E376-R432 PolarHBondContact OE2-NE 3.4Å; E376-W433 PolarHBondContact OE2-NE1 3.24Å
377	V	98.3	Very high	95.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.7	-46	172.8	173.8	0	0	0	0	110.4	T325 W328 A329 V373 R379 L380 Y381 F428	T325-V377 HydrophobicContact CG2-CG1 4.16Å; W328-V377 HydrophobicContact CB-CG1 3.72Å; A329-V377 HydrophobicContact CB-CB 4.48Å; A329-V377 HydrophobicContact CB-CG1 4.2Å; A329-V377 HydrophobicContact CB-CG2 3.79Å; V373-V377 HydrophobicContact CG1-CG2 4.35Å; V373-V377 VanDerWaalsContact O-CG2 3.23Å; V373-V377 WeakPolarHBondContact O-CG2 3.24Å; V373-V377 PolarHBondContact O-N 3.12Å; V377-R379 VanDerWaalsContact C-N 3.29Å; V377-R379 PolarHBondContact O-N 2.95Å; V377-L380 PolarHBondContact O-N 3.28Å; V377-Y381 HydrophobicContact CG1-CD2 4.38Å; V377-Y381 WeakPolarHBondContact O-CA 3.49Å; V377-Y381 WeakPolarHBondContact O-CB 3.44Å; V377-Y381 PolarHBondContact O-N 3.16Å; V377-F428 HydrophobicContact CG2-CE2 3.84Å
378	L	97.8	Very high	95.9	Very high	8 Å²	8	21.7 Å²	21.7	4%	0.042	12%	0.12	C	C	.	.	H	α-helix	trans	-69.1	-24.2	178.3	-75.8	172.8	0	0	0	113.6	T325 V374 K375 E376 P382 V383 P447 F448	T325-L378 HydrophobicContact CG2-CD2 3.69Å; T325-L378 HydrophobicContact CG2-CG 3.94Å; V374-L378 HydrophobicContact CG1-CD1 3.98Å; V374-L378 WeakPolarHBondContact O-CB 3.42Å; V374-L378 WeakPolarHBondContact O-CG 3.31Å; V374-L378 PolarHBondContact O-N 3.41Å; K375-L378 PolarHBondContact O-N 2.92Å; E376-L378 VanDerWaalsContact C-N 3.35Å; E376-L378 PolarHBondContact O-N 3.3Å; L378-P382 VanDerWaalsContact O-CA 3.27Å; L378-P382 WeakPolarHBondContact O-CA 3.36Å; L378-P382 WeakPolarHBondContact O-CB 3.35Å; L378-V383 HydrophobicContact CD2-CG2 4.44Å; L378-P447 HydrophobicContact CB-CB 3.67Å; L378-P447 HydrophobicContact CB-CG 3.88Å; L378-P447 HydrophobicContact CD1-CB 4.19Å; L378-P447 HydrophobicContact CD1-CG 4.17Å; L378-P447 HydrophobicContact CD2-CB 4.19Å; L378-P447 HydrophobicContact CG-CB 4.25Å; L378-F448 HydrophobicContact CD1-CE2 3.56Å; L378-F448 HydrophobicContact CD1-CZ 3.75Å
379	R	97.6	Very high	95.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-70.4	-49.9	170.8	-176.1	-166.7	64	78.4	-3.1	110.6	K375 E376 V377 S416 F422 P425 S427 W433	K375-R379 PolarHBondContact O-N 2.87Å; E376-R379 WeakPolarHBondContact O-CB 3.49Å; E376-R379 PolarHBondContact O-N 3.45Å; E376-R379 IonicContact OE1-CZ 2.84Å; E376-R379 IonicContact OE1-NE 3.18Å; E376-R379 PolarHBondContact OE1-NE 3.17Å; E376-R379 IonicContact OE1-NH2 3.69Å; E376-R379 PolarHBondContact OE1-NH2 3.22Å; E376-R379 IonicContact OE2-CZ 2.75Å; E376-R379 IonicContact OE2-NE 4Å; E376-R379 PolarHBondContact OE2-NE 3.45Å; E376-R379 IonicContact OE2-NH2 3.88Å; V377-R379 VanDerWaalsContact C-N 3.29Å; V377-R379 PolarHBondContact O-N 2.95Å; R379-S416 PolarHBondContact NH1-O 3.27Å; R379-S416 WeakPolarHBondContact O-CB 3.25Å; R379-S416 PolarHBondContact O-OG 3Å; R379-F422 VanDerWaalsContact CD-CD1 3.48Å; R379-F422 VanDerWaalsContact CD-CE1 3.44Å; R379-F422 HydrophobicContact CG-CE1 4.45Å; R379-F422 HydrophobicContact CG-CE2 4.44Å; R379-F422 HydrophobicContact CG-CZ 4.29Å; R379-P425 PolarHBondContact NH1-O 2.75Å; R379-P425 PolarHBondContact NH2-O 3.1Å; R379-S427 PolarHBondContact NH2-O 2.91Å; R379-S427 VanDerWaalsContact NH2-O 3.1Å; R379-W433 HydrophobicContact CB-CZ2 4.12Å; R379-W433 HydrophobicContact CG-CZ2 4.36Å
380	L	97.4	Very high	95.7	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-70.5	-42.9	-179.5	-74.3	174.7	0	0	0	112.1	E376 V377 P382 R417 P425 F428	E376-L380 PolarHBondContact O-N 3.29Å; V377-L380 PolarHBondContact O-N 3.28Å; L380-P382 VanDerWaalsContact O-CD 3.31Å; L380-P382 WeakPolarHBondContact O-CD 3.39Å; L380-R417 VanDerWaalsContact O-CZ 3.25Å; L380-R417 PolarHBondContact O-NH1 3.04Å; L380-R417 PolarHBondContact O-NH2 3.22Å; L380-P425 WeakPolarHBondContact CD2-O 3.28Å; L380-F428 HydrophobicContact CD1-CB 3.91Å; L380-F428 HydrophobicContact CD1-CD2 4.06Å
381	Y	96.9	Very high	95.6	Very high	23 Å²	23	19.3 Å²	19.3	9%	0.09	10%	0.104	C	C	.	.	S	Bend	trans	-124	63.3	-173.2	-50.8	-77.7	0	0	0	111	W328 E332 V377 V383 P489	W328-Y381 HydrophobicContact CB-CD2 3.73Å; W328-Y381 HydrophobicContact CB-CE2 4.4Å; W328-Y381 HydrophobicContact CB-CG 3.92Å; W328-Y381 AromaticContact CD1-CG 3.88Å; W328-Y381 AromaticContact CD2-CD1 3.44Å; W328-Y381 HydrophobicContact CD2-CD1 3.44Å; W328-Y381 VanDerWaalsContact CD2-CD1 3.44Å; W328-Y381 AromaticContact CD2-CD2 3.96Å; W328-Y381 HydrophobicContact CD2-CD2 3.96Å; W328-Y381 AromaticContact CD2-CE1 3.79Å; W328-Y381 HydrophobicContact CD2-CE1 3.79Å; W328-Y381 HydrophobicContact CD2-CE2 4.28Å; W328-Y381 AromaticContact CD2-CG 3.54Å; W328-Y381 HydrophobicContact CD2-CG 3.54Å; W328-Y381 AromaticContact CE2-CD1 3.54Å; W328-Y381 AromaticContact CE2-CG 3.95Å; W328-Y381 AromaticContact CE3-CD1 3.65Å; W328-Y381 HydrophobicContact CE3-CD1 3.65Å; W328-Y381 HydrophobicContact CE3-CD2 4.08Å; W328-Y381 AromaticContact CE3-CE1 3.44Å; W328-Y381 HydrophobicContact CE3-CE1 3.44Å; W328-Y381 VanDerWaalsContact CE3-CE1 3.44Å; W328-Y381 AromaticContact CE3-CE2 3.91Å; W328-Y381 HydrophobicContact CE3-CE2 3.91Å; W328-Y381 AromaticContact CE3-CG 3.96Å; W328-Y381 HydrophobicContact CE3-CG 3.96Å; W328-Y381 AromaticContact CE3-CZ 3.6Å; W328-Y381 AromaticContact CG-CD1 3.94Å; W328-Y381 HydrophobicContact CG-CD1 3.94Å; W328-Y381 AromaticContact CG-CD2 3.83Å; W328-Y381 HydrophobicContact CG-CD2 3.83Å; W328-Y381 AromaticContact CG-CG 3.51Å; W328-Y381 HydrophobicContact CG-CG 3.51Å; W328-Y381 HydrophobicContact CH2-CD1 4.05Å; W328-Y381 AromaticContact CH2-CE1 3.78Å; W328-Y381 HydrophobicContact CH2-CE1 3.78Å; W328-Y381 AromaticContact CZ2-CD1 3.85Å; W328-Y381 HydrophobicContact CZ2-CD1 3.85Å; W328-Y381 HydrophobicContact CZ2-CE1 4.08Å; W328-Y381 AromaticContact CZ3-CD1 3.95Å; W328-Y381 HydrophobicContact CZ3-CD1 3.95Å; W328-Y381 AromaticContact CZ3-CE1 3.45Å; W328-Y381 HydrophobicContact CZ3-CE1 3.45Å; W328-Y381 VanDerWaalsContact CZ3-CE1 3.45Å; W328-Y381 AromaticContact CZ3-CZ 3.83Å; E332-Y381 HydrophobicContact CG-CE2 3.79Å; E332-Y381 PolarHBondContact OE1-OH 3.07Å; V377-Y381 HydrophobicContact CG1-CD2 4.38Å; V377-Y381 WeakPolarHBondContact O-CA 3.49Å; V377-Y381 WeakPolarHBondContact O-CB 3.44Å; V377-Y381 PolarHBondContact O-N 3.16Å; Y381-V383 PolarHBondContact O-N 3.22Å; Y381-P489 HydrophobicContact CD1-CB 4.46Å
382	P	95.6	Very high	95.5	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.013	11%	0.107	C	C	.	.			trans	-64.4	121.8	178.6	27.4	-33.8	0	0	0	109.3	L378 L380 V384 Y413 L495	L378-P382 VanDerWaalsContact O-CA 3.27Å; L378-P382 WeakPolarHBondContact O-CA 3.36Å; L378-P382 WeakPolarHBondContact O-CB 3.35Å; L380-P382 VanDerWaalsContact O-CD 3.31Å; L380-P382 WeakPolarHBondContact O-CD 3.39Å; P382-V384 PolarHBondContact O-N 3.16Å; P382-V384 VanDerWaalsContact O-N 3.13Å; P382-Y413 HydrophobicContact CG-CD2 3.95Å; P382-L495 WeakPolarHBondContact O-CB 3.4Å
383	V	93.8	Very high	95.4	Very high	11 Å²	11	24.1 Å²	24.1	7%	0.067	13%	0.128	C	C	.	.	S	Bend	trans	-54.1	-37.5	179.9	-179.6	0	0	0	0	111.4	T321 T325 L378 Y381 P385 V494 L495	T321-V383 HydrophobicContact CG2-CG1 3.82Å; T325-V383 VanDerWaalsContact OG1-CG2 3.27Å; T325-V383 WeakPolarHBondContact OG1-CG2 3.45Å; L378-V383 HydrophobicContact CD2-CG2 4.44Å; Y381-V383 PolarHBondContact O-N 3.22Å; V383-P385 WeakPolarHBondContact O-CD 3.34Å; V383-V494 HydrophobicContact CG1-CB 3.88Å; V383-V494 HydrophobicContact CG1-CG1 3.79Å; V383-V494 CarbonylContact O-C 3.46Å; V383-V494 WeakPolarHBondContact O-CA 3.35Å; V383-V494 WeakPolarHBondContact O-CB 3.38Å; V383-L495 PolarHBondContact O-N 3.28Å
384	V	92.4	Very high	95.3	Very high	62 Å²	62	28.7 Å²	28.7	38%	0.376	15%	0.153	S	C	.	.	S	Bend	trans	-110.7	100	172.4	179.1	0	0	0	0	108.1	P382 G386	P382-V384 PolarHBondContact O-N 3.16Å; P382-V384 VanDerWaalsContact O-N 3.13Å; V384-G386 WeakPolarHBondContact CG1-O 3.32Å; V384-G386 PolarHBondContact O-N 3.01Å
385	P	91.4	Very high	95.2	Very high	8 Å²	8	28.6 Å²	28.6	5%	0.052	15%	0.151	C	C	.	.	S	Bend	trans	-62.5	-22.6	-175.7	-28	37.3	0	0	0	114.6	H62 Q65 V383 H412 Y413 L495	H62-P385 HydrophobicContact CB-CB 3.8Å; H62-P385 HydrophobicContact CB-CG 4.08Å; Q65-P385 PolarHBondContact NE2-O 2.95Å; Q65-P385 PolarHBondContact OE1-O 3.46Å; Q65-P385 VanDerWaalsContact OE1-O 3.08Å; V383-P385 WeakPolarHBondContact O-CD 3.34Å; P385-H412 PolarHBondContact O-N 3.34Å; P385-Y413 PolarHBondContact O-N 3.42Å; P385-L495 HydrophobicContact CG-CB 3.95Å; P385-L495 HydrophobicContact CG-CD1 3.87Å; P385-L495 HydrophobicContact CG-CG 4.39Å
386	G	90.4	Very high	95.1	Very high	20 Å²	20	26.8 Å²	26.8	21%	0.206	14%	0.144	C	C	.	.			trans	-152.1	137.7	174.4	0	0	0	0	0	111	V384 L410	V384-G386 WeakPolarHBondContact CG1-O 3.32Å; V384-G386 PolarHBondContact O-N 3.01Å; G386-L410 CarbonylContact C-O 3.53Å; G386-L410 WeakPolarHBondContact CA-O 3.44Å
387	N	90.8	Very high	94.9	Very high	13 Å²	13	26.8 Å²	26.8	7%	0.07	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.6	177.6	-161.1	-46.2	0	0	0	109.1	R389 T409 L410 H412	N387-R389 PolarHBondContact OD1-NH1 3.02Å; N387-T409 CarbonylContact O-C 3.45Å; N387-L410 PolarHBondContact N-O 3.43Å; N387-L410 VanDerWaalsContact N-O 3.13Å; N387-L410 WeakPolarHBondContact O-CB 3.46Å; N387-L410 WeakPolarHBondContact O-CG 3.41Å; N387-L410 PolarHBondContact O-N 3.09Å; N387-H412 WeakPolarHBondContact CB-NE2 3.45Å
388	S	93.4	Very high	94.6	Very high	21 Å²	21	28.4 Å²	28.4	15%	0.147	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	151.2	-175.9	-53.8	0	0	0	0	112.6	R107 V408	R107-S388 WeakPolarHBondContact CG-O 3.47Å; S388-V408 CarbonylContact C-O 3.31Å; S388-V408 WeakPolarHBondContact CA-O 3.5Å; S388-V408 WeakPolarHBondContact CB-O 3.14Å
389	R	95.5	Very high	94.4	Very high	8 Å²	8	33.2 Å²	33.2	3%	0.03	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.3	168.3	-71.1	-61.4	-178.3	-82.6	-3.5	111.1	L97 L98 E101 E106 N387 V408 F450	L97-R389 HydrophobicContact CD2-CB 4.19Å; L97-R389 HydrophobicContact CD2-CG 4.05Å; L98-R389 HydrophobicContact CD2-CG 4.43Å; E101-R389 IonicContact OE1-CZ 3.68Å; E101-R389 IonicContact OE1-NE 2.82Å; E101-R389 PolarHBondContact OE1-NE 2.97Å; E101-R389 IonicContact OE1-NH2 3.69Å; E101-R389 PolarHBondContact OE1-NH2 3.24Å; E106-R389 WeakPolarHBondContact O-CA 3.46Å; E106-R389 WeakPolarHBondContact O-CD 3.43Å; N387-R389 PolarHBondContact OD1-NH1 3.02Å; R389-V408 PolarHBondContact N-O 2.99Å; R389-V408 PolarHBondContact O-N 3.21Å; R389-F450 PolarHBondContact NH2-O 3.38Å
390	V	95.5	Very high	94.3	Very high	29 Å²	29	34.7 Å²	34.7	18%	0.176	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-117.9	104.8	167.7	-177.3	0	0	0	0	106.5	E106 L407	E106-V390 HydrophobicContact CB-CB 4.16Å; E106-V390 PolarHBondContact O-N 2.93Å; V390-L407 HydrophobicContact CG2-CD1 4Å
