A0A087Y7W0_POEFO Loading...

Pleckstrin homology, MyTH4 and FERM domain containing H3

AlphaFold DB , UniProt , Accession A0A087Y7W0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 789 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	26.7	Very low	31.7	Very low	240 Å²	240	118.5 Å²	118.5	100%	1.182	65%	0.646	S	S	*	*				0	119	0	-69.1	163.1	167	0	0	107.6
2	P	25.8	Very low	32.3	Very low	118 Å²	118	115.1 Å²	115.1	77%	0.766	64%	0.635	S	S	*	*			trans	-88	152.7	175.1	34.5	-31.5	0	0	0	111.8	Q4	P2-Q4 PolarHBondContact O-N 3.27Å
3	V	26.3	Very low	32.5	Very low	127 Å²	127	121.2 Å²	121.2	77%	0.77	64%	0.643	S	S	*	*			trans	-65.7	119.1	-173.2	-177.2	0	0	0	0	111.9	V6	V3-V6 HydrophobicContact CG1-CG2 4.07Å
4	Q	39.4	Very low	32.3	Very low	179 Å²	179	120.1 Å²	120.1	84%	0.836	63%	0.633	S	S	*	*	S	Bend	trans	-82.5	-29.2	-174.4	-69.2	174.4	-73.8	0	0	114.5	P2 V6	P2-Q4 PolarHBondContact O-N 3.27Å; Q4-V6 PolarHBondContact O-N 3.27Å
5	G	35.3	Very low	32.3	Very low	55 Å²	55	115.3 Å²	115.3	57%	0.567	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-21.9	-170.4	0	0	0	0	0	116.7	C7	G5-C7 PolarHBondContact O-N 3.43Å
6	V	27	Very low	32.5	Very low	88 Å²	88	114.6 Å²	114.6	53%	0.533	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	-17	-171.3	-167	0	0	0	0	112.7	V3 Q4 W8 L10	V3-V6 HydrophobicContact CG1-CG2 4.07Å; Q4-V6 PolarHBondContact O-N 3.27Å; V6-W8 VanDerWaalsContact C-N 3.29Å; V6-W8 PolarHBondContact O-N 2.62Å; V6-L10 HydrophobicContact CG1-CD1 3.89Å; V6-L10 HydrophobicContact CG1-CG 4.41Å; V6-L10 PolarHBondContact O-N 3.41Å
7	C	30.7	Very low	32.2	Very low	56 Å²	56	112.7 Å²	112.7	38%	0.378	61%	0.611	S	S	.	*	H	α-helix	trans	-67.9	-23.9	175.6	176.1	0	0	0	0	112.8	G5 F9 L10 C11	G5-C7 PolarHBondContact O-N 3.43Å; C7-F9 PolarHBondContact O-N 2.89Å; C7-L10 PolarHBondContact O-N 3.1Å; C7-C11 VanDerWaalsContact CA-SG 3.53Å; C7-C11 HydrophobicContact CB-CB 4.37Å; C7-C11 WeakPolarHBondContact CB-SG 3.46Å; C7-C11 WeakPolarHBondContact O-CA 3.42Å; C7-C11 WeakPolarHBondContact O-CB 3.48Å; C7-C11 PolarHBondContact O-N 3.33Å; C7-C11 PolarHBondContact O-SG 3.22Å; C7-C11 WeakPolarHBondContact SG-CB 3.46Å; C7-C11 CovalentContact SG-SG 2.05Å; C7-C11 PolarHBondContact SG-SG 2.97Å
8	W	37	Very low	32	Very low	132 Å²	132	114.8 Å²	114.8	50%	0.5	62%	0.62	S	S	.	*	H	α-helix	trans	-58.9	-50.3	-178.1	-168.5	-100.6	0	0	0	112.8	V6 C12	V6-W8 VanDerWaalsContact C-N 3.29Å; V6-W8 PolarHBondContact O-N 2.62Å; W8-C12 WeakPolarHBondContact O-CB 2.99Å; W8-C12 PolarHBondContact O-SG 2.87Å
9	F	33.2	Very low	32	Very low	170 Å²	170	115.3 Å²	115.3	75%	0.746	62%	0.622	S	S	*	*	H	α-helix	trans	-80.2	-26.6	177.3	-94.6	-82.1	0	0	0	114.3	C7 R13	C7-F9 PolarHBondContact O-N 2.89Å; F9-R13 WeakPolarHBondContact O-CB 3.47Å
10	L	30.6	Very low	31.9	Very low	75 Å²	75	113.1 Å²	113.1	39%	0.393	63%	0.627	S	S	.	*	H	α-helix	trans	-86.3	-42.1	179.9	-72.2	-179.2	0	0	0	113	V6 C7 R13 Q14	V6-L10 HydrophobicContact CG1-CD1 3.89Å; V6-L10 HydrophobicContact CG1-CG 4.41Å; V6-L10 PolarHBondContact O-N 3.41Å; C7-L10 PolarHBondContact O-N 3.1Å; L10-R13 CarbonylContact O-C 3.38Å; L10-R13 PolarHBondContact O-N 2.87Å; L10-R13 VanDerWaalsContact O-N 3.1Å; L10-Q14 HydrophobicContact CD2-CG 4.21Å; L10-Q14 WeakPolarHBondContact O-CA 3.47Å; L10-Q14 VanDerWaalsContact O-CB 3.26Å; L10-Q14 WeakPolarHBondContact O-CB 3.27Å; L10-Q14 PolarHBondContact O-N 2.69Å
11	C	36.2	Very low	31.5	Very low	64 Å²	64	117.9 Å²	117.9	43%	0.432	64%	0.636	S	S	.	*	H	α-helix	trans	-70.7	-37.8	-176.6	-59.3	0	0	0	0	111.2	C7 R13 G15	C7-C11 VanDerWaalsContact CA-SG 3.53Å; C7-C11 HydrophobicContact CB-CB 4.37Å; C7-C11 WeakPolarHBondContact CB-SG 3.46Å; C7-C11 WeakPolarHBondContact O-CA 3.42Å; C7-C11 WeakPolarHBondContact O-CB 3.48Å; C7-C11 PolarHBondContact O-N 3.33Å; C7-C11 PolarHBondContact O-SG 3.22Å; C7-C11 WeakPolarHBondContact SG-CB 3.46Å; C7-C11 CovalentContact SG-SG 2.05Å; C7-C11 PolarHBondContact SG-SG 2.97Å; C11-R13 PolarHBondContact O-N 2.61Å; C11-R13 VanDerWaalsContact O-N 3.16Å; C11-G15 PolarHBondContact O-N 3.23Å
12	C	39	Very low	31.8	Very low	77 Å²	77	114.3 Å²	114.3	52%	0.52	62%	0.622	S	S	.	*	H	α-helix	trans	-68.1	-6.1	170.5	-60.5	0	0	0	0	114.7	W8 F16	W8-C12 WeakPolarHBondContact O-CB 2.99Å; W8-C12 PolarHBondContact O-SG 2.87Å; C12-F16 WeakPolarHBondContact O-CD2 3.41Å
13	R	35.6	Very low	31.9	Very low	195 Å²	195	119.4 Å²	119.4	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-129.4	-31.8	-175.3	-149	175.4	-171.4	-153.2	0.8	115.1	F9 L10 C11 S17	F9-R13 WeakPolarHBondContact O-CB 3.47Å; L10-R13 CarbonylContact O-C 3.38Å; L10-R13 PolarHBondContact O-N 2.87Å; L10-R13 VanDerWaalsContact O-N 3.1Å; C11-R13 PolarHBondContact O-N 2.61Å; C11-R13 VanDerWaalsContact O-N 3.16Å; R13-S17 WeakPolarHBondContact O-CB 3.41Å; R13-S17 PolarHBondContact O-N 3.26Å
14	Q	29.5	Very low	31.9	Very low	106 Å²	106	116.7 Å²	116.7	50%	0.495	62%	0.624	S	S	.	*	H	α-helix	trans	-85.6	-30.1	175.4	-66.7	-170.8	-46.4	0	0	112.8	L10 F16 S17 L18	L10-Q14 HydrophobicContact CD2-CG 4.21Å; L10-Q14 WeakPolarHBondContact O-CA 3.47Å; L10-Q14 VanDerWaalsContact O-CB 3.26Å; L10-Q14 WeakPolarHBondContact O-CB 3.27Å; L10-Q14 PolarHBondContact O-N 2.69Å; Q14-F16 PolarHBondContact O-N 2.73Å; Q14-S17 WeakPolarHBondContact CA-OG 3.48Å; Q14-S17 PolarHBondContact O-N 3.26Å; Q14-L18 PolarHBondContact O-N 3.01Å
15	G	32.3	Very low	31.3	Very low	48 Å²	48	117.9 Å²	117.9	50%	0.495	63%	0.63	S	S	.	*	H	α-helix	trans	-57.4	-34.1	166.2	0	0	0	0	0	111.6	C11	C11-G15 PolarHBondContact O-N 3.23Å
16	F	35.7	Very low	30.8	Very low	103 Å²	103	124.3 Å²	124.3	45%	0.452	64%	0.642	S	S	.	*	H	α-helix	trans	-89.4	-31.6	176.1	-68.4	-82.9	0	0	0	114	C12 Q14 L18 L19	C12-F16 WeakPolarHBondContact O-CD2 3.41Å; Q14-F16 PolarHBondContact O-N 2.73Å; F16-L18 VanDerWaalsContact C-N 3.26Å; F16-L18 PolarHBondContact O-N 2.78Å; F16-L19 PolarHBondContact O-N 3.19Å
17	S	27.8	Very low	30.9	Very low	83 Å²	83	127.1 Å²	127.1	58%	0.58	65%	0.65	S	S	*	*	H	α-helix	trans	-73.9	-11.7	179.7	80.2	0	0	0	0	114.6	R13 Q14 L19	R13-S17 WeakPolarHBondContact O-CB 3.41Å; R13-S17 PolarHBondContact O-N 3.26Å; Q14-S17 WeakPolarHBondContact CA-OG 3.48Å; Q14-S17 PolarHBondContact O-N 3.26Å; S17-L19 VanDerWaalsContact C-N 3.34Å
18	L	27.6	Very low	30.7	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-11.4	172.9	-95	163.7	0	0	0	113.9	Q14 F16 G20	Q14-L18 PolarHBondContact O-N 3.01Å; F16-L18 VanDerWaalsContact C-N 3.26Å; F16-L18 PolarHBondContact O-N 2.78Å; L18-G20 VanDerWaalsContact C-N 3.32Å
19	L	32.6	Very low	30.3	Very low	125 Å²	125	132.9 Å²	132.9	65%	0.654	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	1.6	175.3	-65.1	171.3	0	0	0	113.1	F16 S17 R21	F16-L19 PolarHBondContact O-N 3.19Å; S17-L19 VanDerWaalsContact C-N 3.34Å; L19-R21 VanDerWaalsContact C-N 3.27Å; L19-R21 PolarHBondContact O-N 2.73Å
20	G	28.8	Very low	30	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	68%	0.678	S	S	*	*			trans	-75.4	69.5	172.9	0	0	0	0	0	113.2	L18	L18-G20 VanDerWaalsContact C-N 3.32Å
21	R	25.3	Very low	29.7	Very low	214 Å²	214	134 Å²	134	81%	0.808	69%	0.693	S	S	*	*	S	Bend	trans	-134.3	142.6	163.8	-86.8	-170.2	169.1	176.4	-2.2	111.2	L19 Y23	L19-R21 VanDerWaalsContact C-N 3.27Å; L19-R21 PolarHBondContact O-N 2.73Å; R21-Y23 WeakPolarHBondContact O-CD2 3.4Å; R21-Y23 PolarHBondContact O-N 2.86Å
22	D	31.6	Very low	29.7	Very low	165 Å²	165	137.4 Å²	137.4	88%	0.882	70%	0.701	S	S	*	*			trans	-63.3	114.3	-165.1	-49.2	-85.6	0	0	0	113.1
23	Y	28.5	Very low	29.3	Very low	226 Å²	226	141.7 Å²	141.7	89%	0.886	71%	0.714	S	S	*	*			trans	-97.4	101.4	160.5	-79.9	-86.7	0	0	0	108.5	R21	R21-Y23 WeakPolarHBondContact O-CD2 3.4Å; R21-Y23 PolarHBondContact O-N 2.86Å
24	G	25.3	Very low	29.1	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	70%	0.695	S	S	*	*			trans	-70.1	157.8	178.4	0	0	0	0	0	113.1	K26	G24-K26 PolarHBondContact O-N 3.01Å
25	E	27.1	Very low	29.1	Very low	204 Å²	204	141 Å²	141	95%	0.953	71%	0.711	S	S	*	*	S	Bend	trans	-59.2	101.2	-175.4	-60.6	175.2	145.1	0	0	113
26	K	24.6	Very low	29	Very low	190 Å²	190	144.4 Å²	144.4	83%	0.826	72%	0.718	S	S	*	*			trans	-143.4	87.8	158.2	-79.1	-155.8	169.2	-162.2	0	110.9	G24 E28	G24-K26 PolarHBondContact O-N 3.01Å; K26-E28 PolarHBondContact O-N 3.13Å
27	E	29.2	Very low	28.7	Very low	147 Å²	147	146.9 Å²	146.9	69%	0.687	73%	0.729	S	S	*	*			trans	-73.7	106.4	164.2	-69.9	-167.5	178.2	0	0	109.8	K167	E27-K167 IonicContact OE1-NZ 2.7Å; E27-K167 IonicContact OE2-NZ 2.86Å; E27-K167 PolarHBondContact OE2-NZ 3.31Å
28	E	26.3	Very low	28.8	Very low	186 Å²	186	151.1 Å²	151.1	87%	0.869	74%	0.74	S	S	*	*			trans	-122.5	68.4	152.4	-74.4	-178.8	-173.7	0	0	107.3	K26	K26-E28 PolarHBondContact O-N 3.13Å
29	E	30.4	Very low	28.9	Very low	124 Å²	124	150.6 Å²	150.6	58%	0.579	74%	0.737	S	S	*	*			trans	-75.1	132.5	172.6	-73.2	-172.6	123	0	0	110.6	K167	E29-K167 WeakPolarHBondContact OE2-CE 3.19Å; E29-K167 IonicContact OE2-NZ 2.65Å; E29-K167 PolarHBondContact OE2-NZ 3.14Å
30	E	25.8	Very low	28.7	Very low	164 Å²	164	151.6 Å²	151.6	77%	0.766	74%	0.742	S	S	*	*			trans	-63.9	137.2	164.8	-67.2	-174.9	138.1	0	0	110.6	F32	E30-F32 WeakPolarHBondContact O-CD2 3.36Å; E30-F32 PolarHBondContact O-N 2.71Å
31	S	24.3	Very low	28.6	Very low	103 Å²	103	154.6 Å²	154.6	72%	0.72	75%	0.747	S	S	*	*			trans	-76	87.3	-172.2	53.8	0	0	0	0	112.5	E33	S31-E33 VanDerWaalsContact C-N 3.27Å; S31-E33 PolarHBondContact O-N 2.81Å
32	F	36.7	Very low	28.9	Very low	136 Å²	136	150.2 Å²	150.2	60%	0.596	75%	0.746	S	S	*	*			trans	-67.8	86.4	164.4	-70.1	-84.1	0	0	0	110.5	E30 R166	E30-F32 WeakPolarHBondContact O-CD2 3.36Å; E30-F32 PolarHBondContact O-N 2.71Å; F32-R166 PolarHBondContact O-NH1 3.06Å; F32-R166 PolarHBondContact O-NH2 2.83Å
33	E	29.9	Very low	28.7	Very low	167 Å²	167	150.6 Å²	150.6	78%	0.78	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.3	171	-64.6	-169.1	151.5	0	0	110.8	S31	S31-E33 VanDerWaalsContact C-N 3.27Å; S31-E33 PolarHBondContact O-N 2.81Å
34	L	32.8	Very low	28.6	Very low	67 Å²	67	143.3 Å²	143.3	35%	0.351	74%	0.742	S	S	.	*	P	Polyproline II helix	trans	-96.6	119.2	170.5	-67.3	167.9	0	0	0	107	N36 V197	L34-N36 PolarHBondContact O-N 2.89Å; L34-V197 HydrophobicContact CD1-CG1 3.84Å; L34-V197 HydrophobicContact CD2-CG1 4.09Å
35	R	29.5	Very low	28.8	Very low	219 Å²	219	151.2 Å²	151.2	83%	0.826	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.3	118.1	175.5	-101.3	-177.9	168	169.9	-3.9	110.2
36	N	29.1	Very low	28.6	Very low	121 Å²	121	147.7 Å²	147.7	65%	0.647	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-70.6	155.9	162.1	-75.3	-13.8	0	0	0	109.8	L34 E38	L34-N36 PolarHBondContact O-N 2.89Å; N36-E38 PolarHBondContact O-N 3.5Å
37	K	29.7	Very low	29	Very low	154 Å²	154	144.8 Å²	144.8	67%	0.67	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	10.3	-164.8	-147.4	160.4	-169.7	152.7	0	114.8	E198	K37-E198 IonicContact NZ-OE2 3.61Å; K37-E198 PolarHBondContact NZ-OE2 2.75Å
38	E	29.9	Very low	28.8	Very low	173 Å²	173	144.2 Å²	144.2	81%	0.808	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-22.9	-167.6	-60.1	-176.6	154.5	0	0	113.2	N36 L40	N36-E38 PolarHBondContact O-N 3.5Å; E38-L40 PolarHBondContact O-N 2.77Å
39	D	29.6	Very low	28.8	Very low	138 Å²	138	144.3 Å²	144.3	74%	0.738	75%	0.75	S	S	*	*			trans	-79.4	48.4	180	-69	-51.7	0	0	0	114
40	L	28.4	Very low	28.5	Very low	146 Å²	146	145 Å²	145	76%	0.764	76%	0.763	S	S	*	*			trans	-136	63.7	178.8	-74.1	178.1	0	0	0	113.5	E38	E38-L40 PolarHBondContact O-N 2.77Å
41	T	27.6	Very low	28.4	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	76%	0.763	S	S	*	*			trans	-93.1	126.8	160.9	58.4	0	0	0	0	110.9	N43	T41-N43 PolarHBondContact O-N 2.97Å
42	P	30.4	Very low	28.3	Very low	122 Å²	122	144.6 Å²	144.6	79%	0.792	77%	0.767	S	S	*	*			trans	-81.4	115	-173.6	31	-34.4	0	0	0	113.1