391	P	94.7	Very high	94.2	Very high	11 Å²	11	37.3 Å²	37.3	7%	0.071	21%	0.206	C	C	.	.			trans	-63.2	137.4	-178.9	-23.2	35.4	0	0	0	111.8	K393 I395 N405 T406 V408	P391-K393 VanDerWaalsContact C-N 3.29Å; P391-K393 VanDerWaalsContact CB-O 3.23Å; P391-K393 WeakPolarHBondContact CB-O 3.47Å; P391-I395 HydrophobicContact CB-CD1 4.05Å; P391-I395 HydrophobicContact CB-CG1 4.11Å; P391-I395 HydrophobicContact CB-CG2 3.97Å; P391-I395 HydrophobicContact CG-CD1 3.45Å; P391-I395 VanDerWaalsContact CG-CD1 3.45Å; P391-I395 HydrophobicContact CG-CG1 3.88Å; P391-N405 PolarHBondContact O-N 3.46Å; P391-T406 WeakPolarHBondContact CD-O 3.27Å; P391-V408 HydrophobicContact CG-CG2 4.28Å
392	D	94.1	Very high	94.1	Very high	70 Å²	70	36.2 Å²	36.2	37%	0.374	20%	0.202	S	C	.	.	S	Bend	trans	-85	-4.5	178.5	63.3	-18.4	0	0	0	113.6	K404	D392-K404 WeakPolarHBondContact O-CD 3.31Å; D392-K404 WeakPolarHBondContact O-CE 3.39Å; D392-K404 PolarHBondContact O-NZ 3.46Å
393	K	95.6	Very high	94.1	Very high	107 Å²	107	38.3 Å²	38.3	47%	0.465	22%	0.215	S	C	.	.	S	Bend	trans	-148.9	169.5	176	61.8	-178.7	178.2	-178.3	0	109.3	Q100 P391 I395	Q100-K393 VanDerWaalsContact O-CE 3.29Å; Q100-K393 WeakPolarHBondContact O-CE 3.3Å; P391-K393 VanDerWaalsContact C-N 3.29Å; P391-K393 VanDerWaalsContact CB-O 3.23Å; P391-K393 WeakPolarHBondContact CB-O 3.47Å; K393-I395 HydrophobicContact CG-CG2 4.23Å
394	D	96.2	Very high	94.2	Very high	96 Å²	96	42.8 Å²	42.8	51%	0.513	23%	0.234	S	C	.	.			trans	-63.6	135	169.4	-64	0	0	0	0	109.3	I401 I402 P403 K404	D394-I401 HydrophobicContact CB-CG2 4.31Å; D394-I402 WeakPolarHBondContact CA-O 3.44Å; D394-P403 WeakPolarHBondContact OD1-CA 3.23Å; D394-K404 PolarHBondContact OD1-N 3.35Å
395	I	96.3	Very high	94.2	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156	-179.1	62.3	166.5	0	0	0	110.8	L97 Q100 P391 K393 V397 I402	L97-I395 HydrophobicContact CB-CD1 4.48Å; L97-I395 HydrophobicContact CD1-CD1 3.86Å; L97-I395 HydrophobicContact CG-CD1 3.69Å; Q100-I395 HydrophobicContact CB-CB 4.44Å; Q100-I395 HydrophobicContact CB-CG2 3.95Å; P391-I395 HydrophobicContact CB-CD1 4.05Å; P391-I395 HydrophobicContact CB-CG1 4.11Å; P391-I395 HydrophobicContact CB-CG2 3.97Å; P391-I395 HydrophobicContact CG-CD1 3.45Å; P391-I395 VanDerWaalsContact CG-CD1 3.45Å; P391-I395 HydrophobicContact CG-CG1 3.88Å; K393-I395 HydrophobicContact CG-CG2 4.23Å; I395-V397 HydrophobicContact CD1-CG2 4.12Å; I395-V397 HydrophobicContact CG1-CG2 4.48Å; I395-I402 HydrophobicContact CD1-CB 4.45Å; I395-I402 HydrophobicContact CD1-CD1 4.49Å; I395-I402 HydrophobicContact CG1-CB 3.84Å; I395-I402 HydrophobicContact CG1-CG2 4.41Å; I395-I402 PolarHBondContact N-O 3.2Å; I395-I402 PolarHBondContact O-N 2.91Å
396	H	94.8	Very high	94.3	Very high	67 Å²	67	45.7 Å²	45.7	31%	0.31	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.6	176.1	-54.8	166.4	0	0	0	110.2	R34 Q100	R34-H396 PolarHBondContact NH1-CE1 3.25Å; R34-H396 PolarHBondContact NH1-ND1 3.36Å; Q100-H396 PolarHBondContact NE2-O 2.82Å
397	V	94.9	Very high	94.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	100.3	174	-177.5	0	0	0	0	108.3	V75 V88 L93 E96 L97 I395 D399 Y400 I402	V75-V397 HydrophobicContact CG2-CG1 4.22Å; V88-V397 HydrophobicContact CG1-CG1 4.29Å; V88-V397 HydrophobicContact CG2-CG1 4.18Å; L93-V397 HydrophobicContact CB-CG1 3.88Å; L93-V397 HydrophobicContact CD1-CG1 4.3Å; L93-V397 HydrophobicContact CD2-CG1 4.39Å; L93-V397 HydrophobicContact CG-CG1 4.42Å; E96-V397 WeakPolarHBondContact OE2-CA 3.42Å; L97-V397 HydrophobicContact CB-CG2 4.1Å; L97-V397 HydrophobicContact CD1-CG2 4.15Å; L97-V397 HydrophobicContact CG-CG2 4.49Å; I395-V397 HydrophobicContact CD1-CG2 4.12Å; I395-V397 HydrophobicContact CG1-CG2 4.48Å; V397-D399 PolarHBondContact O-N 3.19Å; V397-Y400 PolarHBondContact N-O 2.86Å; V397-Y400 PolarHBondContact O-N 2.98Å; V397-I402 HydrophobicContact CB-CD1 3.85Å; V397-I402 HydrophobicContact CB-CG1 4.37Å; V397-I402 HydrophobicContact CG2-CD1 3.42Å; V397-I402 VanDerWaalsContact CG2-CD1 3.42Å; V397-I402 HydrophobicContact CG2-CG1 4.14Å
398	G	92.8	Very high	94.8	Very high	33 Å²	33	45.2 Å²	45.2	34%	0.34	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-126.7	-169.7	0	0	0	0	0	110.9	E96 Y400	E96-G398 PolarHBondContact OE2-N 3.05Å; G398-Y400 VanDerWaalsContact C-N 3.25Å; G398-Y400 PolarHBondContact O-N 3.06Å
399	D	92.2	Very high	94.9	Very high	110 Å²	110	45.1 Å²	45.1	59%	0.588	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	2.1	-177.7	-58.3	-35.5	0	0	0	114	R35 V397	R35-D399 PolarHBondContact N-O 3.18Å; V397-D399 PolarHBondContact O-N 3.19Å
400	Y	95.4	Very high	94.9	Very high	30 Å²	30	44.8 Å²	44.8	12%	0.118	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141	-172.1	-55.7	-78	0	0	0	112.9	R35 D39 I40 V75 V397 G398	R35-Y400 HydrophobicContact CB-CD1 3.57Å; R35-Y400 HydrophobicContact CB-CE1 3.76Å; R35-Y400 WeakPolarHBondContact O-CA 3.46Å; D39-Y400 HydrophobicContact CB-CE1 4.38Å; I40-Y400 HydrophobicContact CB-CE1 4.42Å; I40-Y400 HydrophobicContact CD1-CD1 4.32Å; I40-Y400 HydrophobicContact CD1-CG 4.23Å; I40-Y400 HydrophobicContact CG1-CD1 3.45Å; I40-Y400 VanDerWaalsContact CG1-CD1 3.45Å; I40-Y400 HydrophobicContact CG1-CD2 4.37Å; I40-Y400 HydrophobicContact CG1-CE1 3.76Å; I40-Y400 HydrophobicContact CG1-CG 3.79Å; V75-Y400 HydrophobicContact CB-CD2 4.46Å; V75-Y400 HydrophobicContact CB-CE2 4.37Å; V75-Y400 HydrophobicContact CG1-CD2 4.36Å; V397-Y400 PolarHBondContact N-O 2.86Å; V397-Y400 PolarHBondContact O-N 2.98Å; G398-Y400 VanDerWaalsContact C-N 3.25Å; G398-Y400 PolarHBondContact O-N 3.06Å
401	I	95.8	Very high	95	Very high	56 Å²	56	43.4 Å²	43.4	29%	0.287	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.1	165	-59.5	173.4	0	0	0	108	R34 R35 D394 P403	R34-I401 HydrophobicContact CB-CD1 3.97Å; R34-I401 HydrophobicContact CB-CG1 4.05Å; R35-I401 PolarHBondContact O-N 2.67Å; D394-I401 HydrophobicContact CB-CG2 4.31Å; I401-P403 WeakPolarHBondContact O-CD 3.34Å
402	I	95.8	Very high	94.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115.4	172.8	-56.3	-176.9	0	0	0	107.8	V86 D394 I395 V397 T406 V408	V86-I402 HydrophobicContact CB-CD1 4.44Å; V86-I402 HydrophobicContact CG1-CD1 3.9Å; D394-I402 WeakPolarHBondContact CA-O 3.44Å; I395-I402 HydrophobicContact CD1-CB 4.45Å; I395-I402 HydrophobicContact CD1-CD1 4.49Å; I395-I402 HydrophobicContact CG1-CB 3.84Å; I395-I402 HydrophobicContact CG1-CG2 4.41Å; I395-I402 PolarHBondContact N-O 3.2Å; I395-I402 PolarHBondContact O-N 2.91Å; V397-I402 HydrophobicContact CB-CD1 3.85Å; V397-I402 HydrophobicContact CB-CG1 4.37Å; V397-I402 HydrophobicContact CG2-CD1 3.42Å; V397-I402 VanDerWaalsContact CG2-CD1 3.42Å; V397-I402 HydrophobicContact CG2-CG1 4.14Å; I402-T406 HydrophobicContact CG2-CG2 3.79Å; I402-V408 HydrophobicContact CD1-CG2 4.05Å; I402-V408 HydrophobicContact CG2-CG2 3.96Å
403	P	95.1	Very high	95	Very high	46 Å²	46	40.5 Å²	40.5	30%	0.299	21%	0.212	S	C	.	.			trans	-63.9	152.1	179.5	-22.1	33.7	0	0	0	112.4	L37 D394 I401 T406	L37-P403 HydrophobicContact CB-CG 4.37Å; D394-P403 WeakPolarHBondContact OD1-CA 3.23Å; I401-P403 WeakPolarHBondContact O-CD 3.34Å; P403-T406 WeakPolarHBondContact O-CB 3.26Å; P403-T406 PolarHBondContact O-N 3.36Å; P403-T406 PolarHBondContact O-OG1 3.5Å
404	K	95.1	Very high	95	Very high	105 Å²	105	35.9 Å²	35.9	46%	0.457	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.4	145.9	166.3	177.9	176.6	179.8	155.7	0	111.5	D392 D394 T406	D392-K404 WeakPolarHBondContact O-CD 3.31Å; D392-K404 WeakPolarHBondContact O-CE 3.39Å; D392-K404 PolarHBondContact O-NZ 3.46Å; D394-K404 PolarHBondContact OD1-N 3.35Å; K404-T406 PolarHBondContact O-N 3.1Å
405	N	92.9	Very high	95	Very high	114 Å²	114	31.3 Å²	31.3	61%	0.61	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	12.8	179.3	-56.1	-32.6	0	0	0	114.8	P391	P391-N405 PolarHBondContact O-N 3.46Å
406	T	94.1	Very high	94.9	Very high	17 Å²	17	31.1 Å²	31.1	10%	0.104	17%	0.168	C	C	.	.			trans	-82.4	128	173	-57	0	0	0	0	110.3	L37 V86 P391 I402 P403 K404 V408	L37-T406 HydrophobicContact CD1-CG2 4.18Å; V86-T406 HydrophobicContact CG2-CG2 3.78Å; P391-T406 WeakPolarHBondContact CD-O 3.27Å; I402-T406 HydrophobicContact CG2-CG2 3.79Å; P403-T406 WeakPolarHBondContact O-CB 3.26Å; P403-T406 PolarHBondContact O-N 3.36Å; P403-T406 PolarHBondContact O-OG1 3.5Å; K404-T406 PolarHBondContact O-N 3.1Å; T406-V408 PolarHBondContact O-N 3.44Å
407	L	94.9	Very high	95	Very high	24 Å²	24	29.3 Å²	29.3	13%	0.126	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.4	174	178.8	60.6	0	0	0	109.8	V83 T85 V86 C108 V390	V83-L407 HydrophobicContact CG1-CD2 3.79Å; T85-L407 VanDerWaalsContact CA-O 3.31Å; T85-L407 WeakPolarHBondContact CA-O 3.46Å; T85-L407 HydrophobicContact CG2-CD2 4.39Å; T85-L407 HydrophobicContact CG2-CG 4.17Å; T85-L407 WeakPolarHBondContact OG1-CD2 3.38Å; V86-L407 PolarHBondContact N-O 2.96Å; C108-L407 HydrophobicContact CB-CD1 3.89Å; V390-L407 HydrophobicContact CG2-CD1 4Å
408	V	96.3	Very high	95	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.7	175	-169.1	0	0	0	0	109.8	V86 V88 L97 S388 R389 P391 I402 T406	V86-V408 HydrophobicContact CB-CG1 4.37Å; V86-V408 HydrophobicContact CB-CG2 4.36Å; V86-V408 HydrophobicContact CG1-CG1 4.45Å; V86-V408 CarbonylContact O-C 3.53Å; V86-V408 VanDerWaalsContact O-CA 3.23Å; V86-V408 WeakPolarHBondContact O-CA 3.26Å; V88-V408 HydrophobicContact CG2-CG1 3.67Å; L97-V408 HydrophobicContact CD1-CB 4.01Å; L97-V408 HydrophobicContact CD1-CG1 3.48Å; L97-V408 VanDerWaalsContact CD1-CG1 3.48Å; L97-V408 HydrophobicContact CD1-CG2 4.22Å; S388-V408 CarbonylContact C-O 3.31Å; S388-V408 WeakPolarHBondContact CA-O 3.5Å; S388-V408 WeakPolarHBondContact CB-O 3.14Å; R389-V408 PolarHBondContact N-O 2.99Å; R389-V408 PolarHBondContact O-N 3.21Å; P391-V408 HydrophobicContact CG-CG2 4.28Å; I402-V408 HydrophobicContact CD1-CG2 4.05Å; I402-V408 HydrophobicContact CG2-CG2 3.96Å; T406-V408 PolarHBondContact O-N 3.44Å
409	T	95.5	Very high	95.1	Very high	18 Å²	18	34.1 Å²	34.1	11%	0.11	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.8	173.3	-64.1	0	0	0	0	110.1	T85 V86 Y87 V88 N387	T85-T409 VanDerWaalsContact CG2-OG1 3.26Å; T85-T409 WeakPolarHBondContact CG2-OG1 3.39Å; V86-T409 PolarHBondContact O-N 3.37Å; Y87-T409 WeakPolarHBondContact CA-O 3.48Å; Y87-T409 HydrophobicContact CD1-CG2 4.01Å; Y87-T409 HydrophobicContact CE1-CG2 4.16Å; V88-T409 PolarHBondContact N-O 3.27Å; N387-T409 CarbonylContact O-C 3.45Å
410	L	96.1	Very high	95.1	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	108.5	172.2	-46.6	178.7	0	0	0	107.9	V94 L97 L98 G386 N387 H412	V94-L410 HydrophobicContact CG1-CD1 4.28Å; V94-L410 HydrophobicContact CG1-CD2 4.34Å; V94-L410 HydrophobicContact CG2-CD2 4.31Å; L97-L410 HydrophobicContact CD1-CD2 4.06Å; L97-L410 HydrophobicContact CD2-CD2 4.04Å; L98-L410 HydrophobicContact CD1-CD1 4.16Å; L98-L410 HydrophobicContact CD2-CD1 4.06Å; L98-L410 HydrophobicContact CG-CD1 4.24Å; G386-L410 CarbonylContact C-O 3.53Å; G386-L410 WeakPolarHBondContact CA-O 3.44Å; N387-L410 PolarHBondContact N-O 3.43Å; N387-L410 VanDerWaalsContact N-O 3.13Å; N387-L410 WeakPolarHBondContact O-CB 3.46Å; N387-L410 WeakPolarHBondContact O-CG 3.41Å; N387-L410 PolarHBondContact O-N 3.09Å; L410-H412 VanDerWaalsContact C-N 3.3Å; L410-H412 PolarHBondContact O-N 3.08Å
411	C	95.8	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.			trans	-80.6	69.4	-170.8	-67.2	0	0	0	0	112.7	Q65 W76 V88 A89 Y413 A414 T415	Q65-C411 HydrophobicContact CB-CB 4.1Å; Q65-C411 HydrophobicContact CG-CB 4.23Å; W76-C411 HydrophobicContact CH2-CB 4.43Å; W76-C411 VanDerWaalsContact CH2-SG 3.57Å; V88-C411 WeakPolarHBondContact O-CB 3.46Å; V88-C411 PolarHBondContact O-N 3.18Å; A89-C411 HydrophobicContact CB-CB 3.8Å; C411-Y413 VanDerWaalsContact C-N 3.27Å; C411-Y413 PolarHBondContact O-N 2.83Å; C411-A414 HydrophobicContact CB-CB 4.05Å; C411-A414 PolarHBondContact O-N 3.16Å; C411-A414 VanDerWaalsContact O-N 3.08Å; C411-T415 PolarHBondContact O-N 3.48Å
412	H	93.4	Very high	95.1	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-57.1	-36.6	-176.8	-62.5	-28.1	0	0	0	113.6	P385 N387 L410 A414 T415 S416	P385-H412 PolarHBondContact O-N 3.34Å; N387-H412 WeakPolarHBondContact CB-NE2 3.45Å; L410-H412 VanDerWaalsContact C-N 3.3Å; L410-H412 PolarHBondContact O-N 3.08Å; H412-A414 VanDerWaalsContact C-N 3.31Å; H412-A414 PolarHBondContact O-N 2.9Å; H412-T415 WeakPolarHBondContact CA-OG1 3.48Å; H412-T415 PolarHBondContact O-OG1 3.34Å; H412-S416 WeakPolarHBondContact O-CB 3.42Å; H412-S416 PolarHBondContact O-N 2.95Å; H412-S416 PolarHBondContact O-OG 3.39Å
413	Y	95.6	Very high	95	Very high	16 Å²	16	33.9 Å²	33.9	6%	0.063	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-36.7	178.7	-171.5	-88.7	0	0	0	111.9	H62 V66 P382 P385 C411 R417 L495	H62-Y413 HydrophobicContact CB-CD1 4.08Å; H62-Y413 HydrophobicContact CB-CD2 3.98Å; H62-Y413 HydrophobicContact CB-CE1 4.4Å; H62-Y413 HydrophobicContact CB-CE2 4.29Å; H62-Y413 HydrophobicContact CB-CG 3.87Å; H62-Y413 AromaticContact CD2-CE1 3.72Å; H62-Y413 AromaticContact CD2-CE2 3.67Å; H62-Y413 AromaticContact CD2-CZ 3.39Å; H62-Y413 VanDerWaalsContact O-CD1 3.23Å; H62-Y413 WeakPolarHBondContact O-CD1 3.44Å; V66-Y413 HydrophobicContact CG2-CD1 3.75Å; V66-Y413 HydrophobicContact CG2-CE1 3.86Å; P382-Y413 HydrophobicContact CG-CD2 3.95Å; P385-Y413 PolarHBondContact O-N 3.42Å; C411-Y413 VanDerWaalsContact C-N 3.27Å; C411-Y413 PolarHBondContact O-N 2.83Å; Y413-R417 PolarHBondContact OH-NE 3.49Å; Y413-R417 PolarHBondContact OH-NH2 3.06Å; Y413-L495 HydrophobicContact CD2-CD2 4.25Å; Y413-L495 HydrophobicContact CE2-CD2 4.05Å
414	A	96.2	Very high	95	Very high	9 Å²	9	38.5 Å²	38.5	7%	0.074	21%	0.213	C	C	.	.	H	α-helix	trans	-72.9	-48.1	175.4	0	0	0	0	0	112.1	Q65 V66 A89 C411 H412 S416 R417 D418	Q65-A414 HydrophobicContact CB-CB 3.89Å; V66-A414 HydrophobicContact CG2-CB 4.38Å; A89-A414 HydrophobicContact CB-CB 4.06Å; C411-A414 HydrophobicContact CB-CB 4.05Å; C411-A414 PolarHBondContact O-N 3.16Å; C411-A414 VanDerWaalsContact O-N 3.08Å; H412-A414 VanDerWaalsContact C-N 3.31Å; H412-A414 PolarHBondContact O-N 2.9Å; A414-S416 VanDerWaalsContact C-N 3.28Å; A414-S416 PolarHBondContact O-N 2.86Å; A414-R417 CarbonylContact O-C 3.58Å; A414-R417 WeakPolarHBondContact O-CA 3.32Å; A414-R417 PolarHBondContact O-N 2.98Å; A414-D418 PolarHBondContact O-N 2.83Å; A414-D418 VanDerWaalsContact O-N 3.15Å
415	T	95.9	Very high	95	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-37	179.9	60	0	0	0	0	112.1	A89 C411 H412 R417 D418 A444	A89-T415 WeakPolarHBondContact O-CG2 3.34Å; C411-T415 PolarHBondContact O-N 3.48Å; H412-T415 WeakPolarHBondContact CA-OG1 3.48Å; H412-T415 PolarHBondContact O-OG1 3.34Å; T415-R417 PolarHBondContact O-N 3.01Å; T415-D418 PolarHBondContact O-N 3.45Å; T415-A444 CarbonylContact C-O 3.58Å; T415-A444 VanDerWaalsContact C-O 3.31Å; T415-A444 VanDerWaalsContact CB-O 3.29Å; T415-A444 WeakPolarHBondContact CB-O 3.34Å; T415-A444 PolarHBondContact OG1-O 3.37Å
416	S	95.4	Very high	95.2	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.014	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.6	175.2	-73.5	0	0	0	0	113.8	R379 H412 A414 F422 A444	R379-S416 PolarHBondContact NH1-O 3.27Å; R379-S416 WeakPolarHBondContact O-CB 3.25Å; R379-S416 PolarHBondContact O-OG 3Å; H412-S416 WeakPolarHBondContact O-CB 3.42Å; H412-S416 PolarHBondContact O-N 2.95Å; H412-S416 PolarHBondContact O-OG 3.39Å; A414-S416 VanDerWaalsContact C-N 3.28Å; A414-S416 PolarHBondContact O-N 2.86Å; S416-F422 WeakPolarHBondContact O-CD2 3.31Å; S416-A444 PolarHBondContact N-O 3.24Å
417	R	95.4	Very high	95.3	Very high	29 Å²	29	36.2 Å²	36.2	11%	0.109	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	9	-179.9	-77.4	176.8	168.4	69.2	1.6	113.9	L380 Y413 A414 T415 P419 P425 N426	L380-R417 VanDerWaalsContact O-CZ 3.25Å; L380-R417 PolarHBondContact O-NH1 3.04Å; L380-R417 PolarHBondContact O-NH2 3.22Å; Y413-R417 PolarHBondContact OH-NE 3.49Å; Y413-R417 PolarHBondContact OH-NH2 3.06Å; A414-R417 CarbonylContact O-C 3.58Å; A414-R417 WeakPolarHBondContact O-CA 3.32Å; A414-R417 PolarHBondContact O-N 2.98Å; T415-R417 PolarHBondContact O-N 3.01Å; R417-P419 VanDerWaalsContact O-CD 3.31Å; R417-P419 WeakPolarHBondContact O-CD 3.22Å; R417-P425 HydrophobicContact CB-CB 4.43Å; R417-P425 WeakPolarHBondContact O-CB 3.33Å; R417-P425 WeakPolarHBondContact O-CG 3.31Å; R417-N426 PolarHBondContact NE-OD1 2.98Å
418	D	95.1	Very high	95.4	Very high	46 Å²	46	35.6 Å²	35.6	25%	0.246	21%	0.207	C	C	.	.			trans	-71.1	115.7	175.3	-178.3	-3.9	0	0	0	109.7	A414 T415 A420 Q421 F422	A414-D418 PolarHBondContact O-N 2.83Å; A414-D418 VanDerWaalsContact O-N 3.15Å; T415-D418 PolarHBondContact O-N 3.45Å; D418-A420 PolarHBondContact O-N 3.29Å; D418-A420 VanDerWaalsContact OD1-CB 3.31Å; D418-A420 WeakPolarHBondContact OD1-CB 3.38Å; D418-A420 PolarHBondContact OD1-N 3.06Å; D418-Q421 HydrophobicContact CB-CB 4.29Å; D418-Q421 HydrophobicContact CB-CG 3.99Å; D418-Q421 PolarHBondContact O-N 2.83Å; D418-F422 PolarHBondContact O-N 3.38Å
419	P	94.6	Very high	95.4	Very high	89 Å²	89	40 Å²	40	58%	0.578	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.3	179	26.6	-34.7	0	0	0	113.4	R417 Q421 F422 P425	R417-P419 VanDerWaalsContact O-CD 3.31Å; R417-P419 WeakPolarHBondContact O-CD 3.22Å; P419-Q421 VanDerWaalsContact C-N 3.27Å; P419-Q421 PolarHBondContact O-N 3.22Å; P419-F422 WeakPolarHBondContact CA-O 3.41Å; P419-P425 HydrophobicContact CB-CG 4.14Å
420	A	93.5	Very high	95.4	Very high	81 Å²	81	39.3 Å²	39.3	67%	0.669	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-23.6	173.8	0	0	0	0	0	112.5	D418	D418-A420 PolarHBondContact O-N 3.29Å; D418-A420 VanDerWaalsContact OD1-CB 3.31Å; D418-A420 WeakPolarHBondContact OD1-CB 3.38Å; D418-A420 PolarHBondContact OD1-N 3.06Å
421	Q	94.6	Very high	95.3	Very high	43 Å²	43	40.5 Å²	40.5	20%	0.201	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-37.2	176.2	-57.4	-56.7	-55.8	0	0	111.8	P91 D418 P419 P440 A444	P91-Q421 HydrophobicContact CG-CG 3.89Å; D418-Q421 HydrophobicContact CB-CB 4.29Å; D418-Q421 HydrophobicContact CB-CG 3.99Å; D418-Q421 PolarHBondContact O-N 2.83Å; P419-Q421 VanDerWaalsContact C-N 3.27Å; P419-Q421 PolarHBondContact O-N 3.22Å; Q421-P440 HydrophobicContact CB-CB 4.47Å; Q421-A444 HydrophobicContact CB-CB 4.04Å; Q421-A444 HydrophobicContact CG-CB 3.98Å
422	F	95.3	Very high	95.2	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.009	24%	0.24	C	C	.	.	S	Bend	trans	-132.7	99.8	-174.4	-58.6	-75.8	0	0	0	109.9	R379 S416 D418 P419 E424 P425 W433 P440 A444	R379-F422 VanDerWaalsContact CD-CD1 3.48Å; R379-F422 VanDerWaalsContact CD-CE1 3.44Å; R379-F422 HydrophobicContact CG-CE1 4.45Å; R379-F422 HydrophobicContact CG-CE2 4.44Å; R379-F422 HydrophobicContact CG-CZ 4.29Å; S416-F422 WeakPolarHBondContact O-CD2 3.31Å; D418-F422 PolarHBondContact O-N 3.38Å; P419-F422 WeakPolarHBondContact CA-O 3.41Å; F422-E424 PolarHBondContact O-N 3.25Å; F422-P425 HydrophobicContact CB-CB 4.27Å; F422-P425 WeakPolarHBondContact O-CA 3.49Å; F422-P425 WeakPolarHBondContact O-CB 3.38Å; F422-P425 WeakPolarHBondContact O-CD 3.45Å; F422-W433 AromaticContact CE1-CH2 3.73Å; F422-W433 HydrophobicContact CE1-CH2 3.73Å; F422-W433 AromaticContact CE1-CZ2 3.98Å; F422-W433 HydrophobicContact CE1-CZ2 3.98Å; F422-W433 HydrophobicContact CZ-CH2 4.1Å; F422-P440 HydrophobicContact CD1-CB 4.28Å; F422-P440 HydrophobicContact CD1-CG 4.48Å; F422-P440 HydrophobicContact CE1-CB 3.66Å; F422-P440 HydrophobicContact CE1-CG 3.7Å; F422-P440 HydrophobicContact CZ-CB 3.79Å; F422-P440 HydrophobicContact CZ-CG 4.14Å; F422-A444 HydrophobicContact CE2-CB 3.72Å; F422-A444 HydrophobicContact CZ-CB 3.92Å
423	P	93.9	Very high	95.3	Very high	64 Å²	64	44.9 Å²	44.9	42%	0.416	25%	0.25	S	C	.	.	S	Bend	trans	-54.3	136.8	169.6	-25.7	34.7	0	0	0	110.7	R432 P438	P423-R432 PolarHBondContact O-NH1 3.35Å; P423-R432 PolarHBondContact O-NH2 3.15Å; P423-P438 HydrophobicContact CG-CG 4.29Å
424	E	94.9	Very high	95.2	Very high	143 Å²	143	47.6 Å²	47.6	67%	0.668	27%	0.265	S	S	*	.	S	Bend	trans	49.2	62.4	-171.7	-60.4	-179.6	107.6	0	0	111.9	F422 N426 S427	F422-E424 PolarHBondContact O-N 3.25Å; E424-N426 PolarHBondContact O-N 3.02Å; E424-S427 PolarHBondContact O-N 2.99Å
425	P	95.8	Very high	94.5	Very high	19 Å²	19	50.4 Å²	50.4	12%	0.123	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.8	-164.5	22.1	-31.5	0	0	0	113.9	R379 L380 R417 P419 F422	R379-P425 PolarHBondContact NH1-O 2.75Å; R379-P425 PolarHBondContact NH2-O 3.1Å; L380-P425 WeakPolarHBondContact CD2-O 3.28Å; R417-P425 HydrophobicContact CB-CB 4.43Å; R417-P425 WeakPolarHBondContact O-CB 3.33Å; R417-P425 WeakPolarHBondContact O-CG 3.31Å; P419-P425 HydrophobicContact CB-CG 4.14Å; F422-P425 HydrophobicContact CB-CB 4.27Å; F422-P425 WeakPolarHBondContact O-CA 3.49Å; F422-P425 WeakPolarHBondContact O-CB 3.38Å; F422-P425 WeakPolarHBondContact O-CD 3.45Å
426	N	96.1	Very high	93.4	Very high	113 Å²	113	57.5 Å²	57.5	60%	0.604	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-3.7	-180	-63.5	-52.2	0	0	0	113.3	R417 E424	R417-N426 PolarHBondContact NE-OD1 2.98Å; E424-N426 PolarHBondContact O-N 3.02Å
427	S	96	Very high	92.5	Very high	56 Å²	56	60 Å²	60	39%	0.392	35%	0.354	S	S	.	.	S	Bend	trans	-91	145	178.8	-57.3	0	0	0	0	111.1	R379 E424 H429	R379-S427 PolarHBondContact NH2-O 2.91Å; R379-S427 VanDerWaalsContact NH2-O 3.1Å; E424-S427 PolarHBondContact O-N 2.99Å; S427-H429 PolarHBondContact O-N 3Å