43	N	27.5	Very low	27.7	Very low	174 Å²	174	143.5 Å²	143.5	93%	0.93	78%	0.776	S	S	*	*			trans	-152.1	123.5	154.9	-97	-51.5	0	0	0	108.8	T41	T41-N43 PolarHBondContact O-N 2.97Å
44	G	27.6	Very low	27.4	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	78%	0.779	S	S	*	*			trans	-109.5	148.5	-169	0	0	0	0	0	114.6
45	R	27.7	Very low	27.1	Very low	236 Å²	236	147.1 Å²	147.1	89%	0.891	80%	0.803	S	S	*	*			trans	-173.9	116.8	146.7	-105.5	162.9	-170.4	-172.6	3	111.5
46	T	24.9	Very low	26.8	Very low	129 Å²	129	143.3 Å²	143.3	79%	0.791	80%	0.804	S	S	*	*			trans	44.7	144.8	144.3	46.8	0	0	0	0	121.9
47	P	32.6	Very low	26.6	Very low	129 Å²	129	143.8 Å²	143.8	84%	0.838	82%	0.815	S	S	*	*			trans	-84.9	163.7	-163.6	36	-38.4	0	0	0	115
48	T	25.3	Very low	26.4	Very low	136 Å²	136	141.6 Å²	141.6	83%	0.834	83%	0.826	S	S	*	*			trans	-132	134	161.7	-26.4	0	0	0	0	108.9
49	E	25.5	Very low	26.2	Very low	187 Å²	187	138.2 Å²	138.2	87%	0.874	83%	0.827	S	S	*	*			trans	-71.6	150.6	171.9	-61.9	172.8	112.6	0	0	110.9
50	V	24.2	Very low	26	Very low	138 Å²	138	139.8 Å²	139.8	84%	0.836	84%	0.836	S	S	*	*			trans	-133.8	119.8	166.3	-178.1	0	0	0	0	109.4
51	T	22.4	Very low	25.8	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	84%	0.837	S	S	*	*			trans	-78.8	139.9	-175.3	-43.6	0	0	0	0	112.2
52	V	23.4	Very low	25.7	Very low	132 Å²	132	136.3 Å²	136.3	80%	0.8	84%	0.836	S	S	*	*			trans	-69.1	133.8	174	177.2	0	0	0	0	111.1
53	S	24.7	Very low	25.5	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	84%	0.838	S	S	*	*			trans	-137.5	128.7	163.5	56.3	0	0	0	0	111.2
54	Q	23.4	Very low	25.3	Very low	180 Å²	180	133 Å²	133	84%	0.841	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-86.6	145.1	-178.9	-65.7	174.6	-31	0	0	111.4
55	P	25.4	Very low	25.3	Very low	129 Å²	129	139.1 Å²	139.1	84%	0.838	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-93.1	123.4	167.3	33.6	-29.4	0	0	0	112.1
56	T	24.2	Very low	25.2	Very low	139 Å²	139	134 Å²	134	85%	0.853	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-87.8	145.1	176	-28.4	0	0	0	0	111.8
57	C	24.8	Very low	25.2	Very low	132 Å²	132	134.2 Å²	134.2	89%	0.892	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.1	142.2	176.6	-71.3	0	0	0	0	113.4
58	A	25.6	Very low	24.7	Very low	107 Å²	107	132.7 Å²	132.7	88%	0.884	83%	0.826	S	S	*	*			trans	-147.7	158.8	163.8	0	0	0	0	0	110.4
59	A	25	Very low	24.7	Very low	102 Å²	102	135.4 Å²	135.4	84%	0.843	83%	0.829	S	S	*	*			trans	-116.4	177.9	-164.8	0	0	0	0	0	114.9
60	N	26.1	Very low	24.4	Very low	171 Å²	171	131.7 Å²	131.7	91%	0.914	82%	0.823	S	S	*	*			trans	-40	140.7	-176.4	-62.9	-26.5	0	0	0	116.9
61	G	24.3	Very low	25.4	Very low	77 Å²	77	130.3 Å²	130.3	79%	0.794	82%	0.818	S	S	*	*			trans	-150.4	146.4	162.7	0	0	0	0	0	110.9
62	T	25.3	Very low	25.5	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	82%	0.823	S	S	*	*			trans	-116	167.4	-167.7	40.9	0	0	0	0	114.7
63	N	25.8	Very low	25.6	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	82%	0.821	S	S	*	*			trans	78.1	89.7	162.9	-60.2	-15	0	0	0	119.3
64	G	24.3	Very low	25.5	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	82%	0.822	S	S	*	*				77.3	129.9	102	0	0	0	0	0	120.8
65	H	27.3	Very low	25.7	Very low	201 Å²	201	137.2 Å²	137.2	93%	0.931	83%	0.826	S	S	*	*			trans	-160.1	161.8	131.7	-110.3	-75.7	0	0	0	110.9
66	T	24.1	Very low	25.7	Very low	130 Å²	130	140 Å²	140	80%	0.798	82%	0.824	S	S	*	*			trans	-115.2	149.3	-167.4	-38.2	0	0	0	0	112.3
67	V	25.2	Very low	25.8	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	82%	0.818	S	S	*	*			trans	153.2	114.4	150.3	155.7	0	0	0	0	107
68	S	22.5	Very low	25.9	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	81%	0.809	S	S	*	*				80.3	96.9	53.3	-176.8	0	0	0	0	114.7
69	Q	24.3	Very low	25.8	Very low	194 Å²	194	138.9 Å²	138.9	91%	0.907	80%	0.8	S	S	*	*				-176.9	160	126.2	-100.6	174.2	38.9	0	0	113.4
70	S	21.1	Very low	25.8	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	80%	0.796	S	S	*	*			trans	-166.9	-172.5	-179	67.1	0	0	0	0	108.6
71	P	44.9	Very low	26	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	79%	0.794	S	S	*	*			cis	-129.7	146.9	-43.1	30	-12.5	0	0	0	113.4
72	V	24.6	Very low	26.2	Very low	149 Å²	149	150.2 Å²	150.2	90%	0.903	80%	0.801	S	S	*	*			trans	-150	139.4	174.8	-179.6	0	0	0	0	111
73	K	24.5	Very low	26.3	Very low	174 Å²	174	147.3 Å²	147.3	76%	0.757	80%	0.797	S	S	*	*			cis	-168.5	138.2	-29.1	-159.9	170.8	-172.7	175	0	109.5
74	M	23.4	Very low	26.6	Very low	166 Å²	166	148 Å²	148	82%	0.818	80%	0.797	S	S	*	*			trans	34.7	128.7	155.9	-69.9	171.2	154.3	0	0	121.9
75	K	26.1	Very low	26.7	Very low	209 Å²	209	148.1 Å²	148.1	91%	0.909	80%	0.798	S	S	*	*				-167.3	142.2	102	-102.6	169.4	-176.2	-179.2	0	113.1
76	K	26.7	Very low	27.2	Very low	187 Å²	187	143.6 Å²	143.6	81%	0.813	78%	0.784	S	S	*	*			trans	-94.7	158.2	157.2	-82.3	-170.8	171.6	-172.2	0	108.7
77	P	27	Very low	27.8	Very low	112 Å²	112	144.9 Å²	144.9	73%	0.727	79%	0.786	S	S	*	*				-126.5	154.8	94.5	43.2	-36.2	0	0	0	109.9
78	T	25	Very low	28.5	Very low	112 Å²	112	146.9 Å²	146.9	69%	0.687	79%	0.787	S	S	*	*				47.1	129	62.8	53	0	0	0	0	113
79	N	23.5	Very low	29.8	Very low	131 Å²	131	146.8 Å²	146.8	70%	0.701	78%	0.776	S	S	*	*			cis	-148.4	-174.5	22.8	-153.7	38.2	0	0	0	113
80	E	26.3	Very low	31	Very low	163 Å²	163	142.2 Å²	142.2	76%	0.762	76%	0.763	S	S	*	*			trans	71.9	115.6	161.6	-78.1	131.6	-113.4	0	0	119.6
81	E	29.8	Very low	32.8	Very low	187 Å²	187	142.2 Å²	142.2	87%	0.874	75%	0.754	S	S	*	*			trans	-77.2	138	160.5	-59.4	166.3	118.2	0	0	109.9
82	Y	28.2	Very low	33.6	Very low	238 Å²	238	139.8 Å²	139.8	93%	0.933	74%	0.735	S	S	*	*			trans	-137.4	111.6	146.5	-113.9	-89	0	0	0	107.6
83	G	28.2	Very low	36.1	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	71%	0.712	S	S	*	*			trans	-82.7	136.3	-174.7	0	0	0	0	0	112.5
84	M	31.3	Very low	39.3	Very low	169 Å²	169	129 Å²	129	83%	0.833	68%	0.681	S	S	*	*			trans	-158.5	53.1	156.5	-103.7	-65.1	-81.5	0	0	109.2	V86	M84-V86 HydrophobicContact CE-CG2 4.29Å; M84-V86 PolarHBondContact O-N 3.02Å; M84-V86 HydrophobicContact SD-CG2 4.4Å
85	G	26.8	Very low	42.6	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	66%	0.664	S	S	*	*			trans	-87.2	90.8	169.5	0	0	0	0	0	109.9	D87	G85-D87 VanDerWaalsContact C-N 3.33Å; G85-D87 PolarHBondContact O-N 3.06Å
86	V	37	Very low	45.8	Very low	106 Å²	106	116.8 Å²	116.8	64%	0.642	63%	0.625	S	S	*	*			trans	-82.7	85.7	167.2	-178.1	0	0	0	0	107.3	M84 E88	M84-V86 HydrophobicContact CE-CG2 4.29Å; M84-V86 PolarHBondContact O-N 3.02Å; M84-V86 HydrophobicContact SD-CG2 4.4Å; V86-E88 PolarHBondContact O-N 3.07Å; V86-E88 VanDerWaalsContact O-N 3.16Å
87	D	37.3	Very low	48.9	Very low	156 Å²	156	111.7 Å²	111.7	83%	0.834	60%	0.601	S	S	*	*			trans	-66.7	107.2	164.4	-77.3	-26.9	0	0	0	107.8	G85 E89	G85-D87 VanDerWaalsContact C-N 3.33Å; G85-D87 PolarHBondContact O-N 3.06Å; D87-E89 PolarHBondContact O-N 2.88Å
88	E	40.6	Very low	52.1	Low	174 Å²	174	106.4 Å²	106.4	81%	0.813	57%	0.566	S	S	*	*			trans	-65.3	105.7	174.5	-66.4	-174.9	141.4	0	0	109.4	V86 P90	V86-E88 PolarHBondContact O-N 3.07Å; V86-E88 VanDerWaalsContact O-N 3.16Å; E88-P90 VanDerWaalsContact O-CD 3.31Å; E88-P90 WeakPolarHBondContact O-CD 3.39Å
89	E	49.3	Very low	55.3	Low	96 Å²	96	102.7 Å²	102.7	45%	0.449	54%	0.542	S	S	.	.			trans	-71.3	108.7	176	-159.8	171.1	-85.2	0	0	107.6	D87 D91 L92 K95 K129	D87-E89 PolarHBondContact O-N 2.88Å; E89-D91 PolarHBondContact O-N 2.89Å; E89-L92 HydrophobicContact CG-CD1 3.78Å; E89-L92 HydrophobicContact CG-CG 4.42Å; E89-L92 WeakPolarHBondContact OE2-CD1 3.46Å; E89-K95 IonicContact OE2-NZ 3.53Å; E89-K129 WeakPolarHBondContact OE1-CE 3.34Å; E89-K129 IonicContact OE1-NZ 3.79Å; E89-K129 PolarHBondContact OE1-NZ 2.8Å
90	P	50.2	Low	58.4	Low	97 Å²	97	98.9 Å²	98.9	63%	0.63	52%	0.518	S	S	*	.			trans	-69.9	107.8	-155.1	25.6	-35.6	0	0	0	112.3	E88 L92	E88-P90 VanDerWaalsContact O-CD 3.31Å; E88-P90 WeakPolarHBondContact O-CD 3.39Å; P90-L92 VanDerWaalsContact O-CD2 3.31Å; P90-L92 WeakPolarHBondContact O-CD2 3.46Å; P90-L92 PolarHBondContact O-N 3.16Å
91	D	58.3	Low	61.1	Low	108 Å²	108	93.5 Å²	93.5	58%	0.578	49%	0.493	S	S	*	.			trans	10.5	74.6	178.7	-84	-11.3	0	0	0	115.2	E89 I93 Q118	E89-D91 PolarHBondContact O-N 2.89Å; D91-I93 PolarHBondContact O-N 3.04Å; D91-Q118 HydrophobicContact CB-CG 3.98Å; D91-Q118 PolarHBondContact OD2-NE2 3.23Å
92	L	61.9	Low	63.3	Low	59 Å²	59	86.8 Å²	86.8	31%	0.309	47%	0.465	S	S	.	.			trans	-81	108	-176.5	-62.7	-176.9	0	0	0	111	E89 P90 K95 V115	E89-L92 HydrophobicContact CG-CD1 3.78Å; E89-L92 HydrophobicContact CG-CG 4.42Å; E89-L92 WeakPolarHBondContact OE2-CD1 3.46Å; P90-L92 VanDerWaalsContact O-CD2 3.31Å; P90-L92 WeakPolarHBondContact O-CD2 3.46Å; P90-L92 PolarHBondContact O-N 3.16Å; L92-K95 HydrophobicContact CD1-CD 4.37Å; L92-V115 HydrophobicContact CD2-CG1 3.65Å
93	I	76.7	Confident	64.4	Low	81 Å²	81	79.4 Å²	79.4	42%	0.415	46%	0.461	S	S	.	.			trans	-84	-44.6	-171.5	-60.2	171.4	0	0	0	111.6	D91 L116 Q118 I190	D91-I93 PolarHBondContact O-N 3.04Å; I93-L116 PolarHBondContact N-O 3.25Å; I93-Q118 HydrophobicContact CD1-CG 4.2Å; I93-I190 HydrophobicContact CB-CD1 4.37Å; I93-I190 HydrophobicContact CD1-CD1 3.58Å; I93-I190 HydrophobicContact CD1-CG1 3.68Å; I93-I190 HydrophobicContact CG2-CD1 4.34Å
94	V	91.1	Very high	65.6	Low	17 Å²	17	79 Å²	79	10%	0.103	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	143.1	173.2	-174.2	0	0	0	0	110.5	L116 W183 A186	V94-L116 HydrophobicContact CB-CB 4.15Å; V94-L116 HydrophobicContact CB-CD2 4.11Å; V94-L116 HydrophobicContact CG2-CD2 4.08Å; V94-L116 PolarHBondContact N-O 2.91Å; V94-L116 WeakPolarHBondContact O-CB 3.22Å; V94-L116 PolarHBondContact O-N 2.89Å; V94-W183 HydrophobicContact CB-CE3 4.31Å; V94-W183 HydrophobicContact CB-CH2 4.29Å; V94-W183 HydrophobicContact CB-CZ3 4.13Å; V94-W183 HydrophobicContact CG1-CD2 3.86Å; V94-W183 HydrophobicContact CG1-CE3 3.97Å; V94-W183 HydrophobicContact CG1-CH2 3.78Å; V94-W183 HydrophobicContact CG1-CZ2 3.66Å; V94-W183 HydrophobicContact CG1-CZ3 3.94Å; V94-A186 HydrophobicContact CG2-CB 3.46Å; V94-A186 VanDerWaalsContact CG2-CB 3.46Å
95	K	92.2	Very high	66.1	Low	109 Å²	109	76.8 Å²	76.8	47%	0.474	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.9	169.5	59.7	-164.8	176.5	-166.1	0	111.4	E89 L92 W113 F114 V115	E89-K95 IonicContact OE2-NZ 3.53Å; L92-K95 HydrophobicContact CD1-CD 4.37Å; K95-W113 HydrophobicContact CB-CZ2 3.78Å; K95-W113 HydrophobicContact CD-CZ2 4.26Å; K95-W113 HydrophobicContact CG-CH2 4.49Å; K95-W113 HydrophobicContact CG-CZ2 3.85Å; K95-F114 VanDerWaalsContact CA-O 3.31Å; K95-F114 WeakPolarHBondContact CA-O 3.48Å; K95-V115 HydrophobicContact CB-CG2 4.26Å
96	G	93.5	Very high	67.5	Low	9 Å²	9	83 Å²	83	9%	0.093	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.4	176.6	-174	0	0	0	0	0	115.1	W113 F114	G96-W113 VanDerWaalsContact C-CE3 3.46Å; G96-W113 VanDerWaalsContact CA-CZ3 3.46Å; G96-F114 PolarHBondContact N-O 3.43Å; G96-F114 PolarHBondContact O-N 3.16Å
97	W	93.4	Very high	68.6	Low	80 Å²	80	83.7 Å²	83.7	30%	0.303	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	104.8	-178.4	-76.6	108.2	0	0	0	112	R111 Y112 W113 P127	W97-R111 HydrophobicContact CB-CG 4.42Å; W97-R111 HydrophobicContact CD2-CG 4.43Å; W97-R111 HydrophobicContact CE3-CG 3.77Å; W97-R111 HydrophobicContact CZ3-CG 4.41Å; W97-Y112 VanDerWaalsContact CE3-C 3.4Å; W97-W113 AromaticContact CD1-CE3 3.64Å; W97-W113 AromaticContact CD1-CZ3 3.54Å; W97-W113 AromaticContact CD2-CE3 3.82Å; W97-W113 HydrophobicContact CD2-CE3 3.82Å; W97-W113 HydrophobicContact CD2-CZ3 4.5Å; W97-W113 AromaticContact CE2-CE3 3.82Å; W97-W113 HydrophobicContact CE3-CB 4.31Å; W97-W113 AromaticContact CG-CE3 3.75Å; W97-W113 HydrophobicContact CG-CE3 3.75Å; W97-W113 HydrophobicContact CG-CZ3 4.04Å; W97-W113 HydrophobicContact CZ3-CB 4.25Å; W97-W113 AromaticContact NE1-CE3 3.65Å; W97-W113 AromaticContact NE1-CZ3 3.73Å; W97-P127 HydrophobicContact CZ2-CG 4.23Å