428	F	97.7	Very high	91.8	Very high	11 Å²	11	63.5 Å²	63.5	5%	0.048	38%	0.381	C	S	.	.			trans	-81.3	104.9	173.3	176.7	-110.2	0	0	0	110	E332 L333 H336 V339 V373 E376 V377 L380 P430	E332-F428 HydrophobicContact CB-CB 4.45Å; E332-F428 HydrophobicContact CB-CD1 3.94Å; E332-F428 HydrophobicContact CB-CD2 3.86Å; E332-F428 HydrophobicContact CB-CE1 4.05Å; E332-F428 HydrophobicContact CB-CE2 4.01Å; E332-F428 HydrophobicContact CB-CG 3.82Å; E332-F428 HydrophobicContact CB-CZ 4.08Å; E332-F428 HydrophobicContact CG-CB 4.33Å; E332-F428 HydrophobicContact CG-CD2 3.98Å; E332-F428 HydrophobicContact CG-CE2 4.47Å; E332-F428 HydrophobicContact CG-CG 4.09Å; E332-F428 WeakPolarHBondContact OE2-CB 3.45Å; L333-F428 HydrophobicContact CD2-CE1 4.47Å; L333-F428 HydrophobicContact CD2-CZ 4.5Å; H336-F428 HydrophobicContact CB-CD1 4.15Å; H336-F428 HydrophobicContact CB-CE1 4.38Å; H336-F428 AromaticContact CE1-CD1 3.9Å; H336-F428 AromaticContact CG-CD1 3.71Å; H336-F428 AromaticContact ND1-CD1 3.52Å; V339-F428 HydrophobicContact CB-CE1 4.39Å; V339-F428 HydrophobicContact CG1-CE1 3.97Å; V339-F428 HydrophobicContact CG1-CZ 4.48Å; V339-F428 HydrophobicContact CG2-CE1 4.48Å; V373-F428 HydrophobicContact CG1-CZ 4.18Å; V373-F428 HydrophobicContact CG2-CZ 4.25Å; E376-F428 HydrophobicContact CB-CD2 4.28Å; E376-F428 HydrophobicContact CB-CE2 4.03Å; E376-F428 HydrophobicContact CG-CD2 3.58Å; E376-F428 HydrophobicContact CG-CE2 3.85Å; E376-F428 HydrophobicContact CG-CG 4.49Å; V377-F428 HydrophobicContact CG2-CE2 3.84Å; L380-F428 HydrophobicContact CD1-CB 3.91Å; L380-F428 HydrophobicContact CD1-CD2 4.06Å; F428-P430 HydrophobicContact CD1-CG 4.31Å; F428-P430 HydrophobicContact CD2-CG 4.38Å; F428-P430 HydrophobicContact CE1-CG 3.7Å; F428-P430 HydrophobicContact CE2-CG 3.74Å; F428-P430 HydrophobicContact CZ-CG 3.38Å
429	H	95.7	Very high	91.5	Very high	93 Å²	93	67.3 Å²	67.3	43%	0.431	41%	0.406	S	S	.	.			trans	-137.6	80.7	-176.5	-172.3	-98	0	0	0	111.5	E376 S427 A431 R432	E376-H429 PolarHBondContact OE1-N 3.28Å; S427-H429 PolarHBondContact O-N 3Å; H429-A431 PolarHBondContact O-N 2.77Å; H429-R432 VanDerWaalsContact O-CG 3.26Å; H429-R432 WeakPolarHBondContact O-CG 3.49Å; H429-R432 PolarHBondContact O-N 3Å; H429-R432 PolarHBondContact O-NE 3.13Å
430	P	96.6	Very high	91.5	Very high	4 Å²	4	64.1 Å²	64.1	3%	0.026	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-57.7	-30.2	-177.8	-28.6	37.9	0	0	0	114.5	V339 L369 A372 V373 E376 F428 R432 W433	V339-P430 HydrophobicContact CG1-CG 3.96Å; L369-P430 HydrophobicContact CD1-CB 4.01Å; A372-P430 HydrophobicContact CB-CB 4.08Å; A372-P430 WeakPolarHBondContact CB-O 3.36Å; V373-P430 HydrophobicContact CG2-CB 3.94Å; V373-P430 HydrophobicContact CG2-CG 3.75Å; E376-P430 HydrophobicContact CB-CB 4.47Å; E376-P430 HydrophobicContact CB-CG 4.29Å; E376-P430 HydrophobicContact CG-CG 4.36Å; F428-P430 HydrophobicContact CD1-CG 4.31Å; F428-P430 HydrophobicContact CD2-CG 4.38Å; F428-P430 HydrophobicContact CE1-CG 3.7Å; F428-P430 HydrophobicContact CE2-CG 3.74Å; F428-P430 HydrophobicContact CZ-CG 3.38Å; P430-R432 PolarHBondContact O-N 2.84Å; P430-W433 PolarHBondContact O-N 2.74Å
431	A	94.1	Very high	91.5	Very high	26 Å²	26	62.9 Å²	62.9	22%	0.215	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-56.6	-22.2	-178.5	0	0	0	0	0	113.7	H429 W433 L434	H429-A431 PolarHBondContact O-N 2.77Å; A431-W433 PolarHBondContact O-N 2.76Å; A431-L434 HydrophobicContact CB-CD1 4.39Å; A431-L434 WeakPolarHBondContact O-CB 3.37Å; A431-L434 PolarHBondContact O-N 2.76Å
432	R	93.8	Very high	91.5	Very high	37 Å²	37	65.6 Å²	65.6	14%	0.14	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-59.5	-19.1	173.8	77.7	179.3	67.6	-109	11.2	114.1	E376 P423 H429 P430	E376-R432 IonicContact OE1-CZ 2.72Å; E376-R432 IonicContact OE1-NE 3.49Å; E376-R432 PolarHBondContact OE1-NE 2.97Å; E376-R432 IonicContact OE1-NH2 3.62Å; E376-R432 VanDerWaalsContact OE2-CD 3.24Å; E376-R432 WeakPolarHBondContact OE2-CD 3.49Å; E376-R432 IonicContact OE2-NE 3.4Å; E376-R432 PolarHBondContact OE2-NE 3.4Å; P423-R432 PolarHBondContact O-NH1 3.35Å; P423-R432 PolarHBondContact O-NH2 3.15Å; H429-R432 VanDerWaalsContact O-CG 3.26Å; H429-R432 WeakPolarHBondContact O-CG 3.49Å; H429-R432 PolarHBondContact O-N 3Å; H429-R432 PolarHBondContact O-NE 3.13Å; P430-R432 PolarHBondContact O-N 2.84Å
433	W	94.8	Very high	91.5	Very high	59 Å²	59	66 Å²	66	22%	0.223	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-96.9	0.1	179	-56	106.1	0	0	0	113.6	A372 K375 E376 R379 F422 P430 A431 P440	A372-W433 HydrophobicContact CB-CB 3.81Å; K375-W433 HydrophobicContact CB-CD2 4.02Å; K375-W433 HydrophobicContact CB-CG 4.07Å; K375-W433 HydrophobicContact CB-CZ2 4.46Å; K375-W433 HydrophobicContact CD-CB 4.38Å; K375-W433 HydrophobicContact CD-CD2 4.09Å; K375-W433 HydrophobicContact CD-CE3 4.12Å; K375-W433 HydrophobicContact CD-CG 4.23Å; E376-W433 PolarHBondContact OE2-NE1 3.24Å; R379-W433 HydrophobicContact CB-CZ2 4.12Å; R379-W433 HydrophobicContact CG-CZ2 4.36Å; F422-W433 AromaticContact CE1-CH2 3.73Å; F422-W433 HydrophobicContact CE1-CH2 3.73Å; F422-W433 AromaticContact CE1-CZ2 3.98Å; F422-W433 HydrophobicContact CE1-CZ2 3.98Å; F422-W433 HydrophobicContact CZ-CH2 4.1Å; P430-W433 PolarHBondContact O-N 2.74Å; A431-W433 PolarHBondContact O-N 2.76Å; W433-P440 HydrophobicContact CZ3-CG 4.21Å
434	L	93.4	Very high	91.6	Very high	74 Å²	74	63 Å²	63	39%	0.387	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	1.8	-178.3	-59.1	-179.5	0	0	0	113.3	P368 L369 A372 A431	P368-L434 HydrophobicContact CB-CD2 3.94Å; L369-L434 HydrophobicContact CD1-CD1 4.39Å; A372-L434 HydrophobicContact CB-CD2 3.88Å; A372-L434 HydrophobicContact CB-CG 4.32Å; A431-L434 HydrophobicContact CB-CD1 4.39Å; A431-L434 WeakPolarHBondContact O-CB 3.37Å; A431-L434 PolarHBondContact O-N 2.76Å
435	G	82.4	Confident	91.6	Very high	67 Å²	67	57.2 Å²	57.2	69%	0.691	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	5.4	179.1	0	0	0	0	0	114.2
436	E	71.6	Confident	91.5	Very high	150 Å²	150	57.1 Å²	57.1	70%	0.701	34%	0.343	S	S	*	.			trans	-92	107.3	174.6	-61.9	-179.3	179.3	0	0	109.3
437	G	76.4	Confident	91.4	Very high	55 Å²	55	53.6 Å²	53.6	57%	0.567	33%	0.326	S	S	*	.	S	Bend	trans	111.6	-172.4	174.9	0	0	0	0	0	115.8	T439	G437-T439 PolarHBondContact O-N 2.91Å
438	P	82.3	Confident	91.4	Very high	101 Å²	101	52.4 Å²	52.4	66%	0.656	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-63.7	126.1	-178.6	25.1	-31.7	0	0	0	110.2	P423 P440	P423-P438 HydrophobicContact CG-CG 4.29Å; P438-P440 WeakPolarHBondContact O-CD 3.3Å
439	T	88.2	Confident	91.2	Very high	127 Å²	127	52.5 Å²	52.5	78%	0.779	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-74.6	119.6	177.9	-59.7	0	0	0	0	108.9	G437	G437-T439 PolarHBondContact O-N 2.91Å
440	P	93.4	Very high	91.2	Very high	22 Å²	22	52.2 Å²	52.2	14%	0.143	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-64.5	157.1	177.3	28.2	-35.5	0	0	0	110.2	Q421 F422 W433 P438 A444	Q421-P440 HydrophobicContact CB-CB 4.47Å; F422-P440 HydrophobicContact CD1-CB 4.28Å; F422-P440 HydrophobicContact CD1-CG 4.48Å; F422-P440 HydrophobicContact CE1-CB 3.66Å; F422-P440 HydrophobicContact CE1-CG 3.7Å; F422-P440 HydrophobicContact CZ-CB 3.79Å; F422-P440 HydrophobicContact CZ-CG 4.14Å; W433-P440 HydrophobicContact CZ3-CG 4.21Å; P438-P440 WeakPolarHBondContact O-CD 3.3Å; P440-A444 HydrophobicContact CB-CB 4.39Å
441	H	95.4	Very high	91	Very high	54 Å²	54	53.3 Å²	53.3	25%	0.25	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-55.6	136.7	172.2	-167.3	-87.6	0	0	0	110.4	P91 E95 F443 A444	P91-H441 HydrophobicContact CB-CB 3.64Å; P91-H441 WeakPolarHBondContact CB-ND1 3.47Å; P91-H441 HydrophobicContact CG-CB 4.28Å; E95-H441 IonicContact OE2-CE1 2.73Å; E95-H441 PolarHBondContact OE2-CE1 3.33Å; E95-H441 IonicContact OE2-NE2 2.63Å; E95-H441 PolarHBondContact OE2-NE2 3.45Å; H441-F443 AromaticContact CE1-CD2 3.74Å; H441-F443 AromaticContact ND1-CD2 3.96Å; H441-F443 PolarHBondContact ND1-N 3.42Å; H441-F443 PolarHBondContact O-N 2.94Å; H441-A444 HydrophobicContact CB-CB 4.26Å; H441-A444 WeakPolarHBondContact O-CB 3.21Å; H441-A444 PolarHBondContact O-N 3.12Å
442	P	94	Very high	91	Very high	101 Å²	101	57.4 Å²	57.4	66%	0.656	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.7	-176.6	-28	35.3	0	0	0	114.8
443	F	95.4	Very high	91.1	Very high	11 Å²	11	56.2 Å²	56.2	5%	0.048	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	3.5	177.7	-66.8	-106.5	0	0	0	113.9	P91 V94 E95 L98 H441 S445 L446 F450	P91-F443 HydrophobicContact CB-CB 4.47Å; V94-F443 HydrophobicContact CG1-CB 4.34Å; V94-F443 HydrophobicContact CG1-CD1 4.17Å; E95-F443 HydrophobicContact CB-CB 4.38Å; E95-F443 HydrophobicContact CB-CD1 4.01Å; E95-F443 HydrophobicContact CB-CD2 3.68Å; E95-F443 HydrophobicContact CB-CE1 4.2Å; E95-F443 HydrophobicContact CB-CE2 3.88Å; E95-F443 HydrophobicContact CB-CG 3.77Å; E95-F443 HydrophobicContact CB-CZ 4.14Å; E95-F443 VanDerWaalsContact CD-CE2 3.45Å; E95-F443 HydrophobicContact CG-CD2 3.91Å; E95-F443 HydrophobicContact CG-CE1 4.35Å; E95-F443 HydrophobicContact CG-CE2 3.61Å; E95-F443 HydrophobicContact CG-CG 4.43Å; E95-F443 HydrophobicContact CG-CZ 3.85Å; E95-F443 WeakPolarHBondContact OE1-CE2 3.32Å; L98-F443 HydrophobicContact CB-CE1 4.24Å; L98-F443 HydrophobicContact CD1-CD1 3.74Å; L98-F443 HydrophobicContact CD1-CE1 3.68Å; H441-F443 AromaticContact CE1-CD2 3.74Å; H441-F443 AromaticContact ND1-CD2 3.96Å; H441-F443 PolarHBondContact ND1-N 3.42Å; H441-F443 PolarHBondContact O-N 2.94Å; F443-S445 VanDerWaalsContact C-N 3.34Å; F443-L446 HydrophobicContact CB-CD1 4.16Å; F443-L446 HydrophobicContact CD1-CD1 3.74Å; F443-L446 HydrophobicContact CG-CD1 4.32Å; F443-F450 HydrophobicContact CE1-CB 4.47Å; F443-F450 AromaticContact CE1-CD1 3.79Å; F443-F450 HydrophobicContact CE1-CD1 3.79Å; F443-F450 AromaticContact CE1-CD2 3.9Å; F443-F450 HydrophobicContact CE1-CD2 3.9Å; F443-F450 AromaticContact CE1-CE1 3.94Å; F443-F450 HydrophobicContact CE1-CE1 3.94Å; F443-F450 HydrophobicContact CE1-CE2 4.04Å; F443-F450 AromaticContact CE1-CG 3.78Å; F443-F450 HydrophobicContact CE1-CG 3.78Å; F443-F450 HydrophobicContact CE1-CZ 4.06Å; F443-F450 HydrophobicContact CZ-CD1 4.24Å; F443-F450 HydrophobicContact CZ-CD2 4.08Å; F443-F450 AromaticContact CZ-CE1 3.92Å; F443-F450 HydrophobicContact CZ-CE1 3.92Å; F443-F450 AromaticContact CZ-CE2 3.74Å; F443-F450 HydrophobicContact CZ-CE2 3.74Å; F443-F450 HydrophobicContact CZ-CG 4.32Å; F443-F450 AromaticContact CZ-CZ 3.66Å; F443-F450 HydrophobicContact CZ-CZ 3.66Å
444	A	95.2	Very high	91.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-71.5	-29.2	179	0	0	0	0	0	112.7	P91 T415 S416 Q421 F422 P440 H441	P91-A444 HydrophobicContact CB-CB 4.15Å; P91-A444 HydrophobicContact CG-CB 3.75Å; T415-A444 CarbonylContact C-O 3.58Å; T415-A444 VanDerWaalsContact C-O 3.31Å; T415-A444 VanDerWaalsContact CB-O 3.29Å; T415-A444 WeakPolarHBondContact CB-O 3.34Å; T415-A444 PolarHBondContact OG1-O 3.37Å; S416-A444 PolarHBondContact N-O 3.24Å; Q421-A444 HydrophobicContact CB-CB 4.04Å; Q421-A444 HydrophobicContact CG-CB 3.98Å; F422-A444 HydrophobicContact CE2-CB 3.72Å; F422-A444 HydrophobicContact CZ-CB 3.92Å; P440-A444 HydrophobicContact CB-CB 4.39Å; H441-A444 HydrophobicContact CB-CB 4.26Å; H441-A444 WeakPolarHBondContact O-CB 3.21Å; H441-A444 PolarHBondContact O-N 3.12Å
445	S	94.9	Very high	91.2	Very high	22 Å²	22	53.5 Å²	53.5	15%	0.154	33%	0.331	C	S	.	.			trans	-133.4	111.2	174.2	-179.1	0	0	0	0	110.3	F443 P447	F443-S445 VanDerWaalsContact C-N 3.34Å; S445-P447 VanDerWaalsContact C-CD 3.42Å
446	L	94.6	Very high	91.8	Very high	17 Å²	17	50.9 Å²	50.9	9%	0.089	30%	0.302	C	S	.	.			trans	-126.2	60.4	-178.3	-65.2	174.1	0	0	0	111.7	V94 L98 F443 F448 G449 F450	V94-L446 HydrophobicContact CG1-CD1 3.94Å; L98-L446 HydrophobicContact CD1-CD1 4.16Å; F443-L446 HydrophobicContact CB-CD1 4.16Å; F443-L446 HydrophobicContact CD1-CD1 3.74Å; F443-L446 HydrophobicContact CG-CD1 4.32Å; L446-F448 PolarHBondContact O-N 3.03Å; L446-F448 VanDerWaalsContact O-N 3.11Å; L446-G449 PolarHBondContact O-N 3.19Å; L446-F450 HydrophobicContact CD1-CB 4.37Å; L446-F450 HydrophobicContact CD2-CB 4.38Å
447	P	93.5	Very high	92.9	Very high	38 Å²	38	44.9 Å²	44.9	25%	0.247	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.7	-173	26.3	-35.6	0	0	0	113.8	L378 S445	L378-P447 HydrophobicContact CB-CB 3.67Å; L378-P447 HydrophobicContact CB-CG 3.88Å; L378-P447 HydrophobicContact CD1-CB 4.19Å; L378-P447 HydrophobicContact CD1-CG 4.17Å; L378-P447 HydrophobicContact CD2-CB 4.19Å; L378-P447 HydrophobicContact CG-CB 4.25Å; S445-P447 VanDerWaalsContact C-CD 3.42Å
448	F	95.6	Very high	93.8	Very high	32 Å²	32	46.9 Å²	46.9	14%	0.14	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	8.5	175.1	-65.3	-72.8	0	0	0	113.3	L378 L446 C455 R458 A461 E462	L378-F448 HydrophobicContact CD1-CE2 3.56Å; L378-F448 HydrophobicContact CD1-CZ 3.75Å; L446-F448 PolarHBondContact O-N 3.03Å; L446-F448 VanDerWaalsContact O-N 3.11Å; F448-C455 HydrophobicContact CB-CB 3.86Å; F448-C455 HydrophobicContact CD1-CB 3.79Å; F448-C455 HydrophobicContact CG-CB 4.32Å; F448-C455 WeakPolarHBondContact O-CB 3.41Å; F448-C455 PolarHBondContact O-N 3.49Å; F448-R458 HydrophobicContact CB-CB 4.41Å; F448-R458 HydrophobicContact CB-CG 4.19Å; F448-R458 HydrophobicContact CD1-CB 3.95Å; F448-R458 HydrophobicContact CD1-CG 3.94Å; F448-R458 HydrophobicContact CD2-CG 3.85Å; F448-R458 HydrophobicContact CE1-CB 4.39Å; F448-R458 HydrophobicContact CE1-CG 4.26Å; F448-R458 HydrophobicContact CE2-CG 4.16Å; F448-R458 HydrophobicContact CG-CB 4.11Å; F448-R458 HydrophobicContact CG-CG 3.72Å; F448-R458 HydrophobicContact CZ-CG 4.36Å; F448-A461 HydrophobicContact CE1-CB 4.26Å; F448-E462 HydrophobicContact CE2-CG 4.15Å; F448-E462 HydrophobicContact CZ-CG 4.17Å
449	G	94.3	Very high	94.3	Very high	12 Å²	12	46.3 Å²	46.3	12%	0.124	26%	0.255	C	S	.	.			trans	64.4	-168.7	-169	0	0	0	0	0	113.1	L446	L446-G449 PolarHBondContact O-N 3.19Å
450	F	94.7	Very high	94.5	Very high	87 Å²	87	40.7 Å²	40.7	38%	0.382	22%	0.22	S	C	.	.			trans	-139.2	164.5	-176.1	-174.6	-95	0	0	0	111.2	L98 R389 F443 L446	L98-F450 HydrophobicContact CB-CD1 4.08Å; L98-F450 HydrophobicContact CD1-CB 3.86Å; L98-F450 HydrophobicContact CD1-CD1 4.05Å; L98-F450 HydrophobicContact CD1-CG 4.22Å; L98-F450 HydrophobicContact CG-CD1 4.5Å; R389-F450 PolarHBondContact NH2-O 3.38Å; F443-F450 HydrophobicContact CE1-CB 4.47Å; F443-F450 AromaticContact CE1-CD1 3.79Å; F443-F450 HydrophobicContact CE1-CD1 3.79Å; F443-F450 AromaticContact CE1-CD2 3.9Å; F443-F450 HydrophobicContact CE1-CD2 3.9Å; F443-F450 AromaticContact CE1-CE1 3.94Å; F443-F450 HydrophobicContact CE1-CE1 3.94Å; F443-F450 HydrophobicContact CE1-CE2 4.04Å; F443-F450 AromaticContact CE1-CG 3.78Å; F443-F450 HydrophobicContact CE1-CG 3.78Å; F443-F450 HydrophobicContact CE1-CZ 4.06Å; F443-F450 HydrophobicContact CZ-CD1 4.24Å; F443-F450 HydrophobicContact CZ-CD2 4.08Å; F443-F450 AromaticContact CZ-CE1 3.92Å; F443-F450 HydrophobicContact CZ-CE1 3.92Å; F443-F450 AromaticContact CZ-CE2 3.74Å; F443-F450 HydrophobicContact CZ-CE2 3.74Å; F443-F450 HydrophobicContact CZ-CG 4.32Å; F443-F450 AromaticContact CZ-CZ 3.66Å; F443-F450 HydrophobicContact CZ-CZ 3.66Å; L446-F450 HydrophobicContact CD1-CB 4.37Å; L446-F450 HydrophobicContact CD2-CB 4.38Å
451	G	94.1	Very high	94.6	Very high	28 Å²	28	40.2 Å²	40.2	29%	0.289	22%	0.218	S	C	.	.	S	Bend	trans	78.2	-165	172.3	0	0	0	0	0	114.3	R453 S454	G451-R453 PolarHBondContact O-N 2.79Å; G451-S454 VanDerWaalsContact O-CB 3.3Å; G451-S454 WeakPolarHBondContact O-CB 3.44Å; G451-S454 PolarHBondContact O-N 3.02Å; G451-S454 VanDerWaalsContact O-N 3.09Å; G451-S454 PolarHBondContact O-OG 3.06Å
452	K	93.6	Very high	94.6	Very high	111 Å²	111	39.2 Å²	39.2	48%	0.483	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.6	-176.1	-64.6	-175.6	-179.2	-175.5	0	112.2	P103 P105 W134 R138	P103-K452 WeakPolarHBondContact O-CD 3.47Å; P103-K452 PolarHBondContact O-NZ 3.45Å; P105-K452 HydrophobicContact CG-CB 4.25Å; W134-K452 HydrophobicContact CH2-CB 4Å; R138-K452 VanDerWaalsContact CZ-O 3.25Å; R138-K452 PolarHBondContact NE-O 2.65Å; R138-K452 PolarHBondContact NH2-O 2.71Å
453	R	95.1	Very high	94.5	Very high	13 Å²	13	35 Å²	35	5%	0.049	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	35	176.1	-155.5	159.4	-175.5	-178.2	-2.5	112.5	P105 R107 A129 E130 W134 G451	P105-R453 HydrophobicContact CB-CB 4.04Å; P105-R453 HydrophobicContact CG-CB 4.12Å; P105-R453 WeakPolarHBondContact O-CD 3.24Å; P105-R453 PolarHBondContact O-NH1 3.41Å; R107-R453 PolarHBondContact NH2-O 2.82Å; A129-R453 PolarHBondContact O-NH2 2.99Å; E130-R453 VanDerWaalsContact CD-NH2 3.35Å; E130-R453 IonicContact OE1-CZ 2.85Å; E130-R453 IonicContact OE1-NH1 2.75Å; E130-R453 PolarHBondContact OE1-NH1 3.37Å; E130-R453 IonicContact OE1-NH2 3.99Å; E130-R453 PolarHBondContact OE1-NH2 3.2Å; E130-R453 IonicContact OE2-CZ 3.7Å; E130-R453 IonicContact OE2-NH1 3.14Å; E130-R453 PolarHBondContact OE2-NH1 3.43Å; E130-R453 IonicContact OE2-NH2 3.84Å; E130-R453 PolarHBondContact OE2-NH2 3.2Å; W134-R453 HydrophobicContact CH2-CB 4.09Å; W134-R453 HydrophobicContact CH2-CG 4.45Å; W134-R453 HydrophobicContact CZ2-CB 3.56Å; W134-R453 HydrophobicContact CZ2-CG 3.53Å; G451-R453 PolarHBondContact O-N 2.79Å
454	S	94.9	Very high	94.5	Very high	30 Å²	30	34.7 Å²	34.7	21%	0.21	18%	0.184	C	C	.	.	S	Bend	trans	-69.4	165	164.5	51.4	0	0	0	0	112.2	R138 G451 M456	R138-S454 VanDerWaalsContact CZ-O 3.31Å; R138-S454 PolarHBondContact NH1-O 3.37Å; R138-S454 PolarHBondContact NH2-O 2.98Å; R138-S454 PolarHBondContact NH2-OG 2.83Å; G451-S454 VanDerWaalsContact O-CB 3.3Å; G451-S454 WeakPolarHBondContact O-CB 3.44Å; G451-S454 PolarHBondContact O-N 3.02Å; G451-S454 VanDerWaalsContact O-N 3.09Å; G451-S454 PolarHBondContact O-OG 3.06Å; S454-M456 PolarHBondContact O-N 2.86Å
455	C	96.2	Very high	94.6	Very high	45 Å²	45	34.9 Å²	34.9	30%	0.304	19%	0.185	S	C	.	.			trans	-50.6	127.7	-178.7	-178.4	0	0	0	0	111.9	F448 R458	F448-C455 HydrophobicContact CB-CB 3.86Å; F448-C455 HydrophobicContact CD1-CB 3.79Å; F448-C455 HydrophobicContact CG-CB 4.32Å; F448-C455 WeakPolarHBondContact O-CB 3.41Å; F448-C455 PolarHBondContact O-N 3.49Å; C455-R458 HydrophobicContact CB-CB 4.36Å
456	M	94.9	Very high	94.6	Very high	13 Å²	13	34.4 Å²	34.4	6%	0.064	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-38.2	-178.9	-169.7	76.1	-90.7	0	0	112.5	L126 R138 L141 A142 L145 L146 S454 R458	L126-M456 HydrophobicContact CD2-CB 3.68Å; L126-M456 HydrophobicContact CD2-CG 3.54Å; L126-M456 HydrophobicContact CD2-SD 3.68Å; R138-M456 VanDerWaalsContact NH1-CA 3.32Å; R138-M456 PolarHBondContact NH1-SD 3.34Å; L141-M456 HydrophobicContact CB-SD 3.82Å; A142-M456 VanDerWaalsContact CA-CE 3.48Å; A142-M456 HydrophobicContact CB-CE 3.94Å; L145-M456 HydrophobicContact CB-CE 4.18Å; L145-M456 HydrophobicContact CB-CG 4.49Å; L145-M456 HydrophobicContact CD1-CG 3.75Å; L146-M456 HydrophobicContact CB-CE 4.35Å; L146-M456 HydrophobicContact CD1-CE 3.25Å; L146-M456 HydrophobicContact CD2-CE 4.03Å; L146-M456 WeakPolarHBondContact CD2-O 3.48Å; L146-M456 HydrophobicContact CG-CE 3.22Å; S454-M456 PolarHBondContact O-N 2.86Å; M456-R458 VanDerWaalsContact C-N 3.34Å; M456-R458 PolarHBondContact O-N 3.17Å
457	G	94.5	Very high	94.6	Very high	24 Å²	24	33.9 Å²	33.9	25%	0.247	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	13	-176.9	0	0	0	0	0	114.4	R459 L460 A461	G457-R459 PolarHBondContact O-N 3.41Å; G457-L460 PolarHBondContact O-N 3.28Å; G457-A461 WeakPolarHBondContact O-CB 3.19Å; G457-A461 PolarHBondContact O-N 3.08Å
458	R	95.3	Very high	94.7	Very high	96 Å²	96	32.1 Å²	32.1	36%	0.362	17%	0.166	S	C	.	.	H	α-helix	trans	-51.5	-51.4	-172.6	174.4	178.9	172.5	-178.8	0.6	112.8	L146 F448 C455 M456 A461 E462	L146-R458 HydrophobicContact CD2-CB 4.44Å; F448-R458 HydrophobicContact CB-CB 4.41Å; F448-R458 HydrophobicContact CB-CG 4.19Å; F448-R458 HydrophobicContact CD1-CB 3.95Å; F448-R458 HydrophobicContact CD1-CG 3.94Å; F448-R458 HydrophobicContact CD2-CG 3.85Å; F448-R458 HydrophobicContact CE1-CB 4.39Å; F448-R458 HydrophobicContact CE1-CG 4.26Å; F448-R458 HydrophobicContact CE2-CG 4.16Å; F448-R458 HydrophobicContact CG-CB 4.11Å; F448-R458 HydrophobicContact CG-CG 3.72Å; F448-R458 HydrophobicContact CZ-CG 4.36Å; C455-R458 HydrophobicContact CB-CB 4.36Å; M456-R458 VanDerWaalsContact C-N 3.34Å; M456-R458 PolarHBondContact O-N 3.17Å; R458-A461 PolarHBondContact O-N 3.06Å; R458-E462 HydrophobicContact CG-CG 4.4Å; R458-E462 IonicContact CZ-OE1 2.83Å; R458-E462 IonicContact NE-OE1 3.96Å; R458-E462 PolarHBondContact NE-OE1 3.37Å; R458-E462 IonicContact NE-OE2 3.06Å; R458-E462 IonicContact NH2-OE1 3.59Å; R458-E462 PolarHBondContact NH2-OE1 3.34Å; R458-E462 WeakPolarHBondContact O-CB 3.47Å; R458-E462 VanDerWaalsContact O-CG 3.31Å; R458-E462 WeakPolarHBondContact O-CG 3.38Å; R458-E462 PolarHBondContact O-N 2.87Å
459	R	93.3	Very high	94.8	Very high	89 Å²	89	30.6 Å²	30.6	34%	0.336	16%	0.159	S	C	.	.	H	α-helix	trans	-68.4	-38	-176.3	-63.1	-51	-172.4	179.8	6.3	112.3	L146 A151 G457 E462 L463	L146-R459 VanDerWaalsContact O-CG 3.31Å; L146-R459 WeakPolarHBondContact O-CG 3.4Å; A151-R459 HydrophobicContact CB-CB 3.65Å; G457-R459 PolarHBondContact O-N 3.41Å; R459-E462 WeakPolarHBondContact CD-OE2 3.15Å; R459-E462 IonicContact CZ-OE2 3.6Å; R459-E462 IonicContact NH1-OE2 3.81Å; R459-E462 PolarHBondContact NH1-OE2 3.29Å; R459-L463 VanDerWaalsContact O-CB 3.25Å; R459-L463 WeakPolarHBondContact O-CB 3.17Å; R459-L463 PolarHBondContact O-N 2.99Å
460	L	92.4	Very high	94.9	Very high	9 Å²	9	30 Å²	30	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-46.2	176.2	-172.5	67.4	0	0	0	111.3	Y154 L158 I198 V201 G457 L463 E464	Y154-L460 HydrophobicContact CD2-CD1 3.92Å; Y154-L460 HydrophobicContact CG-CD1 4.22Å; L158-L460 HydrophobicContact CD1-CD1 3.87Å; I198-L460 HydrophobicContact CD1-CD2 4.05Å; V201-L460 HydrophobicContact CB-CD2 4.31Å; V201-L460 HydrophobicContact CG1-CD1 4.46Å; V201-L460 HydrophobicContact CG1-CD2 3.84Å; V201-L460 HydrophobicContact CG2-CD1 3.98Å; V201-L460 HydrophobicContact CG2-CD2 4.15Å; G457-L460 PolarHBondContact O-N 3.28Å; L460-L463 WeakPolarHBondContact O-CB 3.33Å; L460-L463 PolarHBondContact O-N 3.41Å; L460-E464 WeakPolarHBondContact O-CB 3.36Å; L460-E464 PolarHBondContact O-N 2.97Å