98	L	93.7	Very high	70.4	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	157.1	170.3	-60.9	174	0	0	0	111	Y112 F114 L172 T174 W183	L98-Y112 PolarHBondContact N-O 3.44Å; L98-Y112 PolarHBondContact O-N 3.21Å; L98-F114 HydrophobicContact CB-CD2 3.68Å; L98-F114 HydrophobicContact CB-CE2 3.91Å; L98-F114 HydrophobicContact CB-CG 4.46Å; L98-F114 HydrophobicContact CD1-CD2 4.35Å; L98-F114 HydrophobicContact CD1-CG 4.34Å; L98-F114 HydrophobicContact CG-CD2 4.32Å; L98-L172 HydrophobicContact CD1-CB 4.17Å; L98-L172 HydrophobicContact CD1-CD1 3.93Å; L98-T174 HydrophobicContact CD2-CG2 4.4Å; L98-W183 HydrophobicContact CD1-CD2 3.84Å; L98-W183 HydrophobicContact CD1-CE3 4.26Å; L98-W183 HydrophobicContact CD1-CG 4.13Å; L98-W183 HydrophobicContact CD1-CZ2 4.17Å; L98-W183 HydrophobicContact CG-CZ2 4.33Å
99	L	91.7	Very high	72.4	Confident	35 Å²	35	77.8 Å²	77.8	18%	0.183	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139.7	165.2	-60.7	89.6	0	0	0	108.8	H109 R110 Y158 L172 Y173	L99-H109 HydrophobicContact CB-CB 4.32Å; L99-H109 HydrophobicContact CD2-CB 3.97Å; L99-R110 CarbonylContact C-O 3.52Å; L99-R110 WeakPolarHBondContact CA-O 3.22Å; L99-Y158 HydrophobicContact CD1-CE1 4.25Å; L99-Y158 HydrophobicContact CD2-CE1 4.34Å; L99-L172 CarbonylContact O-C 3.51Å; L99-L172 WeakPolarHBondContact O-CA 3.12Å; L99-Y173 WeakPolarHBondContact CD1-O 3.26Å; L99-Y173 PolarHBondContact N-O 2.78Å; L99-Y173 PolarHBondContact O-N 3.28Å
100	R	88.6	Confident	74.2	Confident	51 Å²	51	80.5 Å²	80.5	19%	0.192	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.7	172.3	-178.8	173.1	169.8	-125.2	-3.3	109.8	H109 R110 Y112 F114 Y123 L172	R100-H109 WeakPolarHBondContact O-CA 3.38Å; R100-R110 PolarHBondContact N-O 3.07Å; R100-R110 PolarHBondContact O-N 3.38Å; R100-Y112 HydrophobicContact CB-CD2 4.06Å; R100-Y112 HydrophobicContact CB-CE2 4.38Å; R100-F114 HydrophobicContact CB-CE2 4.42Å; R100-F114 HydrophobicContact CB-CZ 4.1Å; R100-Y123 PolarHBondContact NH1-OH 3.09Å; R100-L172 HydrophobicContact CB-CD2 4.21Å; R100-L172 HydrophobicContact CG-CD2 4.29Å
101	E	82.7	Confident	76.2	Confident	50 Å²	50	83.4 Å²	83.4	23%	0.234	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.4	172.8	-178.1	162.2	-172.1	0	0	110.8	I107 R171 Y173	E101-I107 HydrophobicContact CG-CG2 4.12Å; E101-I107 WeakPolarHBondContact OE1-CG2 3.43Å; E101-R171 IonicContact OE2-NH1 2.69Å; E101-R171 PolarHBondContact OE2-NH1 3.26Å; E101-Y173 HydrophobicContact CB-CE2 4Å; E101-Y173 PolarHBondContact OE2-OH 3.39Å
102	V	75.6	Confident	77.9	Confident	46 Å²	46	79.8 Å²	79.8	28%	0.279	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	121.6	-179.6	-176.4	0	0	0	0	109.4	K108 R110 Y112	V102-K108 PolarHBondContact N-O 3.45Å; V102-K108 VanDerWaalsContact N-O 3.09Å; V102-R110 HydrophobicContact CG2-CB 4.04Å; V102-R110 HydrophobicContact CG2-CG 4.22Å; V102-Y112 HydrophobicContact CG2-CE2 4.06Å
103	G	51.9	Low	79.5	Confident	82 Å²	82	79.2 Å²	79.2	85%	0.845	40%	0.399	S	S	*	.			trans	-64.6	147.8	-172.3	0	0	0	0	0	114.7
104	G	54.3	Low	80.4	Confident	61 Å²	61	75.3 Å²	75.3	63%	0.629	38%	0.379	S	S	*	.	S	Bend	trans	161.9	178.5	-179.9	0	0	0	0	0	109.9	W106	G104-W106 PolarHBondContact O-N 3.09Å
105	S	41.5	Very low	80.5	Confident	121 Å²	121	75.3 Å²	75.3	85%	0.846	38%	0.379	S	S	*	.	S	Bend	trans	-59.2	-14.8	-176.7	175.2	0	0	0	0	115.2
106	W	55.3	Low	80.7	Confident	205 Å²	205	70.1 Å²	70.1	78%	0.777	36%	0.357	S	S	*	.	S	Bend	trans	-138.4	128.9	176.1	-71.9	60.1	0	0	0	108.1	G104 K108	G104-W106 PolarHBondContact O-N 3.09Å; W106-K108 PolarHBondContact O-N 3.28Å
107	I	61.3	Low	80.6	Confident	121 Å²	121	70.9 Å²	70.9	62%	0.621	36%	0.361	S	S	*	.			trans	-59.7	122	179.1	-66.9	170	0	0	0	109.9	E101	E101-I107 HydrophobicContact CG-CG2 4.12Å; E101-I107 WeakPolarHBondContact OE1-CG2 3.43Å
108	K	74.1	Confident	80.5	Confident	139 Å²	139	71.4 Å²	71.4	60%	0.604	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	117.5	178.9	-73.3	177.8	-176.6	176	0	111	V102 W106	V102-K108 PolarHBondContact N-O 3.45Å; V102-K108 VanDerWaalsContact N-O 3.09Å; W106-K108 PolarHBondContact O-N 3.28Å
109	H	83.1	Confident	80.4	Confident	67 Å²	67	75.9 Å²	75.9	31%	0.31	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	125.6	171	-61.2	106.1	0	0	0	110.1	L99 R100 Y173	L99-H109 HydrophobicContact CB-CB 4.32Å; L99-H109 HydrophobicContact CD2-CB 3.97Å; R100-H109 WeakPolarHBondContact O-CA 3.38Å; H109-Y173 AromaticContact CD2-CD2 3.62Å; H109-Y173 AromaticContact CD2-CE2 3.56Å; H109-Y173 AromaticContact NE2-CD2 3.82Å; H109-Y173 AromaticContact NE2-CE1 3.85Å; H109-Y173 AromaticContact NE2-CE2 3.41Å; H109-Y173 WeakPolarHBondContact NE2-CE2 3.22Å; H109-Y173 AromaticContact NE2-CZ 3.38Å
110	R	87.1	Confident	80.5	Confident	153 Å²	153	74.9 Å²	74.9	58%	0.577	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.8	171.1	-75.6	-171.5	173.8	-165	-0.4	110.2	L99 R100 V102 Y112	L99-R110 CarbonylContact C-O 3.52Å; L99-R110 WeakPolarHBondContact CA-O 3.22Å; R100-R110 PolarHBondContact N-O 3.07Å; R100-R110 PolarHBondContact O-N 3.38Å; V102-R110 HydrophobicContact CG2-CB 4.04Å; V102-R110 HydrophobicContact CG2-CG 4.22Å; R110-Y112 HydrophobicContact CB-CD2 4.28Å; R110-Y112 HydrophobicContact CB-CE2 3.48Å; R110-Y112 VanDerWaalsContact CB-CE2 3.48Å; R110-Y112 WeakPolarHBondContact CD-OH 3.41Å; R110-Y112 WeakPolarHBondContact O-CD2 3.28Å
111	R	92	Very high	80.8	Confident	158 Å²	158	72.5 Å²	72.5	60%	0.596	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	130.7	178.7	-156.9	-169.2	-171.8	-167.1	-2.7	109.6	W97	W97-R111 HydrophobicContact CB-CG 4.42Å; W97-R111 HydrophobicContact CD2-CG 4.43Å; W97-R111 HydrophobicContact CE3-CG 3.77Å; W97-R111 HydrophobicContact CZ3-CG 4.41Å
112	Y	94.3	Very high	81.4	Confident	31 Å²	31	70.4 Å²	70.4	12%	0.122	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.8	177.6	-63.6	-77.5	0	0	0	110.6	W97 L98 R100 V102 R110 Y123 L134	W97-Y112 VanDerWaalsContact CE3-C 3.4Å; L98-Y112 PolarHBondContact N-O 3.44Å; L98-Y112 PolarHBondContact O-N 3.21Å; R100-Y112 HydrophobicContact CB-CD2 4.06Å; R100-Y112 HydrophobicContact CB-CE2 4.38Å; V102-Y112 HydrophobicContact CG2-CE2 4.06Å; R110-Y112 HydrophobicContact CB-CD2 4.28Å; R110-Y112 HydrophobicContact CB-CE2 3.48Å; R110-Y112 VanDerWaalsContact CB-CE2 3.48Å; R110-Y112 WeakPolarHBondContact CD-OH 3.41Å; R110-Y112 WeakPolarHBondContact O-CD2 3.28Å; Y112-Y123 AromaticContact CD1-CD2 3.91Å; Y112-Y123 HydrophobicContact CD1-CD2 3.91Å; Y112-Y123 HydrophobicContact CD1-CE2 4.24Å; Y112-Y123 HydrophobicContact CD2-CD2 4.21Å; Y112-Y123 HydrophobicContact CD2-CE2 4.48Å; Y112-Y123 HydrophobicContact CE1-CD2 4.44Å; Y112-Y123 HydrophobicContact CE1-CE2 4.31Å; Y112-Y123 AromaticContact CG-CD2 3.77Å; Y112-Y123 HydrophobicContact CG-CD2 3.77Å; Y112-Y123 HydrophobicContact CG-CE2 4.31Å; Y112-L134 HydrophobicContact CD1-CD1 3.61Å; Y112-L134 HydrophobicContact CE1-CD1 3.45Å; Y112-L134 VanDerWaalsContact CE1-CD1 3.45Å
113	W	94.8	Very high	82.3	Confident	47 Å²	47	69.6 Å²	69.6	18%	0.178	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	115.9	172.8	-176.6	-106.1	0	0	0	108.8	K95 G96 W97 Y123 Y124 P127	K95-W113 HydrophobicContact CB-CZ2 3.78Å; K95-W113 HydrophobicContact CD-CZ2 4.26Å; K95-W113 HydrophobicContact CG-CH2 4.49Å; K95-W113 HydrophobicContact CG-CZ2 3.85Å; G96-W113 VanDerWaalsContact C-CE3 3.46Å; G96-W113 VanDerWaalsContact CA-CZ3 3.46Å; W97-W113 AromaticContact CD1-CE3 3.64Å; W97-W113 AromaticContact CD1-CZ3 3.54Å; W97-W113 AromaticContact CD2-CE3 3.82Å; W97-W113 HydrophobicContact CD2-CE3 3.82Å; W97-W113 HydrophobicContact CD2-CZ3 4.5Å; W97-W113 AromaticContact CE2-CE3 3.82Å; W97-W113 HydrophobicContact CE3-CB 4.31Å; W97-W113 AromaticContact CG-CE3 3.75Å; W97-W113 HydrophobicContact CG-CE3 3.75Å; W97-W113 HydrophobicContact CG-CZ3 4.04Å; W97-W113 HydrophobicContact CZ3-CB 4.25Å; W97-W113 AromaticContact NE1-CE3 3.65Å; W97-W113 AromaticContact NE1-CZ3 3.73Å; W113-Y123 CarbonylContact O-C 3.46Å; W113-Y123 VanDerWaalsContact O-CA 3.32Å; W113-Y123 WeakPolarHBondContact O-CA 3.45Å; W113-Y124 PolarHBondContact N-O 3.17Å; W113-Y124 PolarHBondContact O-N 3.5Å; W113-P127 HydrophobicContact CD2-CB 3.79Å; W113-P127 HydrophobicContact CE3-CB 4.11Å; W113-P127 HydrophobicContact CG-CB 4.17Å; W113-P127 HydrophobicContact CH2-CB 4.39Å; W113-P127 HydrophobicContact CZ2-CB 4.08Å; W113-P127 HydrophobicContact CZ3-CB 4.4Å
114	F	95.7	Very high	84.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	144.5	178.1	-78.5	-97.7	0	0	0	110.6	K95 G96 L98 R100 L121 D122 Y123 Y170 L172 W183	K95-F114 VanDerWaalsContact CA-O 3.31Å; K95-F114 WeakPolarHBondContact CA-O 3.48Å; G96-F114 PolarHBondContact N-O 3.43Å; G96-F114 PolarHBondContact O-N 3.16Å; L98-F114 HydrophobicContact CB-CD2 3.68Å; L98-F114 HydrophobicContact CB-CE2 3.91Å; L98-F114 HydrophobicContact CB-CG 4.46Å; L98-F114 HydrophobicContact CD1-CD2 4.35Å; L98-F114 HydrophobicContact CD1-CG 4.34Å; L98-F114 HydrophobicContact CG-CD2 4.32Å; R100-F114 HydrophobicContact CB-CE2 4.42Å; R100-F114 HydrophobicContact CB-CZ 4.1Å; F114-L121 HydrophobicContact CB-CD1 4.45Å; F114-L121 HydrophobicContact CD1-CD1 3.92Å; F114-L121 HydrophobicContact CD1-CG 4.14Å; F114-D122 WeakPolarHBondContact CA-O 3.31Å; F114-Y123 HydrophobicContact CE1-CD1 4.4Å; F114-Y123 HydrophobicContact CE1-CG 4.13Å; F114-Y123 HydrophobicContact CZ-CG 4.13Å; F114-Y170 HydrophobicContact CE1-CD2 4.13Å; F114-Y170 HydrophobicContact CE1-CE2 4.46Å; F114-L172 HydrophobicContact CD1-CD2 4.42Å; F114-L172 HydrophobicContact CE1-CD1 4.4Å; F114-L172 HydrophobicContact CE1-CD2 3.53Å; F114-L172 HydrophobicContact CE2-CD2 4.01Å; F114-L172 HydrophobicContact CZ-CD2 3.29Å; F114-W183 HydrophobicContact CB-CH2 3.6Å; F114-W183 HydrophobicContact CB-CZ2 4.21Å; F114-W183 HydrophobicContact CB-CZ3 4.17Å
115	V	94.6	Very high	86.1	Confident	17 Å²	17	69.1 Å²	69.1	10%	0.103	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.3	176.3	-176.4	0	0	0	0	108.3	L92 K95 D122 Y124	L92-V115 HydrophobicContact CD2-CG1 3.65Å; K95-V115 HydrophobicContact CB-CG2 4.26Å; V115-D122 PolarHBondContact N-O 3.02Å; V115-D122 PolarHBondContact O-N 3.5Å; V115-Y124 HydrophobicContact CB-CE2 3.99Å; V115-Y124 HydrophobicContact CG2-CD2 3.97Å; V115-Y124 HydrophobicContact CG2-CE2 3.79Å
116	L	95.4	Very high	88.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	107.5	178.7	-178	61.2	0	0	0	108.5	I93 V94 L121 L139 W183 A186 I187 I190	I93-L116 PolarHBondContact N-O 3.25Å; V94-L116 HydrophobicContact CB-CB 4.15Å; V94-L116 HydrophobicContact CB-CD2 4.11Å; V94-L116 HydrophobicContact CG2-CD2 4.08Å; V94-L116 PolarHBondContact N-O 2.91Å; V94-L116 WeakPolarHBondContact O-CB 3.22Å; V94-L116 PolarHBondContact O-N 2.89Å; L116-L121 HydrophobicContact CB-CD1 4.33Å; L116-L121 HydrophobicContact CD1-CB 4.27Å; L116-L121 HydrophobicContact CD1-CD1 4.25Å; L116-L139 HydrophobicContact CD1-CD1 3.62Å; L116-W183 HydrophobicContact CB-CZ3 4.02Å; L116-A186 HydrophobicContact CD2-CB 3.71Å; L116-I187 HydrophobicContact CD1-CG1 3.96Å; L116-I187 HydrophobicContact CD2-CG1 3.71Å; L116-I187 HydrophobicContact CG-CG1 4.48Å; L116-I190 HydrophobicContact CD1-CD1 3.56Å; L116-I190 HydrophobicContact CD2-CD1 3.6Å; L116-I190 HydrophobicContact CG-CD1 3.39Å
117	S	92.8	Very high	90	Very high	25 Å²	25	56.6 Å²	56.6	18%	0.175	27%	0.266	C	S	.	.			trans	-90	-179.8	172.3	72.1	0	0	0	0	110.2	D119 S120	S117-D119 PolarHBondContact O-N 3.04Å; S117-D119 PolarHBondContact OG-N 3.18Å; S117-S120 PolarHBondContact N-O 3.34Å; S117-S120 PolarHBondContact OG-N 3.41Å; S117-S120 PolarHBondContact OG-O 2.81Å; S117-S120 PolarHBondContact OG-OG 3.14Å; S117-S120 VanDerWaalsContact OG-OG 3.11Å
118	Q	90.2	Very high	91.3	Very high	91 Å²	91	57.1 Å²	57.1	43%	0.425	27%	0.266	S	S	.	.	S	Bend	trans	-61.3	-26.1	170.4	-61.9	-160.4	15.8	0	0	113.3	D91 I93 I190 K194	D91-Q118 HydrophobicContact CB-CG 3.98Å; D91-Q118 PolarHBondContact OD2-NE2 3.23Å; I93-Q118 HydrophobicContact CD1-CG 4.2Å; Q118-I190 WeakPolarHBondContact O-CG2 3.43Å; Q118-K194 WeakPolarHBondContact O-CE 3.48Å; Q118-K194 PolarHBondContact O-NZ 3.49Å
119	D	91.4	Very high	91.3	Very high	94 Å²	94	59.3 Å²	59.3	50%	0.503	28%	0.275	S	S	.	.	S	Bend	trans	-117.4	-13.6	-170.6	-67.4	-63.8	0	0	0	114.9	S117 L139 K194	S117-D119 PolarHBondContact O-N 3.04Å; S117-D119 PolarHBondContact OG-N 3.18Å; D119-L139 PolarHBondContact O-N 2.84Å; D119-K194 IonicContact OD1-NZ 3.39Å; D119-K194 PolarHBondContact OD1-NZ 2.69Å
120	S	94.1	Very high	91	Very high	14 Å²	14	60.1 Å²	60.1	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	152.3	-173.1	73.8	0	0	0	0	114.6	S117 D122 T136 L137	S117-S120 PolarHBondContact N-O 3.34Å; S117-S120 PolarHBondContact OG-N 3.41Å; S117-S120 PolarHBondContact OG-O 2.81Å; S117-S120 PolarHBondContact OG-OG 3.14Å; S117-S120 VanDerWaalsContact OG-OG 3.11Å; S120-D122 WeakPolarHBondContact CB-OD1 3.46Å; S120-D122 PolarHBondContact OG-OD1 3.05Å; S120-T136 WeakPolarHBondContact CB-OG1 3.4Å; S120-L137 VanDerWaalsContact CA-O 3.32Å; S120-L137 WeakPolarHBondContact CA-O 3.32Å
121	L	95.6	Very high	91	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	102.2	162.1	-179.9	60.7	0	0	0	109.1	F114 L116 L137 V163 Y170 L172 W183 I187	F114-L121 HydrophobicContact CB-CD1 4.45Å; F114-L121 HydrophobicContact CD1-CD1 3.92Å; F114-L121 HydrophobicContact CD1-CG 4.14Å; L116-L121 HydrophobicContact CB-CD1 4.33Å; L116-L121 HydrophobicContact CD1-CB 4.27Å; L116-L121 HydrophobicContact CD1-CD1 4.25Å; L121-L137 HydrophobicContact CB-CB 4.47Å; L121-L137 PolarHBondContact N-O 2.82Å; L121-L137 PolarHBondContact O-N 3.43Å; L121-V163 HydrophobicContact CD2-CG2 4.08Å; L121-Y170 HydrophobicContact CD2-CD2 4.34Å; L121-L172 HydrophobicContact CD2-CD1 3.9Å; L121-W183 HydrophobicContact CD1-CE3 4.49Å; L121-W183 HydrophobicContact CD1-CZ3 3.84Å; L121-I187 HydrophobicContact CD2-CD1 3.88Å
122	D	94.5	Very high	90.9	Very high	7 Å²	7	55.2 Å²	55.2	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	153.6	-177.7	-76.4	18	0	0	0	111.3	F114 V115 S120 Y124 R133 T136	F114-D122 WeakPolarHBondContact CA-O 3.31Å; V115-D122 PolarHBondContact N-O 3.02Å; V115-D122 PolarHBondContact O-N 3.5Å; S120-D122 WeakPolarHBondContact CB-OD1 3.46Å; S120-D122 PolarHBondContact OG-OD1 3.05Å; D122-Y124 HydrophobicContact CB-CD2 4.46Å; D122-Y124 HydrophobicContact CB-CE2 3.57Å; D122-Y124 PolarHBondContact OD2-OH 2.92Å; D122-R133 WeakPolarHBondContact OD2-CD 3.4Å; D122-R133 IonicContact OD2-CZ 3.92Å; D122-R133 IonicContact OD2-NE 2.63Å; D122-R133 IonicContact OD2-NH1 2.72Å; D122-R133 PolarHBondContact OD2-NH1 3.42Å; D122-T136 WeakPolarHBondContact OD1-CA 3.45Å; D122-T136 WeakPolarHBondContact OD1-CB 3.28Å; D122-T136 PolarHBondContact OD1-OG1 2.93Å
123	Y	94.1	Very high	90.9	Very high	28 Å²	28	60.2 Å²	60.2	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.8	171.3	76.7	-76.5	0	0	0	113.4	R100 Y112 W113 F114 L134 G135 Y170	R100-Y123 PolarHBondContact NH1-OH 3.09Å; Y112-Y123 AromaticContact CD1-CD2 3.91Å; Y112-Y123 HydrophobicContact CD1-CD2 3.91Å; Y112-Y123 HydrophobicContact CD1-CE2 4.24Å; Y112-Y123 HydrophobicContact CD2-CD2 4.21Å; Y112-Y123 HydrophobicContact CD2-CE2 4.48Å; Y112-Y123 HydrophobicContact CE1-CD2 4.44Å; Y112-Y123 HydrophobicContact CE1-CE2 4.31Å; Y112-Y123 AromaticContact CG-CD2 3.77Å; Y112-Y123 HydrophobicContact CG-CD2 3.77Å; Y112-Y123 HydrophobicContact CG-CE2 4.31Å; W113-Y123 CarbonylContact O-C 3.46Å; W113-Y123 VanDerWaalsContact O-CA 3.32Å; W113-Y123 WeakPolarHBondContact O-CA 3.45Å; F114-Y123 HydrophobicContact CE1-CD1 4.4Å; F114-Y123 HydrophobicContact CE1-CG 4.13Å; F114-Y123 HydrophobicContact CZ-CG 4.13Å; Y123-L134 HydrophobicContact CD2-CB 3.79Å; Y123-L134 HydrophobicContact CD2-CD1 4.27Å; Y123-L134 HydrophobicContact CE1-CB 4.48Å; Y123-L134 HydrophobicContact CE2-CB 3.34Å; Y123-L134 HydrophobicContact CE2-CD1 4.06Å; Y123-L134 HydrophobicContact CE2-CG 4.36Å; Y123-L134 PolarHBondContact O-N 3.37Å; Y123-L134 PolarHBondContact OH-O 3.06Å; Y123-L134 VanDerWaalsContact OH-O 3.06Å; Y123-G135 VanDerWaalsContact CE1-CA 3.41Å; Y123-G135 PolarHBondContact N-O 2.79Å; Y123-G135 VanDerWaalsContact N-O 3.09Å; Y123-G135 PolarHBondContact O-N 2.96Å; Y123-Y170 AromaticContact CD1-CE2 3.89Å; Y123-Y170 HydrophobicContact CD1-CE2 3.89Å; Y123-Y170 HydrophobicContact CE1-CE2 4.22Å; Y123-Y170 AromaticContact CE1-CZ 3.86Å; Y123-Y170 WeakPolarHBondContact CE1-OH 3.32Å
124	Y	94.6	Very high	90.7	Very high	54 Å²	54	60.9 Å²	60.9	21%	0.212	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	163.9	-166.3	-62.8	-101.4	0	0	0	111.7	W113 V115 D122 G126 R132 R133	W113-Y124 PolarHBondContact N-O 3.17Å; W113-Y124 PolarHBondContact O-N 3.5Å; V115-Y124 HydrophobicContact CB-CE2 3.99Å; V115-Y124 HydrophobicContact CG2-CD2 3.97Å; V115-Y124 HydrophobicContact CG2-CE2 3.79Å; D122-Y124 HydrophobicContact CB-CD2 4.46Å; D122-Y124 HydrophobicContact CB-CE2 3.57Å; D122-Y124 PolarHBondContact OD2-OH 2.92Å; Y124-G126 PolarHBondContact O-N 2.84Å; Y124-R132 WeakPolarHBondContact CA-O 3.27Å; Y124-R133 HydrophobicContact CD1-CB 3.92Å; Y124-R133 HydrophobicContact CE1-CB 3.66Å; Y124-R133 HydrophobicContact CE1-CG 4.19Å
125	T	91.6	Very high	90.5	Very high	80 Å²	80	61.8 Å²	61.8	49%	0.491	32%	0.322	S	S	.	.	S	Bend	trans	-63.3	-24.3	172.9	50.7	0	0	0	0	114	R132 L134	T125-R132 HydrophobicContact CG2-CB 3.99Å; T125-R132 PolarHBondContact N-O 2.79Å; T125-R132 PolarHBondContact OG1-N 3.14Å; T125-R132 VanDerWaalsContact OG1-N 3.17Å; T125-L134 HydrophobicContact CG2-CD1 3.88Å; T125-L134 HydrophobicContact CG2-CD2 3.87Å; T125-L134 HydrophobicContact CG2-CG 3.97Å
126	G	90.5	Very high	90.5	Very high	5 Å²	5	63 Å²	63	5%	0.052	33%	0.329	C	S	.	.			trans	-178.1	179.9	-177.9	0	0	0	0	0	112	Y124 E128 A131	Y124-G126 PolarHBondContact O-N 2.84Å; G126-E128 VanDerWaalsContact C-N 3.35Å; G126-A131 WeakPolarHBondContact O-CB 3.4Å
127	P	88.3	Confident	90.4	Very high	57 Å²	57	63.1 Å²	63.1	37%	0.37	33%	0.33	S	S	.	.	S	Bend	trans	-79.5	-8.6	-179.1	32.7	-39	0	0	0	115	W97 W113	W97-P127 HydrophobicContact CZ2-CG 4.23Å; W113-P127 HydrophobicContact CD2-CB 3.79Å; W113-P127 HydrophobicContact CE3-CB 4.11Å; W113-P127 HydrophobicContact CG-CB 4.17Å; W113-P127 HydrophobicContact CH2-CB 4.39Å; W113-P127 HydrophobicContact CZ2-CB 4.08Å; W113-P127 HydrophobicContact CZ3-CB 4.4Å
128	E	88.3	Confident	90.4	Very high	133 Å²	133	66.3 Å²	66.3	62%	0.621	35%	0.348	S	S	*	.	S	Bend	trans	-62.6	142.1	-172.6	-19.1	-54.1	143.9	0	0	112.1	G126 G130 A131	G126-E128 VanDerWaalsContact C-N 3.35Å; E128-G130 PolarHBondContact O-N 3.42Å; E128-G130 VanDerWaalsContact O-N 3.13Å; E128-A131 WeakPolarHBondContact O-CB 3.43Å; E128-A131 PolarHBondContact O-N 2.95Å
129	K	74.1	Confident	90.6	Very high	185 Å²	185	62.1 Å²	62.1	80%	0.804	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	118.1	167.6	-71.2	-159.2	171.4	-160	0	108.8	E89	E89-K129 WeakPolarHBondContact OE1-CE 3.34Å; E89-K129 IonicContact OE1-NZ 3.79Å; E89-K129 PolarHBondContact OE1-NZ 2.8Å
130	G	77.3	Confident	90.7	Very high	83 Å²	83	59.1 Å²	59.1	86%	0.856	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	3.3	-170.8	0	0	0	0	0	115.4	E128	E128-G130 PolarHBondContact O-N 3.42Å; E128-G130 VanDerWaalsContact O-N 3.13Å
131	A	86.9	Confident	90.6	Very high	19 Å²	19	60.1 Å²	60.1	16%	0.157	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-58	143.3	171.7	0	0	0	0	0	111.9	G126 E128 R133	G126-A131 WeakPolarHBondContact O-CB 3.4Å; E128-A131 WeakPolarHBondContact O-CB 3.43Å; E128-A131 PolarHBondContact O-N 2.95Å; A131-R133 PolarHBondContact O-N 3.43Å
132	R	90.9	Very high	90.4	Very high	189 Å²	189	61 Å²	61	71%	0.713	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-72.9	122.1	-177.5	176.9	176.4	177	-179.9	1.1	110.3	Y124 T125 L134	Y124-R132 WeakPolarHBondContact CA-O 3.27Å; T125-R132 HydrophobicContact CG2-CB 3.99Å; T125-R132 PolarHBondContact N-O 2.79Å; T125-R132 PolarHBondContact OG1-N 3.14Å; T125-R132 VanDerWaalsContact OG1-N 3.17Å; R132-L134 HydrophobicContact CG-CD2 4.31Å; R132-L134 PolarHBondContact O-N 2.97Å
133	R	92.9	Very high	90.2	Very high	136 Å²	136	61 Å²	61	51%	0.513	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	129.3	165.1	-173.3	163.7	65.9	176.9	1.8	109.5	D122 Y124 A131	D122-R133 WeakPolarHBondContact OD2-CD 3.4Å; D122-R133 IonicContact OD2-CZ 3.92Å; D122-R133 IonicContact OD2-NE 2.63Å; D122-R133 IonicContact OD2-NH1 2.72Å; D122-R133 PolarHBondContact OD2-NH1 3.42Å; Y124-R133 HydrophobicContact CD1-CB 3.92Å; Y124-R133 HydrophobicContact CE1-CB 3.66Å; Y124-R133 HydrophobicContact CE1-CG 4.19Å; A131-R133 PolarHBondContact O-N 3.43Å
134	L	91.8	Very high	90.1	Very high	61 Å²	61	60.7 Å²	60.7	32%	0.319	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-17.3	-178.1	-64.6	177.6	0	0	0	112.6	Y112 Y123 T125 R132	Y112-L134 HydrophobicContact CD1-CD1 3.61Å; Y112-L134 HydrophobicContact CE1-CD1 3.45Å; Y112-L134 VanDerWaalsContact CE1-CD1 3.45Å; Y123-L134 HydrophobicContact CD2-CB 3.79Å; Y123-L134 HydrophobicContact CD2-CD1 4.27Å; Y123-L134 HydrophobicContact CE1-CB 4.48Å; Y123-L134 HydrophobicContact CE2-CB 3.34Å; Y123-L134 HydrophobicContact CE2-CD1 4.06Å; Y123-L134 HydrophobicContact CE2-CG 4.36Å; Y123-L134 PolarHBondContact O-N 3.37Å; Y123-L134 PolarHBondContact OH-O 3.06Å; Y123-L134 VanDerWaalsContact OH-O 3.06Å; T125-L134 HydrophobicContact CG2-CD1 3.88Å; T125-L134 HydrophobicContact CG2-CD2 3.87Å; T125-L134 HydrophobicContact CG2-CG 3.97Å; R132-L134 HydrophobicContact CG-CD2 4.31Å; R132-L134 PolarHBondContact O-N 2.97Å
135	G	91	Very high	89.9	Confident	19 Å²	19	58.7 Å²	58.7	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	172.5	168.2	0	0	0	0	0	111.8	Y123	Y123-G135 VanDerWaalsContact CE1-CA 3.41Å; Y123-G135 PolarHBondContact N-O 2.79Å; Y123-G135 VanDerWaalsContact N-O 3.09Å; Y123-G135 PolarHBondContact O-N 2.96Å
136	T	93.5	Very high	89.8	Confident	43 Å²	43	56.4 Å²	56.4	26%	0.264	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.3	180	-178.3	0	0	0	0	109.1	S120 D122 H168 Y170	S120-T136 WeakPolarHBondContact CB-OG1 3.4Å; D122-T136 WeakPolarHBondContact OD1-CA 3.45Å; D122-T136 WeakPolarHBondContact OD1-CB 3.28Å; D122-T136 PolarHBondContact OD1-OG1 2.93Å; T136-H168 PolarHBondContact O-CD2 2.87Å; T136-Y170 PolarHBondContact N-OH 3.3Å; T136-Y170 PolarHBondContact O-OH 2.92Å; T136-Y170 VanDerWaalsContact O-OH 3.08Å
137	L	93.7	Very high	89.7	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	104.7	167.7	-174	162	0	0	0	106.8	S120 L121 L139 V163 H168 Y170	S120-L137 VanDerWaalsContact CA-O 3.32Å; S120-L137 WeakPolarHBondContact CA-O 3.32Å; L121-L137 HydrophobicContact CB-CB 4.47Å; L121-L137 PolarHBondContact N-O 2.82Å; L121-L137 PolarHBondContact O-N 3.43Å; L137-L139 HydrophobicContact CD2-CD2 3.72Å; L137-L139 PolarHBondContact O-N 3.03Å; L137-V163 HydrophobicContact CD1-CB 4.24Å; L137-V163 HydrophobicContact CD1-CG1 3.98Å; L137-V163 HydrophobicContact CD2-CG1 3.97Å; L137-H168 HydrophobicContact CD1-CB 4.47Å; L137-H168 WeakPolarHBondContact CD1-O 3.22Å; L137-Y170 HydrophobicContact CB-CD2 3.97Å; L137-Y170 HydrophobicContact CB-CE1 4.39Å; L137-Y170 HydrophobicContact CB-CE2 3.65Å; L137-Y170 HydrophobicContact CB-CG 4.49Å; L137-Y170 HydrophobicContact CD1-CD1 3.96Å; L137-Y170 HydrophobicContact CD1-CD2 3.9Å; L137-Y170 HydrophobicContact CD1-CE1 4.39Å; L137-Y170 HydrophobicContact CD1-CE2 4.36Å; L137-Y170 HydrophobicContact CD1-CG 3.68Å