461	A	95.1	Very high	94.8	Very high	12 Å²	12	26.1 Å²	26.1	10%	0.099	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-44.2	177.9	0	0	0	0	0	112.2	V322 F448 G457 R458 L463 E464 L465	V322-A461 HydrophobicContact CG2-CB 3.99Å; F448-A461 HydrophobicContact CE1-CB 4.26Å; G457-A461 WeakPolarHBondContact O-CB 3.19Å; G457-A461 PolarHBondContact O-N 3.08Å; R458-A461 PolarHBondContact O-N 3.06Å; A461-L463 VanDerWaalsContact C-N 3.31Å; A461-L463 PolarHBondContact O-N 3.35Å; A461-E464 PolarHBondContact O-N 2.93Å; A461-L465 VanDerWaalsContact O-CB 3.31Å; A461-L465 WeakPolarHBondContact O-CB 3.23Å; A461-L465 WeakPolarHBondContact O-CD1 3.16Å; A461-L465 WeakPolarHBondContact O-CG 3.31Å; A461-L465 PolarHBondContact O-N 3.16Å
462	E	95.1	Very high	94.9	Very high	33 Å²	33	24.8 Å²	24.8	15%	0.154	12%	0.123	C	C	.	.	H	α-helix	trans	-57.5	-46.1	174.3	-76.4	171.8	168.9	0	0	110.7	F448 R458 R459 Q466	F448-E462 HydrophobicContact CE2-CG 4.15Å; F448-E462 HydrophobicContact CZ-CG 4.17Å; R458-E462 HydrophobicContact CG-CG 4.4Å; R458-E462 IonicContact CZ-OE1 2.83Å; R458-E462 IonicContact NE-OE1 3.96Å; R458-E462 PolarHBondContact NE-OE1 3.37Å; R458-E462 IonicContact NE-OE2 3.06Å; R458-E462 IonicContact NH2-OE1 3.59Å; R458-E462 PolarHBondContact NH2-OE1 3.34Å; R458-E462 WeakPolarHBondContact O-CB 3.47Å; R458-E462 VanDerWaalsContact O-CG 3.31Å; R458-E462 WeakPolarHBondContact O-CG 3.38Å; R458-E462 PolarHBondContact O-N 2.87Å; R459-E462 WeakPolarHBondContact CD-OE2 3.15Å; R459-E462 IonicContact CZ-OE2 3.6Å; R459-E462 IonicContact NH1-OE2 3.81Å; R459-E462 PolarHBondContact NH1-OE2 3.29Å; E462-Q466 WeakPolarHBondContact O-CB 3.17Å; E462-Q466 VanDerWaalsContact O-CD 3.29Å; E462-Q466 WeakPolarHBondContact O-CG 3.06Å; E462-Q466 PolarHBondContact O-N 3.41Å
463	L	92.8	Very high	95	Very high	13 Å²	13	19.5 Å²	19.5	7%	0.068	10%	0.1	C	C	.	.	H	α-helix	trans	-61.9	-51.5	177.8	173.7	62.4	0	0	0	111.9	A151 L158 A361 R459 L460 A461 L465 Q466 M467	A151-L463 WeakPolarHBondContact O-CD2 3.2Å; L158-L463 HydrophobicContact CD1-CD2 3.95Å; L158-L463 HydrophobicContact CD1-CG 4.11Å; A361-L463 HydrophobicContact CB-CD1 3.46Å; A361-L463 VanDerWaalsContact CB-CD1 3.46Å; R459-L463 VanDerWaalsContact O-CB 3.25Å; R459-L463 WeakPolarHBondContact O-CB 3.17Å; R459-L463 PolarHBondContact O-N 2.99Å; L460-L463 WeakPolarHBondContact O-CB 3.33Å; L460-L463 PolarHBondContact O-N 3.41Å; A461-L463 VanDerWaalsContact C-N 3.31Å; A461-L463 PolarHBondContact O-N 3.35Å; L463-L465 PolarHBondContact O-N 3.3Å; L463-Q466 PolarHBondContact O-N 3.02Å; L463-M467 HydrophobicContact CD1-CG 4Å; L463-M467 HydrophobicContact CD1-SD 3.62Å; L463-M467 HydrophobicContact CG-SD 3.88Å; L463-M467 WeakPolarHBondContact O-CB 2.99Å; L463-M467 VanDerWaalsContact O-CG 3.28Å; L463-M467 WeakPolarHBondContact O-CG 3.46Å; L463-M467 PolarHBondContact O-N 3.42Å
464	E	94.3	Very high	94.9	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.019	11%	0.105	C	C	.	.	H	α-helix	trans	-61.4	-43.1	-178.1	-172.3	173	-166.6	0	0	111.9	L158 F193 V322 L460 A461 A468	L158-E464 HydrophobicContact CD1-CB 4.24Å; L158-E464 HydrophobicContact CD2-CG 4.29Å; F193-E464 HydrophobicContact CE1-CG 3.84Å; F193-E464 HydrophobicContact CZ-CG 3.7Å; V322-E464 HydrophobicContact CG1-CG 3.99Å; L460-E464 WeakPolarHBondContact O-CB 3.36Å; L460-E464 PolarHBondContact O-N 2.97Å; A461-E464 PolarHBondContact O-N 2.93Å; E464-A468 VanDerWaalsContact O-CB 3.28Å; E464-A468 WeakPolarHBondContact O-CB 3Å; E464-A468 PolarHBondContact O-N 2.89Å
465	L	96.8	Very high	94.9	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-44.5	175.8	-72.2	167.3	0	0	0	112.1	V322 T325 L326 V374 A461 L463 A468 L469	V322-L465 HydrophobicContact CG1-CD2 3.96Å; V322-L465 HydrophobicContact CG1-CG 4.25Å; T325-L465 HydrophobicContact CG2-CD1 3.62Å; T325-L465 HydrophobicContact CG2-CD2 3.95Å; T325-L465 HydrophobicContact CG2-CG 4.46Å; L326-L465 HydrophobicContact CB-CD2 3.94Å; V374-L465 HydrophobicContact CG1-CD1 4.14Å; V374-L465 HydrophobicContact CG2-CB 4.44Å; A461-L465 VanDerWaalsContact O-CB 3.31Å; A461-L465 WeakPolarHBondContact O-CB 3.23Å; A461-L465 WeakPolarHBondContact O-CD1 3.16Å; A461-L465 WeakPolarHBondContact O-CG 3.31Å; A461-L465 PolarHBondContact O-N 3.16Å; L463-L465 PolarHBondContact O-N 3.3Å; L465-A468 PolarHBondContact O-N 3.39Å; L465-L469 VanDerWaalsContact O-CB 3.31Å; L465-L469 WeakPolarHBondContact O-CB 3.38Å; L465-L469 VanDerWaalsContact O-CG 3.29Å; L465-L469 WeakPolarHBondContact O-CG 3.2Å; L465-L469 PolarHBondContact O-N 3.31Å
466	Q	95.7	Very high	94.9	Very high	13 Å²	13	19.3 Å²	19.3	6%	0.061	9%	0.092	C	C	.	.	H	α-helix	trans	-64.6	-44	179.5	-74.1	167.1	6.2	0	0	111.5	L370 E462 L463 A470	L370-Q466 HydrophobicContact CD2-CB 3.91Å; L370-Q466 HydrophobicContact CD2-CG 4.04Å; L370-Q466 HydrophobicContact CG-CB 4.43Å; L370-Q466 HydrophobicContact CG-CG 4.1Å; E462-Q466 WeakPolarHBondContact O-CB 3.17Å; E462-Q466 VanDerWaalsContact O-CD 3.29Å; E462-Q466 WeakPolarHBondContact O-CG 3.06Å; E462-Q466 PolarHBondContact O-N 3.41Å; L463-Q466 PolarHBondContact O-N 3.02Å; Q466-A470 VanDerWaalsContact O-CB 3.23Å; Q466-A470 WeakPolarHBondContact O-CB 3.07Å; Q466-A470 PolarHBondContact O-N 3.48Å
467	M	94.5	Very high	95.1	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.03	10%	0.103	C	C	.	.	H	α-helix	trans	-63.6	-47.6	176.3	-69.1	178.1	69.2	0	0	111.4	T155 L158 D159 V162 A361 L364 L463 A470 Q471	T155-M467 HydrophobicContact CG2-CE 4.21Å; T155-M467 HydrophobicContact CG2-SD 4.42Å; L158-M467 HydrophobicContact CB-CE 4.12Å; L158-M467 HydrophobicContact CB-SD 4.04Å; D159-M467 HydrophobicContact CB-CE 3.78Å; V162-M467 HydrophobicContact CG2-CB 4.07Å; A361-M467 HydrophobicContact CB-SD 4.29Å; L364-M467 HydrophobicContact CD1-CB 4.43Å; L364-M467 HydrophobicContact CD1-CG 3.93Å; L463-M467 HydrophobicContact CD1-CG 4Å; L463-M467 HydrophobicContact CD1-SD 3.62Å; L463-M467 HydrophobicContact CG-SD 3.88Å; L463-M467 WeakPolarHBondContact O-CB 2.99Å; L463-M467 VanDerWaalsContact O-CG 3.28Å; L463-M467 WeakPolarHBondContact O-CG 3.46Å; L463-M467 PolarHBondContact O-N 3.42Å; M467-A470 PolarHBondContact O-N 3.48Å; M467-Q471 WeakPolarHBondContact O-CB 3.31Å; M467-Q471 VanDerWaalsContact O-CG 3.23Å; M467-Q471 WeakPolarHBondContact O-CG 3.49Å; M467-Q471 PolarHBondContact O-N 3.3Å
468	A	96.3	Very high	95.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62	-48.5	179.5	0	0	0	0	0	112.2	V162 L165 F193 L326 E464 L465 Q471 I472	V162-A468 HydrophobicContact CG2-CB 4.48Å; L165-A468 HydrophobicContact CD2-CB 4.45Å; F193-A468 HydrophobicContact CE1-CB 4.01Å; F193-A468 HydrophobicContact CZ-CB 3.85Å; L326-A468 HydrophobicContact CD1-CB 4.11Å; L326-A468 HydrophobicContact CD2-CB 3.88Å; E464-A468 VanDerWaalsContact O-CB 3.28Å; E464-A468 WeakPolarHBondContact O-CB 3Å; E464-A468 PolarHBondContact O-N 2.89Å; L465-A468 PolarHBondContact O-N 3.39Å; A468-Q471 PolarHBondContact O-N 3.09Å; A468-I472 WeakPolarHBondContact O-CB 3.5Å; A468-I472 VanDerWaalsContact O-CG1 3.23Å; A468-I472 WeakPolarHBondContact O-CG1 3.4Å; A468-I472 PolarHBondContact O-N 2.93Å
469	L	97.3	Very high	95.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.3	-46.4	178.1	-75.6	171.8	0	0	0	111.7	L326 A329 L330 L333 L370 V374 L465 Q471 I472 L473	L326-L469 HydrophobicContact CD1-CD2 3.66Å; L326-L469 HydrophobicContact CD1-CG 3.82Å; A329-L469 HydrophobicContact CB-CD1 4.18Å; A329-L469 HydrophobicContact CB-CD2 3.87Å; L330-L469 HydrophobicContact CD2-CD2 3.8Å; L330-L469 HydrophobicContact CG-CD2 4.05Å; L333-L469 HydrophobicContact CD1-CD2 4.12Å; L370-L469 HydrophobicContact CD1-CB 3.97Å; L370-L469 HydrophobicContact CD1-CD1 4.16Å; V374-L469 HydrophobicContact CG2-CD1 3.82Å; L465-L469 VanDerWaalsContact O-CB 3.31Å; L465-L469 WeakPolarHBondContact O-CB 3.38Å; L465-L469 VanDerWaalsContact O-CG 3.29Å; L465-L469 WeakPolarHBondContact O-CG 3.2Å; L465-L469 PolarHBondContact O-N 3.31Å; L469-Q471 VanDerWaalsContact C-N 3.32Å; L469-Q471 PolarHBondContact O-N 3.02Å; L469-I472 PolarHBondContact O-N 3.38Å; L469-L473 WeakPolarHBondContact O-CB 3.42Å; L469-L473 VanDerWaalsContact O-CG 3.26Å; L469-L473 WeakPolarHBondContact O-CG 3.41Å; L469-L473 PolarHBondContact O-N 3.4Å
470	A	95.2	Very high	95.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.3	-46.3	179.4	0	0	0	0	0	111.4	I347 L364 Q466 M467 L473 I474	I347-A470 HydrophobicContact CD1-CB 4.27Å; I347-A470 HydrophobicContact CG1-CB 4.42Å; I347-A470 HydrophobicContact CG2-CB 4.15Å; L364-A470 HydrophobicContact CD1-CB 3.97Å; L364-A470 HydrophobicContact CD2-CB 3.55Å; L364-A470 HydrophobicContact CG-CB 4.42Å; Q466-A470 VanDerWaalsContact O-CB 3.23Å; Q466-A470 WeakPolarHBondContact O-CB 3.07Å; Q466-A470 PolarHBondContact O-N 3.48Å; M467-A470 PolarHBondContact O-N 3.48Å; A470-L473 PolarHBondContact O-N 2.88Å; A470-I474 WeakPolarHBondContact O-CB 3.34Å; A470-I474 WeakPolarHBondContact O-CD1 2.88Å; A470-I474 WeakPolarHBondContact O-CG1 3.44Å; A470-I474 PolarHBondContact O-N 2.72Å
471	Q	93.6	Very high	95.6	Very high	5 Å²	5	19.1 Å²	19.1	2%	0.023	10%	0.097	C	C	.	.	H	α-helix	trans	-68.7	-38.6	-178.2	-72	-56.8	-44.1	0	0	113.9	V162 V166 H358 M467 A468 L469 H475	V162-Q471 HydrophobicContact CG1-CB 3.39Å; V162-Q471 HydrophobicContact CG1-CG 3.43Å; V162-Q471 VanDerWaalsContact CG1-CG 3.43Å; V166-Q471 HydrophobicContact CG2-CB 4.02Å; H358-Q471 VanDerWaalsContact CE1-CD 3.49Å; H358-Q471 PolarHBondContact CE1-OE1 3.23Å; H358-Q471 PolarHBondContact ND1-NE2 3Å; H358-Q471 PolarHBondContact ND1-OE1 2.98Å; M467-Q471 WeakPolarHBondContact O-CB 3.31Å; M467-Q471 VanDerWaalsContact O-CG 3.23Å; M467-Q471 WeakPolarHBondContact O-CG 3.49Å; M467-Q471 PolarHBondContact O-N 3.3Å; A468-Q471 PolarHBondContact O-N 3.09Å; L469-Q471 VanDerWaalsContact C-N 3.32Å; L469-Q471 PolarHBondContact O-N 3.02Å; Q471-H475 PolarHBondContact O-CD2 2.92Å; Q471-H475 VanDerWaalsContact O-CD2 3.23Å; Q471-H475 PolarHBondContact O-N 3.01Å
472	I	96.5	Very high	95.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.6	-45.7	174.8	-70	169	0	0	0	109.9	L165 L169 F190 L330 A468 L469 H475 F476 V478 F505	L165-I472 HydrophobicContact CD2-CD1 4.02Å; L169-I472 HydrophobicContact CD1-CD1 4.01Å; L169-I472 HydrophobicContact CD1-CG1 3.96Å; F190-I472 HydrophobicContact CE1-CD1 4.35Å; L330-I472 HydrophobicContact CD1-CD1 3.73Å; L330-I472 HydrophobicContact CD1-CG2 4.18Å; L330-I472 HydrophobicContact CD2-CG2 3.97Å; A468-I472 WeakPolarHBondContact O-CB 3.5Å; A468-I472 VanDerWaalsContact O-CG1 3.23Å; A468-I472 WeakPolarHBondContact O-CG1 3.4Å; A468-I472 PolarHBondContact O-N 2.93Å; L469-I472 PolarHBondContact O-N 3.38Å; I472-H475 PolarHBondContact O-N 2.99Å; I472-F476 HydrophobicContact CG2-CD2 4.21Å; I472-F476 WeakPolarHBondContact O-CA 3.04Å; I472-F476 WeakPolarHBondContact O-CB 3.37Å; I472-F476 WeakPolarHBondContact O-CD2 3.21Å; I472-F476 PolarHBondContact O-N 3.3Å; I472-V478 HydrophobicContact CG2-CG2 4.05Å; I472-F505 HydrophobicContact CG2-CD1 4.29Å; I472-F505 HydrophobicContact CG2-CE1 3.92Å