138	V	94.1	Very high	89.8	Confident	91 Å²	91	59.7 Å²	59.7	55%	0.552	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.4	178.1	-179.6	0	0	0	0	109.5	T140	V138-T140 HydrophobicContact CG1-CG2 4.47Å
139	L	93.1	Very high	89.6	Confident	4 Å²	4	56 Å²	56	2%	0.021	30%	0.295	C	S	.	.			trans	-94.5	117.5	-176.3	-64.2	172.1	0	0	0	110.3	L116 D119 L137 C143 V163 I187 I190 I191 K194	L116-L139 HydrophobicContact CD1-CD1 3.62Å; D119-L139 PolarHBondContact O-N 2.84Å; L137-L139 HydrophobicContact CD2-CD2 3.72Å; L137-L139 PolarHBondContact O-N 3.03Å; L139-C143 HydrophobicContact CD2-CB 4.38Å; L139-V163 HydrophobicContact CD2-CG1 4.4Å; L139-I187 HydrophobicContact CD2-CG2 4.08Å; L139-I190 HydrophobicContact CB-CG2 4.33Å; L139-I190 HydrophobicContact CD1-CB 4.38Å; L139-I190 HydrophobicContact CD1-CG2 3.79Å; L139-I191 HydrophobicContact CD2-CD1 4.35Å; L139-I191 HydrophobicContact CD2-CG1 4.25Å; L139-K194 WeakPolarHBondContact O-CE 3.45Å
140	T	93.8	Very high	89.9	Confident	31 Å²	31	54.6 Å²	54.6	19%	0.19	29%	0.29	C	S	.	.			trans	-122	171.4	173.9	73.3	0	0	0	0	109.9	V138 L142 C143 Y244	V138-T140 HydrophobicContact CG1-CG2 4.47Å; T140-L142 PolarHBondContact O-N 3.12Å; T140-L142 PolarHBondContact OG1-N 3.3Å; T140-C143 PolarHBondContact N-SG 3.05Å; T140-C143 WeakPolarHBondContact O-CB 3.35Å; T140-C143 PolarHBondContact O-N 3.03Å; T140-Y244 WeakPolarHBondContact OG1-CE2 3.32Å
141	S	91.6	Very high	90.1	Very high	34 Å²	34	56.7 Å²	56.7	24%	0.238	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.2	175.5	80.1	0	0	0	0	114.4	P196 V197	S141-P196 WeakPolarHBondContact OG-CA 3.46Å; S141-V197 PolarHBondContact OG-N 2.8Å
142	L	90.9	Very high	89.6	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.105	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-3.4	176.7	-55.3	-176.9	0	0	0	112.4	T140 V197 P241 P243 Y244	T140-L142 PolarHBondContact O-N 3.12Å; T140-L142 PolarHBondContact OG1-N 3.3Å; L142-V197 HydrophobicContact CD1-CB 3.8Å; L142-V197 HydrophobicContact CD1-CG1 3.92Å; L142-V197 HydrophobicContact CD1-CG2 4.22Å; L142-V197 HydrophobicContact CG-CB 3.9Å; L142-V197 HydrophobicContact CG-CG2 4.01Å; L142-P241 HydrophobicContact CD1-CB 3.97Å; L142-P241 HydrophobicContact CD2-CB 3.93Å; L142-P243 CarbonylContact O-C 3.59Å; L142-P243 VanDerWaalsContact O-CA 3.28Å; L142-P243 WeakPolarHBondContact O-CA 3.17Å; L142-Y244 HydrophobicContact CB-CD1 4.41Å; L142-Y244 HydrophobicContact CB-CD2 4.11Å; L142-Y244 HydrophobicContact CB-CE1 4.04Å; L142-Y244 HydrophobicContact CB-CE2 3.74Å; L142-Y244 HydrophobicContact CB-CG 4.45Å; L142-Y244 HydrophobicContact CD1-CE1 4.26Å; L142-Y244 VanDerWaalsContact O-CD2 3.24Å; L142-Y244 WeakPolarHBondContact O-CD2 3.42Å; L142-Y244 PolarHBondContact O-N 3.09Å
143	C	92.3	Very high	89.3	Confident	6 Å²	6	52.2 Å²	52.2	4%	0.041	26%	0.259	C	S	.	.			trans	-66.8	152	168	-72.2	0	0	0	0	110.7	L139 T140 Y164 I191	L139-C143 HydrophobicContact CD2-CB 4.38Å; T140-C143 PolarHBondContact N-SG 3.05Å; T140-C143 WeakPolarHBondContact O-CB 3.35Å; T140-C143 PolarHBondContact O-N 3.03Å; C143-Y164 WeakPolarHBondContact CA-O 3.47Å; C143-Y164 WeakPolarHBondContact CB-O 3.45Å; C143-Y164 PolarHBondContact SG-O 3.13Å; C143-Y164 VanDerWaalsContact SG-O 3.34Å; C143-I191 HydrophobicContact CB-CD1 3.56Å; C143-I191 HydrophobicContact CB-CG1 3.83Å; C143-I191 WeakPolarHBondContact O-CG2 3.48Å
144	S	90.4	Very high	88.8	Confident	22 Å²	22	53.7 Å²	53.7	15%	0.154	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	154.5	174.7	63.6	0	0	0	0	111.9	Y164 G245	S144-Y164 PolarHBondContact N-O 3.13Å; S144-Y164 PolarHBondContact O-N 3.48Å; S144-G245 VanDerWaalsContact OG-CA 3.29Å; S144-G245 WeakPolarHBondContact OG-CA 3.34Å; S144-G245 PolarHBondContact OG-N 3.02Å
145	V	91.1	Very high	88.2	Confident	12 Å²	12	57.3 Å²	57.3	7%	0.073	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.2	-174.2	-174.2	0	0	0	0	109.7	I161 T162 A184 I187 I191	V145-I161 HydrophobicContact CG1-CG2 3.54Å; V145-T162 CarbonylContact C-O 3.59Å; V145-T162 WeakPolarHBondContact CA-O 3.37Å; V145-A184 HydrophobicContact CG1-CB 4.03Å; V145-I187 HydrophobicContact CG2-CB 4.18Å; V145-I187 HydrophobicContact CG2-CG2 3.64Å; V145-I191 HydrophobicContact CG2-CD1 3.81Å
146	I	88.9	Confident	87.5	Confident	32 Å²	32	58.3 Å²	58.3	16%	0.164	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.7	163.7	-60.7	175.4	0	0	0	107.8	I161 T162 Y164 H249	I146-I161 WeakPolarHBondContact O-CG2 3.43Å; I146-T162 HydrophobicContact CD1-CG2 4.48Å; I146-T162 PolarHBondContact N-O 3.26Å; I146-T162 PolarHBondContact O-N 3.49Å; I146-Y164 HydrophobicContact CD1-CE2 3.63Å; I146-Y164 HydrophobicContact CG1-CE2 3.98Å; I146-H249 VanDerWaalsContact CD1-NE2 3.32Å; I146-H249 WeakPolarHBondContact CD1-NE2 3.17Å
147	W	89.9	Confident	87.1	Confident	115 Å²	115	58.3 Å²	58.3	44%	0.436	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-75.9	152.8	179.8	-70.3	75.2	0	0	0	112.1	D149 V181 A184 C185 Q188	W147-D149 PolarHBondContact O-N 2.99Å; W147-V181 HydrophobicContact CZ3-CG1 4.37Å; W147-A184 HydrophobicContact CD2-CB 4.02Å; W147-A184 HydrophobicContact CE3-CB 3.73Å; W147-A184 HydrophobicContact CH2-CB 4.39Å; W147-A184 HydrophobicContact CZ3-CB 3.93Å; W147-C185 HydrophobicContact CH2-CB 4.31Å; W147-C185 VanDerWaalsContact CH2-SG 3.55Å; W147-C185 VanDerWaalsContact CZ3-SG 3.57Å; W147-Q188 HydrophobicContact CZ2-CB 4.19Å; W147-Q188 HydrophobicContact CZ2-CG 4.31Å
148	P	89.3	Confident	86.9	Confident	15 Å²	15	61 Å²	61	10%	0.097	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.9	117.1	-177.6	25.8	-35.3	0	0	0	113	W159 S160 F177 A180 V181	P148-W159 HydrophobicContact CB-CB 4.32Å; P148-W159 HydrophobicContact CB-CE3 4.1Å; P148-S160 WeakPolarHBondContact CA-O 3.24Å; P148-S160 WeakPolarHBondContact CB-O 3.41Å; P148-F177 HydrophobicContact CB-CD2 4.45Å; P148-F177 HydrophobicContact CB-CE2 4.38Å; P148-F177 HydrophobicContact CG-CD2 4.4Å; P148-F177 HydrophobicContact CG-CE2 4.1Å; P148-A180 HydrophobicContact CB-CB 3.76Å; P148-A180 HydrophobicContact CG-CB 3.81Å; P148-V181 HydrophobicContact CG-CG2 3.72Å
149	D	83.6	Confident	86.8	Confident	55 Å²	55	58.5 Å²	58.5	29%	0.294	29%	0.29	S	S	.	.			trans	-105.9	160	-176.8	84.2	88.6	0	0	0	113.5	W147 Q151 T152 Y153 W159	W147-D149 PolarHBondContact O-N 2.99Å; D149-Q151 VanDerWaalsContact OD1-CA 3.26Å; D149-Q151 WeakPolarHBondContact OD1-CA 3.5Å; D149-Q151 VanDerWaalsContact OD1-CB 3.28Å; D149-Q151 WeakPolarHBondContact OD1-CB 3.46Å; D149-Q151 PolarHBondContact OD1-N 2.66Å; D149-T152 PolarHBondContact OD1-N 2.75Å; D149-T152 WeakPolarHBondContact OD2-CB 3.19Å; D149-T152 PolarHBondContact OD2-OG1 2.85Å; D149-Y153 PolarHBondContact O-N 2.91Å; D149-W159 VanDerWaalsContact O-CZ3 3.28Å; D149-W159 WeakPolarHBondContact O-CZ3 3.36Å
150	K	80.8	Confident	86.6	Confident	157 Å²	157	58.5 Å²	58.5	68%	0.683	29%	0.29	S	S	*	.	H	α-helix	trans	-81.6	-15	-175.1	-168.9	173.9	-178.4	177.5	0	113.8	K154	K150-K154 WeakPolarHBondContact O-CG 3.44Å
151	Q	80.7	Confident	86.6	Confident	126 Å²	126	57.1 Å²	57.1	59%	0.589	28%	0.282	S	S	*	.	H	α-helix	trans	-81	-51.6	175.3	176.5	171.4	-15.8	0	0	110.5	D149 Y153 K154 E155	D149-Q151 VanDerWaalsContact OD1-CA 3.26Å; D149-Q151 WeakPolarHBondContact OD1-CA 3.5Å; D149-Q151 VanDerWaalsContact OD1-CB 3.28Å; D149-Q151 WeakPolarHBondContact OD1-CB 3.46Å; D149-Q151 PolarHBondContact OD1-N 2.66Å; Q151-Y153 PolarHBondContact O-N 3.49Å; Q151-K154 WeakPolarHBondContact O-CB 3.48Å; Q151-K154 PolarHBondContact O-N 3.47Å; Q151-E155 WeakPolarHBondContact CG-OE1 3.38Å; Q151-E155 PolarHBondContact NE2-OE1 3.47Å; Q151-E155 PolarHBondContact O-N 2.97Å; Q151-E155 VanDerWaalsContact O-N 3.13Å
152	T	78.3	Confident	86.6	Confident	21 Å²	21	56 Å²	56	13%	0.129	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-35	176.7	-51.6	0	0	0	0	111.4	D149 K154 E155 A156 S160	D149-T152 PolarHBondContact OD1-N 2.75Å; D149-T152 WeakPolarHBondContact OD2-CB 3.19Å; D149-T152 PolarHBondContact OD2-OG1 2.85Å; T152-K154 PolarHBondContact O-N 3.05Å; T152-E155 PolarHBondContact O-N 3.47Å; T152-A156 WeakPolarHBondContact O-CB 3.27Å; T152-A156 PolarHBondContact O-N 3.37Å; T152-S160 VanDerWaalsContact CG2-OG 3.26Å; T152-S160 WeakPolarHBondContact CG2-OG 3.4Å
153	Y	84.5	Confident	86.7	Confident	94 Å²	94	55 Å²	55	37%	0.369	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-39.9	172.4	-179.3	-96	0	0	0	113.7	D149 Q151 E155 G157 Y158 W159	D149-Y153 PolarHBondContact O-N 2.91Å; Q151-Y153 PolarHBondContact O-N 3.49Å; Y153-E155 VanDerWaalsContact C-N 3.33Å; Y153-G157 VanDerWaalsContact O-CA 3.28Å; Y153-G157 WeakPolarHBondContact O-CA 3.44Å; Y153-G157 PolarHBondContact O-N 2.93Å; Y153-Y158 WeakPolarHBondContact CA-O 3.42Å; Y153-W159 HydrophobicContact CD1-CZ2 4.17Å; Y153-W159 AromaticContact CD2-CD1 3.51Å; Y153-W159 AromaticContact CD2-CD2 3.65Å; Y153-W159 HydrophobicContact CD2-CD2 3.65Å; Y153-W159 AromaticContact CD2-CE2 3.41Å; Y153-W159 VanDerWaalsContact CD2-CE2 3.41Å; Y153-W159 HydrophobicContact CD2-CE3 4.4Å; Y153-W159 AromaticContact CD2-CG 3.75Å; Y153-W159 HydrophobicContact CD2-CG 3.75Å; Y153-W159 HydrophobicContact CD2-CZ2 4.03Å; Y153-W159 AromaticContact CD2-NE1 3.28Å; Y153-W159 VanDerWaalsContact CD2-NE1 3.28Å; Y153-W159 AromaticContact CE2-CD1 3.7Å; Y153-W159 HydrophobicContact CE2-CD2 4.47Å; Y153-W159 AromaticContact CE2-CE2 3.89Å; Y153-W159 HydrophobicContact CE2-CG 4.39Å; Y153-W159 HydrophobicContact CE2-CZ2 4.49Å; Y153-W159 AromaticContact CE2-NE1 3.34Å; Y153-W159 VanDerWaalsContact CE2-NE1 3.34Å; Y153-W159 AromaticContact CG-CD2 3.98Å; Y153-W159 HydrophobicContact CG-CD2 3.98Å; Y153-W159 AromaticContact CG-CE2 3.69Å; Y153-W159 HydrophobicContact CG-CE3 4.32Å; Y153-W159 HydrophobicContact CG-CH2 4.27Å; Y153-W159 AromaticContact CG-CZ2 3.85Å; Y153-W159 HydrophobicContact CG-CZ2 3.85Å; Y153-W159 HydrophobicContact CG-CZ3 4.48Å
154	K	81	Confident	86.6	Confident	167 Å²	167	57.5 Å²	57.5	73%	0.726	28%	0.278	S	S	*	.	H	α-helix	trans	-66.6	-35.5	176.3	-72.6	169.8	178.2	-178.7	0	112.2	K150 Q151 T152	K150-K154 WeakPolarHBondContact O-CG 3.44Å; Q151-K154 WeakPolarHBondContact O-CB 3.48Å; Q151-K154 PolarHBondContact O-N 3.47Å; T152-K154 PolarHBondContact O-N 3.05Å
155	E	79.3	Confident	86.5	Confident	136 Å²	136	56.9 Å²	56.9	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-81.2	-41.6	-175.5	-67	172.2	-166	0	0	112.2	Q151 T152 Y153	Q151-E155 WeakPolarHBondContact CG-OE1 3.38Å; Q151-E155 PolarHBondContact NE2-OE1 3.47Å; Q151-E155 PolarHBondContact O-N 2.97Å; Q151-E155 VanDerWaalsContact O-N 3.13Å; T152-E155 PolarHBondContact O-N 3.47Å; Y153-E155 VanDerWaalsContact C-N 3.33Å
156	A	77.5	Confident	86.2	Confident	41 Å²	41	61.8 Å²	61.8	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-100.9	-20.5	-174.9	0	0	0	0	0	114.8	T152 Y158	T152-A156 WeakPolarHBondContact O-CB 3.27Å; T152-A156 PolarHBondContact O-N 3.37Å; A156-Y158 WeakPolarHBondContact O-CD2 3.44Å; A156-Y158 PolarHBondContact O-N 3.21Å
157	G	85.3	Confident	85.9	Confident	42 Å²	42	65.8 Å²	65.8	43%	0.433	31%	0.308	S	S	.	.	S	Bend	trans	73	9.7	-170.9	0	0	0	0	0	114.7	Y153	Y153-G157 VanDerWaalsContact O-CA 3.28Å; Y153-G157 WeakPolarHBondContact O-CA 3.44Å; Y153-G157 PolarHBondContact O-N 2.93Å
158	Y	88.6	Confident	85.7	Confident	61 Å²	61	65 Å²	65	24%	0.239	31%	0.309	C	S	.	.	S	Bend	trans	-134.9	147.4	177.3	-67.5	-93.8	0	0	0	109.8	L99 Y153 A156 T174 K175	L99-Y158 HydrophobicContact CD1-CE1 4.25Å; L99-Y158 HydrophobicContact CD2-CE1 4.34Å; Y153-Y158 WeakPolarHBondContact CA-O 3.42Å; A156-Y158 WeakPolarHBondContact O-CD2 3.44Å; A156-Y158 PolarHBondContact O-N 3.21Å; Y158-T174 CarbonylContact C-O 3.6Å; Y158-K175 HydrophobicContact CD1-CG 3.77Å; Y158-K175 HydrophobicContact CE1-CD 4.27Å; Y158-K175 HydrophobicContact CE1-CG 3.52Å