473	L	96.1	Very high	95	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-74.6	-27.2	-176	-65.7	176	0	0	0	113.8	L333 Q340 L343 H344 I347 L469 A470 H475 V478 R508	L333-L473 HydrophobicContact CD1-CD1 4.09Å; Q340-L473 HydrophobicContact CG-CD2 3.71Å; L343-L473 HydrophobicContact CB-CD1 4.48Å; L343-L473 HydrophobicContact CD2-CD1 3.34Å; L343-L473 HydrophobicContact CG-CD1 3.74Å; H344-L473 PolarHBondContact CD2-O 3.19Å; I347-L473 HydrophobicContact CD1-CB 4.16Å; I347-L473 HydrophobicContact CD1-CD1 4.08Å; L469-L473 WeakPolarHBondContact O-CB 3.42Å; L469-L473 VanDerWaalsContact O-CG 3.26Å; L469-L473 WeakPolarHBondContact O-CG 3.41Å; L469-L473 PolarHBondContact O-N 3.4Å; A470-L473 PolarHBondContact O-N 2.88Å; L473-H475 VanDerWaalsContact C-N 3.28Å; L473-V478 HydrophobicContact CD2-CG2 4.47Å; L473-R508 WeakPolarHBondContact O-CD 3.06Å
474	I	92.9	Very high	94.8	Very high	31 Å²	31	27.1 Å²	27.1	16%	0.159	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-39.9	170.2	-75.4	162.5	0	0	0	110.7	I347 L351 P359 A470	I347-I474 HydrophobicContact CG2-CD1 3.71Å; I347-I474 HydrophobicContact CG2-CG1 3.64Å; L351-I474 HydrophobicContact CD1-CD1 4.11Å; L351-I474 HydrophobicContact CD1-CG1 4.3Å; P359-I474 HydrophobicContact CG-CD1 4.14Å; A470-I474 WeakPolarHBondContact O-CB 3.34Å; A470-I474 WeakPolarHBondContact O-CD1 2.88Å; A470-I474 WeakPolarHBondContact O-CG1 3.44Å; A470-I474 PolarHBondContact O-N 2.72Å
475	H	93.9	Very high	94.7	Very high	54 Å²	54	29.4 Å²	29.4	25%	0.25	19%	0.192	C	C	.	.	H	α-helix	trans	-97.4	-21.3	-172.8	-72.8	-56	0	0	0	114.4	V166 R170 Q471 I472 L473 R508	V166-H475 HydrophobicContact CG1-CB 4.21Å; R170-H475 VanDerWaalsContact NH2-CG 3.3Å; R170-H475 PolarHBondContact NH2-ND1 3.4Å; R170-H475 VanDerWaalsContact NH2-ND1 3.18Å; Q471-H475 PolarHBondContact O-CD2 2.92Å; Q471-H475 VanDerWaalsContact O-CD2 3.23Å; Q471-H475 PolarHBondContact O-N 3.01Å; I472-H475 PolarHBondContact O-N 2.99Å; L473-H475 VanDerWaalsContact C-N 3.28Å; H475-R508 PolarHBondContact O-N 3.02Å; H475-R508 VanDerWaalsContact O-N 3.09Å
476	F	97.1	Very high	94.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.9	-172.5	-52.3	-69.7	0	0	0	113.3	V166 L169 R170 I472 V478 F505 L506 D507 R508	V166-F476 HydrophobicContact CG1-CE2 3.9Å; V166-F476 HydrophobicContact CG1-CZ 4.18Å; L169-F476 HydrophobicContact CB-CE2 4.3Å; L169-F476 HydrophobicContact CB-CZ 4.45Å; L169-F476 HydrophobicContact CD1-CE2 4.41Å; R170-F476 HydrophobicContact CG-CE1 3.94Å; R170-F476 HydrophobicContact CG-CZ 3.56Å; I472-F476 HydrophobicContact CG2-CD2 4.21Å; I472-F476 WeakPolarHBondContact O-CA 3.04Å; I472-F476 WeakPolarHBondContact O-CB 3.37Å; I472-F476 WeakPolarHBondContact O-CD2 3.21Å; I472-F476 PolarHBondContact O-N 3.3Å; F476-V478 HydrophobicContact CB-CG2 4.43Å; F476-F505 HydrophobicContact CB-CB 4.27Å; F476-F505 HydrophobicContact CB-CD1 4.1Å; F476-F505 HydrophobicContact CD1-CB 3.88Å; F476-F505 AromaticContact CD2-CD1 3.98Å; F476-F505 HydrophobicContact CD2-CD1 3.98Å; F476-F505 HydrophobicContact CE1-CB 4.37Å; F476-F505 HydrophobicContact CG-CB 4Å; F476-F505 HydrophobicContact CG-CD1 4.02Å; F476-L506 CarbonylContact C-O 3.48Å; F476-L506 WeakPolarHBondContact CA-O 3.26Å; F476-D507 WeakPolarHBondContact CE1-OD1 3.14Å; F476-R508 PolarHBondContact O-NE 2.98Å
477	E	98	Very high	94.4	Very high	63 Å²	63	33.6 Å²	33.6	29%	0.294	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.2	152.2	-177.7	171.9	143.3	0	0	108.6	Q479 L506 R508	E477-Q479 HydrophobicContact CG-CG 4.41Å; E477-Q479 PolarHBondContact OE1-NE2 2.95Å; E477-L506 HydrophobicContact CB-CB 4.26Å; E477-L506 PolarHBondContact N-O 2.75Å; E477-L506 PolarHBondContact O-N 3.47Å; E477-R508 HydrophobicContact CB-CG 4.28Å; E477-R508 IonicContact OE2-CZ 3.38Å; E477-R508 IonicContact OE2-NH1 3.78Å; E477-R508 PolarHBondContact OE2-NH1 3.38Å; E477-R508 IonicContact OE2-NH2 3.38Å
478	V	98.3	Very high	94.4	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.8	-177.8	-171.8	0	0	0	0	109.5	L330 S334 Q340 I472 L473 F476 L503 Q504 F505	L330-V478 HydrophobicContact CD2-CG2 4.25Å; S334-V478 WeakPolarHBondContact CA-O 3.37Å; Q340-V478 PolarHBondContact NE2-O 3.41Å; I472-V478 HydrophobicContact CG2-CG2 4.05Å; L473-V478 HydrophobicContact CD2-CG2 4.47Å; F476-V478 HydrophobicContact CB-CG2 4.43Å; V478-L503 HydrophobicContact CG1-CB 3.98Å; V478-L503 HydrophobicContact CG1-CD1 3.91Å; V478-L503 HydrophobicContact CG1-CD2 4.46Å; V478-L503 HydrophobicContact CG1-CG 4.33Å; V478-Q504 CarbonylContact C-O 3.53Å; V478-Q504 VanDerWaalsContact CA-O 3.28Å; V478-Q504 WeakPolarHBondContact CA-O 3.46Å; V478-F505 HydrophobicContact CG1-CE1 4.44Å; V478-F505 HydrophobicContact CG2-CD1 3.93Å; V478-F505 HydrophobicContact CG2-CE1 3.96Å
479	Q	97.4	Very high	94.3	Very high	65 Å²	65	41.8 Å²	41.8	30%	0.304	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	154.1	178.8	-66.8	-176.4	-2.6	0	0	110.9	E477 Q504 L506	E477-Q479 HydrophobicContact CG-CG 4.41Å; E477-Q479 PolarHBondContact OE1-NE2 2.95Å; Q479-Q504 HydrophobicContact CB-CB 4.15Å; Q479-Q504 PolarHBondContact N-O 3.06Å; Q479-Q504 PolarHBondContact O-N 3Å; Q479-L506 HydrophobicContact CG-CD1 4.06Å; Q479-L506 VanDerWaalsContact NE2-CD1 3.33Å
480	P	96.3	Very high	94.1	Very high	53 Å²	53	44 Å²	44	34%	0.344	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	159.2	176.6	29.5	-35.7	0	0	0	110.5	S334 Q504	S334-P480 VanDerWaalsContact O-CD 3.29Å; S334-P480 WeakPolarHBondContact O-CD 3.45Å; P480-Q504 PolarHBondContact O-NE2 3.19Å
481	E	94.4	Very high	93.7	Very high	45 Å²	45	44.4 Å²	44.4	21%	0.21	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-60.4	130.3	164.9	175.3	175.1	-133.7	0	0	109.8	L182 G483 A484 N502	L182-E481 HydrophobicContact CD1-CB 3.99Å; L182-E481 HydrophobicContact CD1-CG 4.12Å; E481-G483 PolarHBondContact O-N 3.38Å; E481-A484 HydrophobicContact CB-CB 3.93Å; E481-A484 HydrophobicContact CG-CB 4.34Å; E481-A484 VanDerWaalsContact O-CB 3.24Å; E481-A484 WeakPolarHBondContact O-CB 2.93Å; E481-A484 PolarHBondContact O-N 2.9Å; E481-A484 VanDerWaalsContact O-N 3.08Å; E481-N502 HydrophobicContact CB-CB 4.02Å; E481-N502 HydrophobicContact CG-CB 4.48Å; E481-N502 WeakPolarHBondContact OE2-CB 3.29Å; E481-N502 PolarHBondContact OE2-ND2 3.3Å
482	P	90.3	Very high	93.2	Very high	85 Å²	85	47.8 Å²	47.8	55%	0.552	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	128.5	-178.5	-24.6	35.2	0	0	0	111.7	P179 A484	P179-P482 HydrophobicContact CG-CG 4.15Å; P482-A484 PolarHBondContact O-N 3.44Å
483	G	88.1	Confident	92.5	Very high	88 Å²	88	49.6 Å²	49.6	91%	0.907	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	7.2	-179.8	0	0	0	0	0	115.1	E481 A485	E481-G483 PolarHBondContact O-N 3.38Å; G483-A485 PolarHBondContact O-N 2.77Å
484	A	88.4	Confident	92.1	Very high	52 Å²	52	50 Å²	50	43%	0.43	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-68	129.1	177.9	0	0	0	0	0	111.9	E481 P482	E481-A484 HydrophobicContact CB-CB 3.93Å; E481-A484 HydrophobicContact CG-CB 4.34Å; E481-A484 VanDerWaalsContact O-CB 3.24Å; E481-A484 WeakPolarHBondContact O-CB 2.93Å; E481-A484 PolarHBondContact O-N 2.9Å; E481-A484 VanDerWaalsContact O-N 3.08Å; P482-A484 PolarHBondContact O-N 3.44Å
485	A	91.1	Very high	92.1	Very high	53 Å²	53	48.6 Å²	48.6	44%	0.438	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-70.1	152.1	173.2	0	0	0	0	0	111.3	G483 I487	G483-A485 PolarHBondContact O-N 2.77Å; A485-I487 PolarHBondContact O-N 3.42Å
486	P	92.8	Very high	92	Very high	85 Å²	85	46.4 Å²	46.4	55%	0.552	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-53.1	139.6	175	-26.9	34.8	0	0	0	112.6	Y331 R499	Y331-P486 WeakPolarHBondContact OH-CA 3.26Å; P486-R499 PolarHBondContact O-NH2 3.43Å
487	I	95	Very high	91.9	Very high	19 Å²	19	47.3 Å²	47.3	10%	0.097	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-98.4	126.2	-178.9	-61.1	171.4	0	0	0	107.9	W328 Y331 A485 P497 I501	W328-I487 HydrophobicContact CH2-CG2 4.12Å; Y331-I487 HydrophobicContact CD2-CD1 4.36Å; Y331-I487 HydrophobicContact CE2-CB 4.24Å; Y331-I487 HydrophobicContact CE2-CD1 3.91Å; Y331-I487 HydrophobicContact CE2-CG1 4.14Å; Y331-I487 PolarHBondContact OH-N 3.32Å; A485-I487 PolarHBondContact O-N 3.42Å; I487-P497 HydrophobicContact CG2-CB 3.93Å; I487-I501 HydrophobicContact CD1-CB 4.22Å; I487-I501 HydrophobicContact CD1-CG1 3.61Å
488	R	93.8	Very high	91.6	Very high	166 Å²	166	48.5 Å²	48.5	63%	0.626	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-89.8	150.5	176.6	-64.3	-179.1	178	178	-0.5	110	E498	R488-E498 WeakPolarHBondContact O-CB 3.48Å; R488-E498 PolarHBondContact O-N 3.05Å
489	P	94.6	Very high	91.4	Very high	13 Å²	13	54.6 Å²	54.6	8%	0.084	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	155.2	169.1	31.2	-33.7	0	0	0	111.1	R60 H62 W328 Y381 L495 V496	R60-P489 PolarHBondContact NH1-O 2.97Å; H62-P489 PolarHBondContact CE1-O 3.18Å; W328-P489 HydrophobicContact CH2-CB 4.42Å; W328-P489 HydrophobicContact CZ2-CB 3.99Å; Y381-P489 HydrophobicContact CD1-CB 4.46Å; P489-L495 HydrophobicContact CB-CD1 3.85Å; P489-L495 HydrophobicContact CB-CD2 3.92Å; P489-L495 HydrophobicContact CB-CG 3.77Å; P489-V496 CarbonylContact C-O 3.59Å; P489-V496 WeakPolarHBondContact CA-O 3.41Å
490	M	91.9	Very high	91.2	Very high	45 Å²	45	54.6 Å²	54.6	22%	0.222	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.4	168.9	66.4	170.8	-92.7	0	0	110.2	S59 R492 L495 V496 E498	S59-M490 CarbonylContact O-C 3.45Å; S59-M490 WeakPolarHBondContact O-CA 3.45Å; M490-R492 HydrophobicContact CE-CB 4.24Å; M490-L495 WeakPolarHBondContact O-CA 3.49Å; M490-V496 HydrophobicContact CE-CG2 4.27Å; M490-V496 HydrophobicContact CG-CG2 3.52Å; M490-V496 PolarHBondContact N-O 3.02Å; M490-V496 PolarHBondContact O-N 3.49Å; M490-V496 HydrophobicContact SD-CG2 4.23Å; M490-E498 HydrophobicContact CB-CB 4.34Å; M490-E498 HydrophobicContact CG-CB 4.3Å; M490-E498 HydrophobicContact SD-CB 4.4Å
491	T	87.9	Confident	91.2	Very high	10 Å²	10	52 Å²	52	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.2	177.3	-59	0	0	0	0	110.8	S59 L61 H62	S59-T491 WeakPolarHBondContact CA-O 3.47Å; S59-T491 PolarHBondContact O-N 2.83Å; L61-T491 HydrophobicContact CB-CG2 4.27Å; L61-T491 HydrophobicContact CD1-CG2 4.4Å; H62-T491 PolarHBondContact ND1-OG1 3.17Å
492	R	81.9	Confident	91.3	Very high	75 Å²	75	51.2 Å²	51.2	28%	0.283	30%	0.296	S	S	.	.	S	Bend	trans	-130.8	61.3	169.8	-168.5	-174.6	71.4	-169.2	1.1	108.5	V230 D320 M490 V494 V496	V230-R492 HydrophobicContact CG2-CG 3.59Å; D320-R492 IonicContact OD2-NH2 3.35Å; M490-R492 HydrophobicContact CE-CB 4.24Å; R492-V494 PolarHBondContact N-O 3.24Å; R492-V494 PolarHBondContact O-N 3.24Å; R492-V496 HydrophobicContact CB-CG2 4.26Å