159	W	91.1	Very high	85.7	Confident	38 Å²	38	67.2 Å²	67.2	14%	0.144	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	124.8	170.2	-64.2	96.8	0	0	0	109	P148 D149 Y153 Y173 T174 F177 A180	P148-W159 HydrophobicContact CB-CB 4.32Å; P148-W159 HydrophobicContact CB-CE3 4.1Å; D149-W159 VanDerWaalsContact O-CZ3 3.28Å; D149-W159 WeakPolarHBondContact O-CZ3 3.36Å; Y153-W159 HydrophobicContact CD1-CZ2 4.17Å; Y153-W159 AromaticContact CD2-CD1 3.51Å; Y153-W159 AromaticContact CD2-CD2 3.65Å; Y153-W159 HydrophobicContact CD2-CD2 3.65Å; Y153-W159 AromaticContact CD2-CE2 3.41Å; Y153-W159 VanDerWaalsContact CD2-CE2 3.41Å; Y153-W159 HydrophobicContact CD2-CE3 4.4Å; Y153-W159 AromaticContact CD2-CG 3.75Å; Y153-W159 HydrophobicContact CD2-CG 3.75Å; Y153-W159 HydrophobicContact CD2-CZ2 4.03Å; Y153-W159 AromaticContact CD2-NE1 3.28Å; Y153-W159 VanDerWaalsContact CD2-NE1 3.28Å; Y153-W159 AromaticContact CE2-CD1 3.7Å; Y153-W159 HydrophobicContact CE2-CD2 4.47Å; Y153-W159 AromaticContact CE2-CE2 3.89Å; Y153-W159 HydrophobicContact CE2-CG 4.39Å; Y153-W159 HydrophobicContact CE2-CZ2 4.49Å; Y153-W159 AromaticContact CE2-NE1 3.34Å; Y153-W159 VanDerWaalsContact CE2-NE1 3.34Å; Y153-W159 AromaticContact CG-CD2 3.98Å; Y153-W159 HydrophobicContact CG-CD2 3.98Å; Y153-W159 AromaticContact CG-CE2 3.69Å; Y153-W159 HydrophobicContact CG-CE3 4.32Å; Y153-W159 HydrophobicContact CG-CH2 4.27Å; Y153-W159 AromaticContact CG-CZ2 3.85Å; Y153-W159 HydrophobicContact CG-CZ2 3.85Å; Y153-W159 HydrophobicContact CG-CZ3 4.48Å; W159-Y173 WeakPolarHBondContact O-CA 3.43Å; W159-T174 PolarHBondContact N-O 3.46Å; W159-T174 PolarHBondContact O-N 3.15Å; W159-F177 HydrophobicContact CD2-CB 4.06Å; W159-F177 AromaticContact CD2-CD2 3.72Å; W159-F177 HydrophobicContact CD2-CD2 3.72Å; W159-F177 HydrophobicContact CD2-CG 4.36Å; W159-F177 AromaticContact CE2-CD2 3.95Å; W159-F177 AromaticContact CE3-CD2 3.55Å; W159-F177 HydrophobicContact CE3-CD2 3.55Å; W159-F177 HydrophobicContact CE3-CE2 4.15Å; W159-F177 HydrophobicContact CG-CB 4.3Å; W159-F177 HydrophobicContact CG-CD2 4.45Å; W159-F177 AromaticContact CH2-CD2 3.81Å; W159-F177 HydrophobicContact CH2-CD2 3.81Å; W159-F177 HydrophobicContact CH2-CE2 4.31Å; W159-F177 HydrophobicContact CH2-CG 4.41Å; W159-F177 HydrophobicContact CZ2-CB 4.03Å; W159-F177 HydrophobicContact CZ2-CD2 4.01Å; W159-F177 HydrophobicContact CZ2-CG 4.25Å; W159-F177 AromaticContact CZ3-CD2 3.58Å; W159-F177 HydrophobicContact CZ3-CD2 3.58Å; W159-F177 AromaticContact CZ3-CE2 3.91Å; W159-F177 HydrophobicContact CZ3-CE2 3.91Å; W159-A180 HydrophobicContact CB-CB 3.75Å
160	S	90.4	Very high	86.1	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	149.7	-177.8	56.7	0	0	0	0	113	P148 T152 L172	P148-S160 WeakPolarHBondContact CA-O 3.24Å; P148-S160 WeakPolarHBondContact CB-O 3.41Å; T152-S160 VanDerWaalsContact CG2-OG 3.26Å; T152-S160 WeakPolarHBondContact CG2-OG 3.4Å; S160-L172 CarbonylContact C-O 3.57Å; S160-L172 WeakPolarHBondContact CA-O 3.46Å
161	I	92.7	Very high	86.5	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.8	164	-44.4	168	0	0	0	106.4	V145 I146 V163 L172 A180 W183 A184	V145-I161 HydrophobicContact CG1-CG2 3.54Å; I146-I161 WeakPolarHBondContact O-CG2 3.43Å; I161-V163 HydrophobicContact CG2-CG2 4.31Å; I161-L172 HydrophobicContact CB-CB 4.45Å; I161-L172 PolarHBondContact N-O 3.18Å; I161-L172 PolarHBondContact O-N 3.22Å; I161-A180 HydrophobicContact CD1-CB 4.47Å; I161-A180 WeakPolarHBondContact CD1-O 3.42Å; I161-A180 HydrophobicContact CG1-CB 4.21Å; I161-W183 HydrophobicContact CD1-CB 3.41Å; I161-W183 VanDerWaalsContact CD1-CB 3.41Å; I161-W183 HydrophobicContact CD1-CG 4.39Å; I161-A184 HydrophobicContact CG2-CB 4.26Å
162	T	91.6	Very high	87.1	Confident	11 Å²	11	55.7 Å²	55.7	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.2	173.4	-45.8	0	0	0	0	109.8	V145 I146 Y164 C169 R171	V145-T162 CarbonylContact C-O 3.59Å; V145-T162 WeakPolarHBondContact CA-O 3.37Å; I146-T162 HydrophobicContact CD1-CG2 4.48Å; I146-T162 PolarHBondContact N-O 3.26Å; I146-T162 PolarHBondContact O-N 3.49Å; T162-Y164 HydrophobicContact CG2-CD2 4.13Å; T162-Y164 HydrophobicContact CG2-CE2 3.43Å; T162-Y164 VanDerWaalsContact CG2-CE2 3.43Å; T162-C169 WeakPolarHBondContact CG2-SG 3.42Å; T162-R171 HydrophobicContact CG2-CB 4.44Å; T162-R171 HydrophobicContact CG2-CG 4.5Å
163	V	92.6	Very high	87.8	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.6	179.8	-172.1	0	0	0	0	109.3	L121 L137 L139 I161 C169 Y170 L172 I187	L121-V163 HydrophobicContact CD2-CG2 4.08Å; L137-V163 HydrophobicContact CD1-CB 4.24Å; L137-V163 HydrophobicContact CD1-CG1 3.98Å; L137-V163 HydrophobicContact CD2-CG1 3.97Å; L139-V163 HydrophobicContact CD2-CG1 4.4Å; I161-V163 HydrophobicContact CG2-CG2 4.31Å; V163-C169 WeakPolarHBondContact O-CA 3.46Å; V163-Y170 PolarHBondContact N-O 2.82Å; V163-Y170 PolarHBondContact O-N 2.68Å; V163-L172 HydrophobicContact CG2-CD1 4.27Å; V163-I187 HydrophobicContact CG1-CG2 4.12Å; V163-I187 HydrophobicContact CG2-CD1 3.92Å; V163-I187 HydrophobicContact CG2-CG2 4.41Å
164	Y	91.1	Very high	88.2	Confident	58 Å²	58	50.9 Å²	50.9	23%	0.227	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123	178.6	-67	-101	0	0	0	110.8	C143 S144 I146 T162 C169 G245	C143-Y164 WeakPolarHBondContact CA-O 3.47Å; C143-Y164 WeakPolarHBondContact CB-O 3.45Å; C143-Y164 PolarHBondContact SG-O 3.13Å; C143-Y164 VanDerWaalsContact SG-O 3.34Å; S144-Y164 PolarHBondContact N-O 3.13Å; S144-Y164 PolarHBondContact O-N 3.48Å; I146-Y164 HydrophobicContact CD1-CE2 3.63Å; I146-Y164 HydrophobicContact CG1-CE2 3.98Å; T162-Y164 HydrophobicContact CG2-CD2 4.13Å; T162-Y164 HydrophobicContact CG2-CE2 3.43Å; T162-Y164 VanDerWaalsContact CG2-CE2 3.43Å; Y164-C169 HydrophobicContact CD1-CB 4.22Å; Y164-C169 HydrophobicContact CE1-CB 4.36Å; Y164-G245 VanDerWaalsContact CD1-CA 3.47Å
165	G	89.4	Confident	88.6	Confident	9 Å²	9	49.1 Å²	49.1	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	167.4	172.3	0	0	0	0	0	112.2	K167 H168 Y244	G165-K167 VanDerWaalsContact C-N 3.26Å; G165-K167 PolarHBondContact O-N 2.9Å; G165-H168 WeakPolarHBondContact CA-O 3.48Å; G165-H168 PolarHBondContact N-O 3.03Å; G165-H168 PolarHBondContact O-N 2.88Å; G165-H168 VanDerWaalsContact O-N 3.09Å; G165-Y244 VanDerWaalsContact C-CD2 3.49Å
166	R	84.3	Confident	89.2	Confident	115 Å²	115	48.5 Å²	48.5	43%	0.434	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-39.7	-167.8	-176.5	175.6	171	170.6	-2.9	115.7	F32 Y244 R261	F32-R166 PolarHBondContact O-NH1 3.06Å; F32-R166 PolarHBondContact O-NH2 2.83Å; R166-Y244 HydrophobicContact CB-CE1 4.12Å; R166-Y244 HydrophobicContact CB-CE2 3.87Å; R166-Y244 HydrophobicContact CG-CE1 4.29Å; R166-Y244 VanDerWaalsContact N-CD2 3.33Å; R166-R261 PolarHBondContact O-NH1 3.18Å
167	K	81.5	Confident	89.9	Confident	116 Å²	116	50.8 Å²	50.8	50%	0.504	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-4.1	178.1	-71.9	-152.2	168.4	-146.7	0	114.2	E27 E29 G165	E27-K167 IonicContact OE1-NZ 2.7Å; E27-K167 IonicContact OE2-NZ 2.86Å; E27-K167 PolarHBondContact OE2-NZ 3.31Å; E29-K167 WeakPolarHBondContact OE2-CE 3.19Å; E29-K167 IonicContact OE2-NZ 2.65Å; E29-K167 PolarHBondContact OE2-NZ 3.14Å; G165-K167 VanDerWaalsContact C-N 3.26Å; G165-K167 PolarHBondContact O-N 2.9Å
168	H	85.6	Confident	90.2	Very high	98 Å²	98	55 Å²	55	45%	0.454	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	130	-166.5	-67.1	-21.5	0	0	0	112.4	T136 L137 G165 Y170	T136-H168 PolarHBondContact O-CD2 2.87Å; L137-H168 HydrophobicContact CD1-CB 4.47Å; L137-H168 WeakPolarHBondContact CD1-O 3.22Å; G165-H168 WeakPolarHBondContact CA-O 3.48Å; G165-H168 PolarHBondContact N-O 3.03Å; G165-H168 PolarHBondContact O-N 2.88Å; G165-H168 VanDerWaalsContact O-N 3.09Å; H168-Y170 HydrophobicContact CB-CD1 4.28Å; H168-Y170 HydrophobicContact CB-CE1 3.89Å
169	C	89.1	Confident	90.5	Very high	61 Å²	61	55 Å²	55	41%	0.412	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.8	167.2	178.9	0	0	0	0	109.5	T162 V163 Y164	T162-C169 WeakPolarHBondContact CG2-SG 3.42Å; V163-C169 WeakPolarHBondContact O-CA 3.46Å; Y164-C169 HydrophobicContact CD1-CB 4.22Å; Y164-C169 HydrophobicContact CE1-CB 4.36Å
170	Y	91.9	Very high	90.6	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	102.5	177.9	-77.4	12.3	0	0	0	109.3	F114 L121 Y123 T136 L137 V163 H168	F114-Y170 HydrophobicContact CE1-CD2 4.13Å; F114-Y170 HydrophobicContact CE1-CE2 4.46Å; L121-Y170 HydrophobicContact CD2-CD2 4.34Å; Y123-Y170 AromaticContact CD1-CE2 3.89Å; Y123-Y170 HydrophobicContact CD1-CE2 3.89Å; Y123-Y170 HydrophobicContact CE1-CE2 4.22Å; Y123-Y170 AromaticContact CE1-CZ 3.86Å; Y123-Y170 WeakPolarHBondContact CE1-OH 3.32Å; T136-Y170 PolarHBondContact N-OH 3.3Å; T136-Y170 PolarHBondContact O-OH 2.92Å; T136-Y170 VanDerWaalsContact O-OH 3.08Å; L137-Y170 HydrophobicContact CB-CD2 3.97Å; L137-Y170 HydrophobicContact CB-CE1 4.39Å; L137-Y170 HydrophobicContact CB-CE2 3.65Å; L137-Y170 HydrophobicContact CB-CG 4.49Å; L137-Y170 HydrophobicContact CD1-CD1 3.96Å; L137-Y170 HydrophobicContact CD1-CD2 3.9Å; L137-Y170 HydrophobicContact CD1-CE1 4.39Å; L137-Y170 HydrophobicContact CD1-CE2 4.36Å; L137-Y170 HydrophobicContact CD1-CG 3.68Å; V163-Y170 PolarHBondContact N-O 2.82Å; V163-Y170 PolarHBondContact O-N 2.68Å; H168-Y170 HydrophobicContact CB-CD1 4.28Å; H168-Y170 HydrophobicContact CB-CE1 3.89Å
171	R	90.8	Very high	90.7	Very high	93 Å²	93	54.9 Å²	54.9	35%	0.351	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	113.2	169.3	-158.9	172.6	-176.4	-152	6.6	109.6	E101 T162 Y173	E101-R171 IonicContact OE2-NH1 2.69Å; E101-R171 PolarHBondContact OE2-NH1 3.26Å; T162-R171 HydrophobicContact CG2-CB 4.44Å; T162-R171 HydrophobicContact CG2-CG 4.5Å; R171-Y173 HydrophobicContact CB-CE2 4.32Å; R171-Y173 VanDerWaalsContact CD-OH 3.27Å; R171-Y173 WeakPolarHBondContact CD-OH 3.23Å; R171-Y173 HydrophobicContact CG-CE2 3.88Å; R171-Y173 PolarHBondContact NE-OH 2.81Å; R171-Y173 PolarHBondContact NH1-OH 3.1Å
172	L	92.7	Very high	90.8	Very high	0 Å²	0	60 Å²	60	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	149	-169.2	-52.9	176.9	0	0	0	109.6	L98 L99 R100 F114 L121 S160 I161 V163	L98-L172 HydrophobicContact CD1-CB 4.17Å; L98-L172 HydrophobicContact CD1-CD1 3.93Å; L99-L172 CarbonylContact O-C 3.51Å; L99-L172 WeakPolarHBondContact O-CA 3.12Å; R100-L172 HydrophobicContact CB-CD2 4.21Å; R100-L172 HydrophobicContact CG-CD2 4.29Å; F114-L172 HydrophobicContact CD1-CD2 4.42Å; F114-L172 HydrophobicContact CE1-CD1 4.4Å; F114-L172 HydrophobicContact CE1-CD2 3.53Å; F114-L172 HydrophobicContact CE2-CD2 4.01Å; F114-L172 HydrophobicContact CZ-CD2 3.29Å; L121-L172 HydrophobicContact CD2-CD1 3.9Å; S160-L172 CarbonylContact C-O 3.57Å; S160-L172 WeakPolarHBondContact CA-O 3.46Å; I161-L172 HydrophobicContact CB-CB 4.45Å; I161-L172 PolarHBondContact N-O 3.18Å; I161-L172 PolarHBondContact O-N 3.22Å; V163-L172 HydrophobicContact CG2-CD1 4.27Å
173	Y	92.3	Very high	91	Very high	6 Å²	6	59.6 Å²	59.6	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142	-173.7	-56.5	-100.9	0	0	0	112.1	L99 E101 H109 W159 R171	L99-Y173 WeakPolarHBondContact CD1-O 3.26Å; L99-Y173 PolarHBondContact N-O 2.78Å; L99-Y173 PolarHBondContact O-N 3.28Å; E101-Y173 HydrophobicContact CB-CE2 4Å; E101-Y173 PolarHBondContact OE2-OH 3.39Å; H109-Y173 AromaticContact CD2-CD2 3.62Å; H109-Y173 AromaticContact CD2-CE2 3.56Å; H109-Y173 AromaticContact NE2-CD2 3.82Å; H109-Y173 AromaticContact NE2-CE1 3.85Å; H109-Y173 AromaticContact NE2-CE2 3.41Å; H109-Y173 WeakPolarHBondContact NE2-CE2 3.22Å; H109-Y173 AromaticContact NE2-CZ 3.38Å; W159-Y173 WeakPolarHBondContact O-CA 3.43Å; R171-Y173 HydrophobicContact CB-CE2 4.32Å; R171-Y173 VanDerWaalsContact CD-OH 3.27Å; R171-Y173 WeakPolarHBondContact CD-OH 3.23Å; R171-Y173 HydrophobicContact CG-CE2 3.88Å; R171-Y173 PolarHBondContact NE-OH 2.81Å; R171-Y173 PolarHBondContact NH1-OH 3.1Å
174	T	93.3	Very high	91.1	Very high	7 Å²	7	59.6 Å²	59.6	4%	0.043	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	163.1	167.9	174.2	0	0	0	0	111	L98 Y158 W159 H176 E179 A180	L98-T174 HydrophobicContact CD2-CG2 4.4Å; Y158-T174 CarbonylContact C-O 3.6Å; W159-T174 PolarHBondContact N-O 3.46Å; W159-T174 PolarHBondContact O-N 3.15Å; T174-H176 VanDerWaalsContact C-N 3.34Å; T174-H176 WeakPolarHBondContact CG2-O 3.39Å; T174-H176 PolarHBondContact OG1-N 3.24Å; T174-E179 WeakPolarHBondContact CB-OE2 3.36Å; T174-E179 HydrophobicContact CG2-CB 4.11Å; T174-E179 HydrophobicContact CG2-CG 4.14Å; T174-E179 PolarHBondContact OG1-OE2 3.23Å; T174-A180 HydrophobicContact CG2-CB 3.7Å
175	K	90.4	Very high	91.2	Very high	131 Å²	131	59.7 Å²	59.7	57%	0.57	29%	0.285	S	S	*	.	S	Bend	trans	-77.3	-17.3	173.2	-64.2	-171.8	176.4	-171.9	0	113.3	Y158	Y158-K175 HydrophobicContact CD1-CG 3.77Å; Y158-K175 HydrophobicContact CE1-CD 4.27Å; Y158-K175 HydrophobicContact CE1-CG 3.52Å
176	H	91.3	Very high	91.5	Very high	122 Å²	122	59.8 Å²	59.8	57%	0.565	29%	0.286	S	S	*	.			trans	-113.8	120.2	-169	-57.7	-72	0	0	0	112	T174 N178 E179 A180	T174-H176 VanDerWaalsContact C-N 3.34Å; T174-H176 WeakPolarHBondContact CG2-O 3.39Å; T174-H176 PolarHBondContact OG1-N 3.24Å; H176-N178 VanDerWaalsContact C-N 3.33Å; H176-N178 PolarHBondContact O-N 3.4Å; H176-E179 HydrophobicContact CB-CB 4.07Å; H176-E179 PolarHBondContact O-N 2.91Å; H176-E179 VanDerWaalsContact O-N 3.15Å; H176-A180 PolarHBondContact O-N 2.99Å
177	F	91.5	Very high	92	Very high	90 Å²	90	54.3 Å²	54.3	40%	0.395	27%	0.265	S	S	.	.	H	α-helix	trans	-54.3	-48.2	179.2	179.6	-115.5	0	0	0	112.1	P148 W159 E179 A180 V181	P148-F177 HydrophobicContact CB-CD2 4.45Å; P148-F177 HydrophobicContact CB-CE2 4.38Å; P148-F177 HydrophobicContact CG-CD2 4.4Å; P148-F177 HydrophobicContact CG-CE2 4.1Å; W159-F177 HydrophobicContact CD2-CB 4.06Å; W159-F177 AromaticContact CD2-CD2 3.72Å; W159-F177 HydrophobicContact CD2-CD2 3.72Å; W159-F177 HydrophobicContact CD2-CG 4.36Å; W159-F177 AromaticContact CE2-CD2 3.95Å; W159-F177 AromaticContact CE3-CD2 3.55Å; W159-F177 HydrophobicContact CE3-CD2 3.55Å; W159-F177 HydrophobicContact CE3-CE2 4.15Å; W159-F177 HydrophobicContact CG-CB 4.3Å; W159-F177 HydrophobicContact CG-CD2 4.45Å; W159-F177 AromaticContact CH2-CD2 3.81Å; W159-F177 HydrophobicContact CH2-CD2 3.81Å; W159-F177 HydrophobicContact CH2-CE2 4.31Å; W159-F177 HydrophobicContact CH2-CG 4.41Å; W159-F177 HydrophobicContact CZ2-CB 4.03Å; W159-F177 HydrophobicContact CZ2-CD2 4.01Å; W159-F177 HydrophobicContact CZ2-CG 4.25Å; W159-F177 AromaticContact CZ3-CD2 3.58Å; W159-F177 HydrophobicContact CZ3-CD2 3.58Å; W159-F177 AromaticContact CZ3-CE2 3.91Å; W159-F177 HydrophobicContact CZ3-CE2 3.91Å; F177-E179 VanDerWaalsContact C-N 3.27Å; F177-E179 PolarHBondContact O-N 2.82Å; F177-A180 WeakPolarHBondContact O-CB 3.41Å; F177-A180 PolarHBondContact O-N 3.02Å; F177-V181 HydrophobicContact CD1-CG2 4.2Å; F177-V181 HydrophobicContact CD2-CG2 4.05Å; F177-V181 HydrophobicContact CE1-CG2 3.8Å; F177-V181 HydrophobicContact CE2-CG2 3.65Å; F177-V181 HydrophobicContact CG-CG2 4.33Å; F177-V181 HydrophobicContact CZ-CG2 3.51Å; F177-V181 WeakPolarHBondContact O-CG2 3.47Å; F177-V181 PolarHBondContact O-N 2.96Å
178	N	92.6	Very high	92.6	Very high	130 Å²	130	50.9 Å²	50.9	70%	0.695	25%	0.251	S	S	*	.	H	α-helix	trans	-62.7	-32.8	-178.1	-58.9	11.9	0	0	0	112.4	H176 H182	H176-N178 VanDerWaalsContact C-N 3.33Å; H176-N178 PolarHBondContact O-N 3.4Å; N178-H182 VanDerWaalsContact O-CB 3.22Å; N178-H182 WeakPolarHBondContact O-CB 3.15Å; N178-H182 PolarHBondContact O-N 3.5Å
179	E	93.8	Very high	93.1	Very high	61 Å²	61	53.2 Å²	53.2	29%	0.285	26%	0.259	S	S	.	.	H	α-helix	trans	-70.8	-43.5	173.4	-179.8	177.7	-152.4	0	0	110.6	T174 H176 F177 V181 H182 W183	T174-E179 WeakPolarHBondContact CB-OE2 3.36Å; T174-E179 HydrophobicContact CG2-CB 4.11Å; T174-E179 HydrophobicContact CG2-CG 4.14Å; T174-E179 PolarHBondContact OG1-OE2 3.23Å; H176-E179 HydrophobicContact CB-CB 4.07Å; H176-E179 PolarHBondContact O-N 2.91Å; H176-E179 VanDerWaalsContact O-N 3.15Å; F177-E179 VanDerWaalsContact C-N 3.27Å; F177-E179 PolarHBondContact O-N 2.82Å; E179-V181 VanDerWaalsContact C-N 3.34Å; E179-V181 PolarHBondContact O-N 3.43Å; E179-H182 PolarHBondContact O-N 2.86Å; E179-W183 VanDerWaalsContact O-CD1 3.29Å; E179-W183 PolarHBondContact O-N 3.14Å
180	A	92.9	Very high	93.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-43.5	177.1	0	0	0	0	0	112	P148 W159 I161 T174 H176 F177 A184	P148-A180 HydrophobicContact CB-CB 3.76Å; P148-A180 HydrophobicContact CG-CB 3.81Å; W159-A180 HydrophobicContact CB-CB 3.75Å; I161-A180 HydrophobicContact CD1-CB 4.47Å; I161-A180 WeakPolarHBondContact CD1-O 3.42Å; I161-A180 HydrophobicContact CG1-CB 4.21Å; T174-A180 HydrophobicContact CG2-CB 3.7Å; H176-A180 PolarHBondContact O-N 2.99Å; F177-A180 WeakPolarHBondContact O-CB 3.41Å; F177-A180 PolarHBondContact O-N 3.02Å; A180-A184 WeakPolarHBondContact O-CB 3.43Å; A180-A184 PolarHBondContact O-N 3.46Å
181	V	93.6	Very high	93.4	Very high	39 Å²	39	50.8 Å²	50.8	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-45.2	174.7	172.6	0	0	0	0	110.8	W147 P148 F177 E179 W183 A184 C185	W147-V181 HydrophobicContact CZ3-CG1 4.37Å; P148-V181 HydrophobicContact CG-CG2 3.72Å; F177-V181 HydrophobicContact CD1-CG2 4.2Å; F177-V181 HydrophobicContact CD2-CG2 4.05Å; F177-V181 HydrophobicContact CE1-CG2 3.8Å; F177-V181 HydrophobicContact CE2-CG2 3.65Å; F177-V181 HydrophobicContact CG-CG2 4.33Å; F177-V181 HydrophobicContact CZ-CG2 3.51Å; F177-V181 WeakPolarHBondContact O-CG2 3.47Å; F177-V181 PolarHBondContact O-N 2.96Å; E179-V181 VanDerWaalsContact C-N 3.34Å; E179-V181 PolarHBondContact O-N 3.43Å; V181-W183 PolarHBondContact O-N 3.45Å; V181-A184 PolarHBondContact O-N 2.9Å; V181-C185 WeakPolarHBondContact O-CB 3.44Å; V181-C185 PolarHBondContact O-N 3.46Å; V181-C185 PolarHBondContact O-SG 3.32Å
182	H	94.6	Very high	93.4	Very high	108 Å²	108	51.8 Å²	51.8	50%	0.5	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-45.8	178.9	178.1	-92.8	0	0	0	112.7	N178 E179 A186	N178-H182 VanDerWaalsContact O-CB 3.22Å; N178-H182 WeakPolarHBondContact O-CB 3.15Å; N178-H182 PolarHBondContact O-N 3.5Å; E179-H182 PolarHBondContact O-N 2.86Å; H182-A186 WeakPolarHBondContact O-CB 3.3Å; H182-A186 PolarHBondContact O-N 2.92Å
183	W	95.6	Very high	93.4	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-43	174.6	-82.9	100	0	0	0	112.1	V94 L98 F114 L116 L121 I161 E179 V181 A186 I187	V94-W183 HydrophobicContact CB-CE3 4.31Å; V94-W183 HydrophobicContact CB-CH2 4.29Å; V94-W183 HydrophobicContact CB-CZ3 4.13Å; V94-W183 HydrophobicContact CG1-CD2 3.86Å; V94-W183 HydrophobicContact CG1-CE3 3.97Å; V94-W183 HydrophobicContact CG1-CH2 3.78Å; V94-W183 HydrophobicContact CG1-CZ2 3.66Å; V94-W183 HydrophobicContact CG1-CZ3 3.94Å; L98-W183 HydrophobicContact CD1-CD2 3.84Å; L98-W183 HydrophobicContact CD1-CE3 4.26Å; L98-W183 HydrophobicContact CD1-CG 4.13Å; L98-W183 HydrophobicContact CD1-CZ2 4.17Å; L98-W183 HydrophobicContact CG-CZ2 4.33Å; F114-W183 HydrophobicContact CB-CH2 3.6Å; F114-W183 HydrophobicContact CB-CZ2 4.21Å; F114-W183 HydrophobicContact CB-CZ3 4.17Å; L116-W183 HydrophobicContact CB-CZ3 4.02Å; L121-W183 HydrophobicContact CD1-CE3 4.49Å; L121-W183 HydrophobicContact CD1-CZ3 3.84Å; I161-W183 HydrophobicContact CD1-CB 3.41Å; I161-W183 VanDerWaalsContact CD1-CB 3.41Å; I161-W183 HydrophobicContact CD1-CG 4.39Å; E179-W183 VanDerWaalsContact O-CD1 3.29Å; E179-W183 PolarHBondContact O-N 3.14Å; V181-W183 PolarHBondContact O-N 3.45Å; W183-A186 PolarHBondContact O-N 3.06Å; W183-I187 HydrophobicContact CE3-CD1 4.28Å; W183-I187 WeakPolarHBondContact O-CD1 3.5Å; W183-I187 WeakPolarHBondContact O-CG1 3.33Å; W183-I187 PolarHBondContact O-N 3.05Å
184	A	94	Very high	93.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-47	176.7	0	0	0	0	0	111.9	V145 W147 I161 A180 V181 A186 I187 Q188	V145-A184 HydrophobicContact CG1-CB 4.03Å; W147-A184 HydrophobicContact CD2-CB 4.02Å; W147-A184 HydrophobicContact CE3-CB 3.73Å; W147-A184 HydrophobicContact CH2-CB 4.39Å; W147-A184 HydrophobicContact CZ3-CB 3.93Å; I161-A184 HydrophobicContact CG2-CB 4.26Å; A180-A184 WeakPolarHBondContact O-CB 3.43Å; A180-A184 PolarHBondContact O-N 3.46Å; V181-A184 PolarHBondContact O-N 2.9Å; A184-A186 PolarHBondContact O-N 3.47Å; A184-I187 PolarHBondContact O-N 2.69Å; A184-Q188 VanDerWaalsContact O-CB 3.27Å; A184-Q188 WeakPolarHBondContact O-CB 3.34Å; A184-Q188 PolarHBondContact O-N 2.92Å
185	C	94.8	Very high	93.3	Very high	59 Å²	59	62.6 Å²	62.6	40%	0.399	32%	0.322	S	S	.	.	H	α-helix	trans	-55.5	-47.3	173.3	-71.6	0	0	0	0	112.4	W147 V181 K189	W147-C185 HydrophobicContact CH2-CB 4.31Å; W147-C185 VanDerWaalsContact CH2-SG 3.55Å; W147-C185 VanDerWaalsContact CZ3-SG 3.57Å; V181-C185 WeakPolarHBondContact O-CB 3.44Å; V181-C185 PolarHBondContact O-N 3.46Å; V181-C185 PolarHBondContact O-SG 3.32Å; C185-K189 VanDerWaalsContact O-CB 3.29Å; C185-K189 WeakPolarHBondContact O-CB 3.23Å; C185-K189 PolarHBondContact O-N 3.04Å
186	A	95.3	Very high	93.2	Very high	12 Å²	12	61.5 Å²	61.5	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-68.3	-42.1	-176.2	0	0	0	0	0	112.5	V94 L116 H182 W183 A184 I190	V94-A186 HydrophobicContact CG2-CB 3.46Å; V94-A186 VanDerWaalsContact CG2-CB 3.46Å; L116-A186 HydrophobicContact CD2-CB 3.71Å; H182-A186 WeakPolarHBondContact O-CB 3.3Å; H182-A186 PolarHBondContact O-N 2.92Å; W183-A186 PolarHBondContact O-N 3.06Å; A184-A186 PolarHBondContact O-N 3.47Å; A186-I190 WeakPolarHBondContact O-CD1 3.4Å; A186-I190 WeakPolarHBondContact O-CG1 3.21Å; A186-I190 PolarHBondContact O-N 3.22Å
187	I	95.2	Very high	93.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68.3	-44.3	178.1	-62.1	161.3	0	0	0	110.1	L116 L121 L139 V145 V163 W183 A184 I190 I191	L116-I187 HydrophobicContact CD1-CG1 3.96Å; L116-I187 HydrophobicContact CD2-CG1 3.71Å; L116-I187 HydrophobicContact CG-CG1 4.48Å; L121-I187 HydrophobicContact CD2-CD1 3.88Å; L139-I187 HydrophobicContact CD2-CG2 4.08Å; V145-I187 HydrophobicContact CG2-CB 4.18Å; V145-I187 HydrophobicContact CG2-CG2 3.64Å; V163-I187 HydrophobicContact CG1-CG2 4.12Å; V163-I187 HydrophobicContact CG2-CD1 3.92Å; V163-I187 HydrophobicContact CG2-CG2 4.41Å; W183-I187 HydrophobicContact CE3-CD1 4.28Å; W183-I187 WeakPolarHBondContact O-CD1 3.5Å; W183-I187 WeakPolarHBondContact O-CG1 3.33Å; W183-I187 PolarHBondContact O-N 3.05Å; A184-I187 PolarHBondContact O-N 2.69Å; I187-I190 PolarHBondContact O-N 2.76Å; I187-I191 HydrophobicContact CG2-CD1 3.96Å; I187-I191 WeakPolarHBondContact O-CG1 3.46Å; I187-I191 PolarHBondContact O-N 2.94Å; I187-I191 VanDerWaalsContact O-N 3.11Å
188	Q	94.3	Very high	92.9	Very high	44 Å²	44	55.4 Å²	55.4	21%	0.206	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-46.7	177	-170.7	62.1	56.8	0	0	111.2	W147 A184 I190 I191 D192	W147-Q188 HydrophobicContact CZ2-CB 4.19Å; W147-Q188 HydrophobicContact CZ2-CG 4.31Å; A184-Q188 VanDerWaalsContact O-CB 3.27Å; A184-Q188 WeakPolarHBondContact O-CB 3.34Å; A184-Q188 PolarHBondContact O-N 2.92Å; Q188-I190 PolarHBondContact O-N 2.9Å; Q188-I190 VanDerWaalsContact O-N 3.16Å; Q188-I191 WeakPolarHBondContact O-CB 3.47Å; Q188-I191 PolarHBondContact O-N 2.93Å; Q188-D192 PolarHBondContact NE2-OD1 3.14Å; Q188-D192 PolarHBondContact O-N 2.87Å
189	K	94.4	Very high	93	Very high	147 Å²	147	50 Å²	50	64%	0.639	27%	0.274	S	S	*	.	H	α-helix	trans	-54.5	-37.3	176.9	-177.7	-176.4	175.9	-171	0	112.8	C185 T193	C185-K189 VanDerWaalsContact O-CB 3.29Å; C185-K189 WeakPolarHBondContact O-CB 3.23Å; C185-K189 PolarHBondContact O-N 3.04Å; K189-T193 WeakPolarHBondContact O-CG2 3.33Å; K189-T193 PolarHBondContact O-N 3Å; K189-T193 PolarHBondContact O-OG1 3.27Å