493	T	82.1	Confident	91.6	Very high	38 Å²	38	47.2 Å²	47.2	23%	0.233	27%	0.27	C	S	.	.	S	Bend	trans	70.3	-49.8	-162.5	-51.6	0	0	0	0	112.7	F229 L233	F229-T493 HydrophobicContact CD1-CG2 3.77Å; F229-T493 HydrophobicContact CE1-CG2 4.33Å; F229-T493 PolarHBondContact O-OG1 3.45Å; L233-T493 WeakPolarHBondContact CD1-OG1 3.42Å; L233-T493 VanDerWaalsContact CG-OG1 3.27Å; L233-T493 WeakPolarHBondContact CG-OG1 3.27Å
494	V	88.7	Confident	92	Very high	10 Å²	10	44 Å²	44	6%	0.061	23%	0.231	C	C	.	.	S	Bend	trans	-101.6	162.4	167.6	-66.9	0	0	0	0	110.6	D320 V383 R492 V496	D320-V494 HydrophobicContact CB-CG2 4.33Å; V383-V494 HydrophobicContact CG1-CB 3.88Å; V383-V494 HydrophobicContact CG1-CG1 3.79Å; V383-V494 CarbonylContact O-C 3.46Å; V383-V494 WeakPolarHBondContact O-CA 3.35Å; V383-V494 WeakPolarHBondContact O-CB 3.38Å; R492-V494 PolarHBondContact N-O 3.24Å; R492-V494 PolarHBondContact O-N 3.24Å; V494-V496 HydrophobicContact CG2-CG1 3.81Å
495	L	92	Very high	92.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.4	174.4	-158.2	72.9	0	0	0	110	H62 P382 V383 P385 Y413 P489 M490	H62-L495 HydrophobicContact CB-CD1 4.04Å; P382-L495 WeakPolarHBondContact O-CB 3.4Å; V383-L495 PolarHBondContact O-N 3.28Å; P385-L495 HydrophobicContact CG-CB 3.95Å; P385-L495 HydrophobicContact CG-CD1 3.87Å; P385-L495 HydrophobicContact CG-CG 4.39Å; Y413-L495 HydrophobicContact CD2-CD2 4.25Å; Y413-L495 HydrophobicContact CE2-CD2 4.05Å; P489-L495 HydrophobicContact CB-CD1 3.85Å; P489-L495 HydrophobicContact CB-CD2 3.92Å; P489-L495 HydrophobicContact CB-CG 3.77Å; M490-L495 WeakPolarHBondContact O-CA 3.49Å
496	V	92.6	Very high	92.8	Very high	8 Å²	8	41.6 Å²	41.6	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	161.9	-178.3	-54	0	0	0	0	110.6	P489 M490 R492 V494	P489-V496 CarbonylContact C-O 3.59Å; P489-V496 WeakPolarHBondContact CA-O 3.41Å; M490-V496 HydrophobicContact CE-CG2 4.27Å; M490-V496 HydrophobicContact CG-CG2 3.52Å; M490-V496 PolarHBondContact N-O 3.02Å; M490-V496 PolarHBondContact O-N 3.49Å; M490-V496 HydrophobicContact SD-CG2 4.23Å; R492-V496 HydrophobicContact CB-CG2 4.26Å; V494-V496 HydrophobicContact CG2-CG1 3.81Å
497	P	94.1	Very high	92.9	Very high	18 Å²	18	42 Å²	42	12%	0.117	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.3	169.1	-20.7	33.5	0	0	0	111.8	N324 W328 I487 R499 I501	N324-P497 WeakPolarHBondContact OD1-CD 3.32Å; W328-P497 HydrophobicContact CH2-CB 4.36Å; W328-P497 HydrophobicContact CZ2-CB 4.03Å; W328-P497 HydrophobicContact CZ2-CG 3.88Å; I487-P497 HydrophobicContact CG2-CB 3.93Å; P497-R499 VanDerWaalsContact CB-O 3.26Å; P497-R499 WeakPolarHBondContact CB-O 3.32Å; P497-R499 PolarHBondContact O-N 3.5Å; P497-I501 HydrophobicContact CB-CD1 3.9Å; P497-I501 HydrophobicContact CB-CG1 4.03Å; P497-I501 HydrophobicContact CG-CD1 3.39Å; P497-I501 HydrophobicContact CG-CG1 4.03Å
498	E	92.5	Very high	92.6	Very high	88 Å²	88	47.4 Å²	47.4	41%	0.411	22%	0.22	S	C	.	.	S	Bend	trans	-67.3	-26.1	175	178.8	174.9	-148.9	0	0	112.8	R60 R488 M490	R60-E498 IonicContact CZ-OE1 2.74Å; R60-E498 IonicContact CZ-OE2 2.83Å; R60-E498 IonicContact NH2-OE1 3.43Å; R60-E498 PolarHBondContact NH2-OE1 2.82Å; R60-E498 IonicContact NH2-OE2 3.08Å; R60-E498 PolarHBondContact NH2-OE2 2.98Å; R488-E498 WeakPolarHBondContact O-CB 3.48Å; R488-E498 PolarHBondContact O-N 3.05Å; M490-E498 HydrophobicContact CB-CB 4.34Å; M490-E498 HydrophobicContact CG-CB 4.3Å; M490-E498 HydrophobicContact SD-CB 4.4Å
499	R	92.8	Very high	92.6	Very high	130 Å²	130	41.5 Å²	41.5	49%	0.491	20%	0.2	S	C	.	.	S	Bend	trans	-135.3	156.7	179	-63.7	-177.3	-70.4	176.6	-0.9	109	P486 P497 I501	P486-R499 PolarHBondContact O-NH2 3.43Å; P497-R499 VanDerWaalsContact CB-O 3.26Å; P497-R499 WeakPolarHBondContact CB-O 3.32Å; P497-R499 PolarHBondContact O-N 3.5Å; R499-I501 PolarHBondContact O-N 3.33Å
500	S	93.4	Very high	92.4	Very high	64 Å²	64	42.9 Å²	42.9	45%	0.448	21%	0.206	S	C	.	.			trans	-54.1	133.3	173.8	-69.6	0	0	0	0	111	D185	D185-S500 WeakPolarHBondContact OD1-CB 3.39Å; D185-S500 PolarHBondContact OD1-OG 3.02Å
501	I	96	Very high	92.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.205	C	C	.	.			trans	-85.9	119.2	172.4	-65.6	167.6	0	0	0	107	D185 V186 Y331 I487 P497 R499 L503	D185-I501 WeakPolarHBondContact CA-O 3.49Å; D185-I501 PolarHBondContact N-O 2.88Å; V186-I501 HydrophobicContact CG2-CB 3.83Å; V186-I501 HydrophobicContact CG2-CG2 3.59Å; V186-I501 WeakPolarHBondContact CG2-O 3.45Å; V186-I501 PolarHBondContact N-O 3.34Å; Y331-I501 HydrophobicContact CD2-CG1 4.43Å; Y331-I501 HydrophobicContact CD2-CG2 4.04Å; I487-I501 HydrophobicContact CD1-CB 4.22Å; I487-I501 HydrophobicContact CD1-CG1 3.61Å; P497-I501 HydrophobicContact CB-CD1 3.9Å; P497-I501 HydrophobicContact CB-CG1 4.03Å; P497-I501 HydrophobicContact CG-CD1 3.39Å; P497-I501 HydrophobicContact CG-CG1 4.03Å; R499-I501 PolarHBondContact O-N 3.33Å; I501-L503 HydrophobicContact CG2-CD1 4.05Å; I501-L503 HydrophobicContact CG2-CD2 4.06Å; I501-L503 HydrophobicContact CG2-CG 3.81Å
502	N	96.5	Very high	92.7	Very high	27 Å²	27	44.8 Å²	44.8	14%	0.144	21%	0.213	C	C	.	.			trans	-109	132.2	173	-54.3	-35.3	0	0	0	108.2	L182 V183 R184 D185 E481	L182-N502 HydrophobicContact CD1-CB 4.11Å; V183-N502 WeakPolarHBondContact O-CA 3.41Å; R184-N502 VanDerWaalsContact CA-OD1 3.31Å; R184-N502 WeakPolarHBondContact CA-OD1 3.36Å; D185-N502 PolarHBondContact N-OD1 3.07Å; E481-N502 HydrophobicContact CB-CB 4.02Å; E481-N502 HydrophobicContact CG-CB 4.48Å; E481-N502 WeakPolarHBondContact OE2-CB 3.29Å; E481-N502 PolarHBondContact OE2-ND2 3.3Å
503	L	97.4	Very high	93.4	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.8	-177.9	-60.6	173.4	0	0	0	110.2	V183 V186 L330 V478 I501 F505	V183-L503 PolarHBondContact N-O 2.8Å; V183-L503 PolarHBondContact O-N 3.16Å; V183-L503 VanDerWaalsContact O-N 3.08Å; V186-L503 HydrophobicContact CG1-CB 4.13Å; V186-L503 HydrophobicContact CG1-CD1 4.3Å; V186-L503 HydrophobicContact CG1-CG 4.26Å; V186-L503 HydrophobicContact CG2-CD1 4Å; V186-L503 HydrophobicContact CG2-CG 4.39Å; L330-L503 HydrophobicContact CB-CD1 3.74Å; V478-L503 HydrophobicContact CG1-CB 3.98Å; V478-L503 HydrophobicContact CG1-CD1 3.91Å; V478-L503 HydrophobicContact CG1-CD2 4.46Å; V478-L503 HydrophobicContact CG1-CG 4.33Å; I501-L503 HydrophobicContact CG2-CD1 4.05Å; I501-L503 HydrophobicContact CG2-CD2 4.06Å; I501-L503 HydrophobicContact CG2-CG 3.81Å; L503-F505 HydrophobicContact CB-CD2 4.44Å; L503-F505 HydrophobicContact CB-CE2 3.79Å; L503-F505 HydrophobicContact CB-CZ 4.25Å; L503-F505 HydrophobicContact CD1-CZ 4.46Å
504	Q	97.6	Very high	94.2	Very high	21 Å²	21	43.2 Å²	43.2	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	135.1	170.6	-60.8	-176.6	85.2	0	0	109.6	A181 L182 V478 Q479 P480	A181-Q504 HydrophobicContact CB-CB 4.23Å; A181-Q504 CarbonylContact O-C 3.44Å; A181-Q504 VanDerWaalsContact O-CA 3.31Å; A181-Q504 WeakPolarHBondContact O-CA 3.35Å; L182-Q504 HydrophobicContact CD1-CG 4.06Å; V478-Q504 CarbonylContact C-O 3.53Å; V478-Q504 VanDerWaalsContact CA-O 3.28Å; V478-Q504 WeakPolarHBondContact CA-O 3.46Å; Q479-Q504 HydrophobicContact CB-CB 4.15Å; Q479-Q504 PolarHBondContact N-O 3.06Å; Q479-Q504 PolarHBondContact O-N 3Å; P480-Q504 PolarHBondContact O-NE2 3.19Å
505	F	97.8	Very high	94.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	97.1	176.9	-66.5	-98.1	0	0	0	108.7	L169 R173 A181 V183 V186 F190 L330 I472 F476 V478 L503	L169-F505 HydrophobicContact CD1-CD1 4.26Å; L169-F505 HydrophobicContact CD1-CE1 3.84Å; L169-F505 HydrophobicContact CD1-CZ 4.29Å; L169-F505 HydrophobicContact CD2-CE1 4.34Å; L169-F505 HydrophobicContact CD2-CE2 4.23Å; L169-F505 HydrophobicContact CD2-CZ 4Å; R173-F505 WeakPolarHBondContact CD-O 3.37Å; R173-F505 PolarHBondContact NE-O 2.72Å; R173-F505 VanDerWaalsContact NE-O 3.17Å; R173-F505 PolarHBondContact NH1-O 3.43Å; A181-F505 PolarHBondContact O-N 3.38Å; V183-F505 HydrophobicContact CB-CD2 3.87Å; V183-F505 HydrophobicContact CB-CE2 3.8Å; V183-F505 HydrophobicContact CG1-CE2 4.49Å; V183-F505 HydrophobicContact CG2-CD2 3.57Å; V183-F505 HydrophobicContact CG2-CE2 3.96Å; V186-F505 HydrophobicContact CG1-CE2 3.86Å; V186-F505 HydrophobicContact CG1-CZ 4.18Å; F190-F505 HydrophobicContact CZ-CZ 4.43Å; L330-F505 HydrophobicContact CD1-CE1 4.48Å; I472-F505 HydrophobicContact CG2-CD1 4.29Å; I472-F505 HydrophobicContact CG2-CE1 3.92Å; F476-F505 HydrophobicContact CB-CB 4.27Å; F476-F505 HydrophobicContact CB-CD1 4.1Å; F476-F505 HydrophobicContact CD1-CB 3.88Å; F476-F505 AromaticContact CD2-CD1 3.98Å; F476-F505 HydrophobicContact CD2-CD1 3.98Å; F476-F505 HydrophobicContact CE1-CB 4.37Å; F476-F505 HydrophobicContact CG-CB 4Å; F476-F505 HydrophobicContact CG-CD1 4.02Å; V478-F505 HydrophobicContact CG1-CE1 4.44Å; V478-F505 HydrophobicContact CG2-CD1 3.93Å; V478-F505 HydrophobicContact CG2-CE1 3.96Å; L503-F505 HydrophobicContact CB-CD2 4.44Å; L503-F505 HydrophobicContact CB-CE2 3.79Å; L503-F505 HydrophobicContact CB-CZ 4.25Å; L503-F505 HydrophobicContact CD1-CZ 4.46Å
506	L	96.9	Very high	94.8	Very high	55 Å²	55	49 Å²	49	29%	0.288	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.9	178.5	-59.5	166.8	0	0	0	108.9	A181 F476 E477 Q479	A181-L506 HydrophobicContact CB-CD2 3.67Å; A181-L506 HydrophobicContact CB-CG 4.41Å; F476-L506 CarbonylContact C-O 3.48Å; F476-L506 WeakPolarHBondContact CA-O 3.26Å; E477-L506 HydrophobicContact CB-CB 4.26Å; E477-L506 PolarHBondContact N-O 2.75Å; E477-L506 PolarHBondContact O-N 3.47Å; Q479-L506 HydrophobicContact CG-CD1 4.06Å; Q479-L506 VanDerWaalsContact NE2-CD1 3.33Å
507	D	94.8	Very high	95	Very high	93 Å²	93	52.4 Å²	52.4	50%	0.497	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	142.9	180	-59.6	-59.5	0	0	0	111.3	R173 F476	R173-D507 IonicContact CZ-OD2 3.56Å; R173-D507 IonicContact NH1-OD1 3.47Å; R173-D507 PolarHBondContact NH1-OD1 3.29Å; R173-D507 VanDerWaalsContact NH1-OD1 3.08Å; R173-D507 IonicContact NH1-OD2 2.76Å; R173-D507 PolarHBondContact NH1-OD2 3.26Å; R173-D507 IonicContact NH2-OD2 2.86Å; F476-D507 WeakPolarHBondContact CE1-OD1 3.14Å
508	R	89.7	Confident	95	Very high	132 Å²	132	55.5 Å²	55.5	50%	0.498	26%	0.262	S	S	.	.			trans	-100.8	0	173	-75.1	-171.1	-177.5	-74.9	0.5	112.9	L473 H475 F476 E477	L473-R508 WeakPolarHBondContact O-CD 3.06Å; H475-R508 PolarHBondContact O-N 3.02Å; H475-R508 VanDerWaalsContact O-N 3.09Å; F476-R508 PolarHBondContact O-NE 2.98Å; E477-R508 HydrophobicContact CB-CG 4.28Å; E477-R508 IonicContact OE2-CZ 3.38Å; E477-R508 IonicContact OE2-NH1 3.78Å; E477-R508 PolarHBondContact OE2-NH1 3.38Å; E477-R508 IonicContact OE2-NH2 3.38Å

Retrieved 508 of 508 residues in 2954.6 ms (Link to these results)

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