190	I	94.5	Very high	93.1	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-70.9	-45.2	177.6	-69.2	157.3	0	0	0	110.7	I93 L116 Q118 L139 A186 I187 Q188 D192 T193 K194	I93-I190 HydrophobicContact CB-CD1 4.37Å; I93-I190 HydrophobicContact CD1-CD1 3.58Å; I93-I190 HydrophobicContact CD1-CG1 3.68Å; I93-I190 HydrophobicContact CG2-CD1 4.34Å; L116-I190 HydrophobicContact CD1-CD1 3.56Å; L116-I190 HydrophobicContact CD2-CD1 3.6Å; L116-I190 HydrophobicContact CG-CD1 3.39Å; Q118-I190 WeakPolarHBondContact O-CG2 3.43Å; L139-I190 HydrophobicContact CB-CG2 4.33Å; L139-I190 HydrophobicContact CD1-CB 4.38Å; L139-I190 HydrophobicContact CD1-CG2 3.79Å; A186-I190 WeakPolarHBondContact O-CD1 3.4Å; A186-I190 WeakPolarHBondContact O-CG1 3.21Å; A186-I190 PolarHBondContact O-N 3.22Å; I187-I190 PolarHBondContact O-N 2.76Å; Q188-I190 PolarHBondContact O-N 2.9Å; Q188-I190 VanDerWaalsContact O-N 3.16Å; I190-D192 VanDerWaalsContact C-N 3.28Å; I190-D192 PolarHBondContact O-N 2.85Å; I190-T193 PolarHBondContact O-N 3.32Å; I190-T193 PolarHBondContact O-OG1 3.43Å; I190-K194 PolarHBondContact O-N 2.93Å
191	I	93.1	Very high	93.3	Very high	8 Å²	8	50 Å²	50	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-56.7	-44.5	175.2	-66.9	166.7	0	0	0	110.5	L139 C143 V145 I187 Q188 T193 K194	L139-I191 HydrophobicContact CD2-CD1 4.35Å; L139-I191 HydrophobicContact CD2-CG1 4.25Å; C143-I191 HydrophobicContact CB-CD1 3.56Å; C143-I191 HydrophobicContact CB-CG1 3.83Å; C143-I191 WeakPolarHBondContact O-CG2 3.48Å; V145-I191 HydrophobicContact CG2-CD1 3.81Å; I187-I191 HydrophobicContact CG2-CD1 3.96Å; I187-I191 WeakPolarHBondContact O-CG1 3.46Å; I187-I191 PolarHBondContact O-N 2.94Å; I187-I191 VanDerWaalsContact O-N 3.11Å; Q188-I191 WeakPolarHBondContact O-CB 3.47Å; Q188-I191 PolarHBondContact O-N 2.93Å; I191-T193 PolarHBondContact O-N 2.97Å; I191-K194 PolarHBondContact O-N 3.24Å
192	D	91.6	Very high	93.4	Very high	114 Å²	114	51.4 Å²	51.4	61%	0.61	28%	0.283	S	S	*	.	H	α-helix	trans	-63.7	-23.4	178.4	-58.2	-22.8	0	0	0	113	Q188 I190	Q188-D192 PolarHBondContact NE2-OD1 3.14Å; Q188-D192 PolarHBondContact O-N 2.87Å; I190-D192 VanDerWaalsContact C-N 3.28Å; I190-D192 PolarHBondContact O-N 2.85Å
193	T	92.8	Very high	93.5	Very high	105 Å²	105	48.4 Å²	48.4	64%	0.644	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.3	174.2	57.2	0	0	0	0	114.5	K189 I190 I191	K189-T193 WeakPolarHBondContact O-CG2 3.33Å; K189-T193 PolarHBondContact O-N 3Å; K189-T193 PolarHBondContact O-OG1 3.27Å; I190-T193 PolarHBondContact O-N 3.32Å; I190-T193 PolarHBondContact O-OG1 3.43Å; I191-T193 PolarHBondContact O-N 2.97Å
194	K	92.8	Very high	93.6	Very high	43 Å²	43	49 Å²	49	19%	0.187	27%	0.274	C	S	.	.	S	Bend	trans	-79.2	137.4	179.6	-66.2	-56.2	179.2	-169.6	0	111.9	Q118 D119 L139 I190 I191	Q118-K194 WeakPolarHBondContact O-CE 3.48Å; Q118-K194 PolarHBondContact O-NZ 3.49Å; D119-K194 IonicContact OD1-NZ 3.39Å; D119-K194 PolarHBondContact OD1-NZ 2.69Å; L139-K194 WeakPolarHBondContact O-CE 3.45Å; I190-K194 PolarHBondContact O-N 2.93Å; I191-K194 PolarHBondContact O-N 3.24Å
195	S	89.9	Confident	93.8	Very high	91 Å²	91	49.2 Å²	49.2	64%	0.636	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-54	134.6	170.9	53.9	0	0	0	0	110.8	V197	S195-V197 PolarHBondContact O-N 2.98Å
196	P	89.1	Confident	93.9	Very high	108 Å²	108	50.7 Å²	50.7	70%	0.701	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-52.2	126.1	175.5	-29.2	36.2	0	0	0	112.4	S141 E198	S141-P196 WeakPolarHBondContact OG-CA 3.46Å; P196-E198 PolarHBondContact O-N 3.36Å; P196-E198 VanDerWaalsContact O-N 3.13Å
197	V	88.8	Confident	94	Very high	25 Å²	25	52.6 Å²	52.6	15%	0.152	28%	0.281	C	S	.	.			trans	-69.3	106.8	175.2	177.3	0	0	0	0	109.7	L34 S141 L142 S195	L34-V197 HydrophobicContact CD1-CG1 3.84Å; L34-V197 HydrophobicContact CD2-CG1 4.09Å; S141-V197 PolarHBondContact OG-N 2.8Å; L142-V197 HydrophobicContact CD1-CB 3.8Å; L142-V197 HydrophobicContact CD1-CG1 3.92Å; L142-V197 HydrophobicContact CD1-CG2 4.22Å; L142-V197 HydrophobicContact CG-CB 3.9Å; L142-V197 HydrophobicContact CG-CG2 4.01Å; S195-V197 PolarHBondContact O-N 2.98Å
198	E	88.2	Confident	94.1	Very high	60 Å²	60	52.7 Å²	52.7	28%	0.28	28%	0.282	S	S	.	.			trans	-77.9	130.4	171.4	-56.5	-173.9	71.2	0	0	109.8	K37 P196 L203 R206	K37-E198 IonicContact NZ-OE2 3.61Å; K37-E198 PolarHBondContact NZ-OE2 2.75Å; P196-E198 PolarHBondContact O-N 3.36Å; P196-E198 VanDerWaalsContact O-N 3.13Å; E198-L203 HydrophobicContact CB-CD2 3.78Å; E198-L203 HydrophobicContact CB-CG 4.08Å; E198-L203 HydrophobicContact CG-CD2 4.35Å; E198-L203 WeakPolarHBondContact OE1-CD2 3.41Å; E198-R206 IonicContact OE1-CZ 2.81Å; E198-R206 IonicContact OE1-NH1 2.79Å; E198-R206 PolarHBondContact OE1-NH1 2.78Å; E198-R206 IonicContact OE1-NH2 3.56Å
199	T	93.9	Very high	94.2	Very high	15 Å²	15	53.2 Å²	53.2	9%	0.092	28%	0.284	C	S	.	.			trans	-83.2	157.7	172.9	64.2	0	0	0	0	111.8	T201 Q202 L203 L239 P241	T199-T201 PolarHBondContact O-N 2.98Å; T199-Q202 PolarHBondContact O-N 2.87Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.4Å; T199-Q202 PolarHBondContact OG1-N 2.85Å; T199-L203 WeakPolarHBondContact O-CG 3.45Å; T199-L203 PolarHBondContact O-N 3.45Å; T199-L239 WeakPolarHBondContact CB-O 3.3Å; T199-L239 PolarHBondContact OG1-O 2.77Å; T199-P241 HydrophobicContact CG2-CB 3.96Å; T199-P241 HydrophobicContact CG2-CG 4.28Å
200	P	95.5	Very high	94.4	Very high	54 Å²	54	52.4 Å²	52.4	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-51.5	-39.5	173	-28.5	36.2	0	0	0	113	Q202 L203 L204	P200-Q202 PolarHBondContact O-N 2.9Å; P200-L203 PolarHBondContact O-N 2.91Å; P200-L204 WeakPolarHBondContact O-CB 3.37Å; P200-L204 WeakPolarHBondContact O-CD1 3.47Å; P200-L204 WeakPolarHBondContact O-CG 3.33Å; P200-L204 PolarHBondContact O-N 3.27Å
201	T	96.8	Very high	94.5	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.043	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-44.3	175.7	-34.2	0	0	0	0	112.3	T199 I205 L228 L239	T199-T201 PolarHBondContact O-N 2.98Å; T201-I205 HydrophobicContact CG2-CD1 3.97Å; T201-I205 WeakPolarHBondContact O-CB 3.44Å; T201-I205 WeakPolarHBondContact O-CG1 3.42Å; T201-I205 PolarHBondContact O-N 3.01Å; T201-L228 HydrophobicContact CG2-CD2 4.28Å; T201-L239 VanDerWaalsContact CB-O 3.22Å; T201-L239 WeakPolarHBondContact CB-O 3.41Å; T201-L239 HydrophobicContact CG2-CB 4.15Å; T201-L239 PolarHBondContact OG1-O 3.34Å
202	Q	95.7	Very high	94.6	Very high	69 Å²	69	57.8 Å²	57.8	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-66.8	-42.1	179.2	-72.8	176.3	-46	0	0	112.5	T199 P200 I205 R206 L240 P241	T199-Q202 PolarHBondContact O-N 2.87Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.4Å; T199-Q202 PolarHBondContact OG1-N 2.85Å; P200-Q202 PolarHBondContact O-N 2.9Å; Q202-I205 PolarHBondContact O-N 2.94Å; Q202-R206 PolarHBondContact O-N 3.25Å; Q202-R206 VanDerWaalsContact O-N 3.08Å; Q202-L240 HydrophobicContact CG-CD2 3.82Å; Q202-P241 VanDerWaalsContact NE2-CD 3.26Å
203	L	96.4	Very high	94.7	Very high	46 Å²	46	61.3 Å²	61.3	24%	0.241	32%	0.318	C	S	.	.	H	α-helix	trans	-57.5	-53.6	175.4	-64.2	172.7	0	0	0	109.8	E198 T199 P200 I205 R206 D207	E198-L203 HydrophobicContact CB-CD2 3.78Å; E198-L203 HydrophobicContact CB-CG 4.08Å; E198-L203 HydrophobicContact CG-CD2 4.35Å; E198-L203 WeakPolarHBondContact OE1-CD2 3.41Å; T199-L203 WeakPolarHBondContact O-CG 3.45Å; T199-L203 PolarHBondContact O-N 3.45Å; P200-L203 PolarHBondContact O-N 2.91Å; L203-I205 VanDerWaalsContact C-N 3.33Å; L203-I205 PolarHBondContact O-N 3.04Å; L203-R206 WeakPolarHBondContact O-CB 3.12Å; L203-R206 PolarHBondContact O-N 2.66Å; L203-R206 VanDerWaalsContact O-N 3.08Å; L203-D207 PolarHBondContact O-N 2.79Å
204	L	98.1	Very high	94.9	Very high	15 Å²	15	59.4 Å²	59.4	8%	0.079	30%	0.304	C	S	.	.	H	α-helix	trans	-66.1	-31.4	-179.1	-64.7	167.4	0	0	0	113.5	P200 D207 I208 I221 N225 I227 L228	P200-L204 WeakPolarHBondContact O-CB 3.37Å; P200-L204 WeakPolarHBondContact O-CD1 3.47Å; P200-L204 WeakPolarHBondContact O-CG 3.33Å; P200-L204 PolarHBondContact O-N 3.27Å; L204-D207 PolarHBondContact O-N 3.31Å; L204-I208 WeakPolarHBondContact O-CB 3.24Å; L204-I208 VanDerWaalsContact O-CG1 3.27Å; L204-I208 WeakPolarHBondContact O-CG1 3.27Å; L204-I208 PolarHBondContact O-N 3.09Å; L204-I221 HydrophobicContact CD2-CG2 4.11Å; L204-N225 HydrophobicContact CD1-CB 3.72Å; L204-N225 WeakPolarHBondContact CD1-OD1 3.5Å; L204-N225 HydrophobicContact CD2-CB 4.47Å; L204-I227 HydrophobicContact CD1-CG2 3.65Å; L204-L228 HydrophobicContact CB-CD1 4.08Å; L204-L228 HydrophobicContact CB-CD2 4.07Å; L204-L228 HydrophobicContact CB-CG 4.43Å; L204-L228 HydrophobicContact CD1-CD1 4.15Å; L204-L228 HydrophobicContact CD1-CD2 4.15Å; L204-L228 HydrophobicContact CD1-CG 4.01Å
205	I	97.6	Very high	94.9	Very high	6 Å²	6	61.8 Å²	61.8	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-39.2	172.5	-76.7	169.3	0	0	0	111	T201 Q202 L203 E209 T339 Y343	T201-I205 HydrophobicContact CG2-CD1 3.97Å; T201-I205 WeakPolarHBondContact O-CB 3.44Å; T201-I205 WeakPolarHBondContact O-CG1 3.42Å; T201-I205 PolarHBondContact O-N 3.01Å; Q202-I205 PolarHBondContact O-N 2.94Å; L203-I205 VanDerWaalsContact C-N 3.33Å; L203-I205 PolarHBondContact O-N 3.04Å; I205-E209 WeakPolarHBondContact O-CB 3.45Å; I205-E209 PolarHBondContact O-N 3.26Å; I205-T339 HydrophobicContact CG2-CG2 4.1Å; I205-Y343 HydrophobicContact CD1-CD1 3.6Å; I205-Y343 HydrophobicContact CD1-CE1 3.85Å; I205-Y343 HydrophobicContact CD1-CG 4Å; I205-Y343 HydrophobicContact CG1-CD1 3.79Å; I205-Y343 HydrophobicContact CG1-CD2 3.87Å; I205-Y343 HydrophobicContact CG1-CE1 3.9Å; I205-Y343 HydrophobicContact CG1-CE2 3.99Å; I205-Y343 HydrophobicContact CG1-CG 3.78Å; I205-Y343 HydrophobicContact CG2-CD2 4.29Å; I205-Y343 HydrophobicContact CG2-CG 4.08Å
206	R	97.1	Very high	95.2	Very high	89 Å²	89	65 Å²	65	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-48.6	172	177.1	-178.9	62.3	-124.9	-7.3	110.6	E198 Q202 L203 I208 E209 E210	E198-R206 IonicContact OE1-CZ 2.81Å; E198-R206 IonicContact OE1-NH1 2.79Å; E198-R206 PolarHBondContact OE1-NH1 2.78Å; E198-R206 IonicContact OE1-NH2 3.56Å; Q202-R206 PolarHBondContact O-N 3.25Å; Q202-R206 VanDerWaalsContact O-N 3.08Å; L203-R206 WeakPolarHBondContact O-CB 3.12Å; L203-R206 PolarHBondContact O-N 2.66Å; L203-R206 VanDerWaalsContact O-N 3.08Å; R206-I208 PolarHBondContact O-N 2.9Å; R206-E209 PolarHBondContact O-N 3.19Å; R206-E210 VanDerWaalsContact CD-OE1 3.3Å; R206-E210 WeakPolarHBondContact CD-OE1 3.37Å; R206-E210 HydrophobicContact CG-CG 4.3Å; R206-E210 WeakPolarHBondContact CG-OE1 3.23Å; R206-E210 IonicContact NE-OE1 3.58Å; R206-E210 WeakPolarHBondContact O-CG 3.3Å; R206-E210 PolarHBondContact O-N 3.07Å
207	D	97.6	Very high	95.6	Very high	53 Å²	53	62.1 Å²	62.1	28%	0.283	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-35.6	-179.2	-56	-15.6	0	0	0	111.2	L203 L204 N211 I221	L203-D207 PolarHBondContact O-N 2.79Å; L204-D207 PolarHBondContact O-N 3.31Å; D207-N211 WeakPolarHBondContact O-CB 3.44Å; D207-N211 PolarHBondContact O-N 3.19Å; D207-N211 VanDerWaalsContact O-N 3.07Å; D207-N211 PolarHBondContact O-ND2 3.36Å; D207-I221 HydrophobicContact CB-CD1 4.18Å
208	I	97.8	Very high	96	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-70.7	-44.4	172.2	-70.9	168.4	0	0	0	112.4	L204 R206 E210 N211 K212 V218 I221 Y222 L228 Y343 F346	L204-I208 WeakPolarHBondContact O-CB 3.24Å; L204-I208 VanDerWaalsContact O-CG1 3.27Å; L204-I208 WeakPolarHBondContact O-CG1 3.27Å; L204-I208 PolarHBondContact O-N 3.09Å; R206-I208 PolarHBondContact O-N 2.9Å; I208-E210 VanDerWaalsContact C-N 3.27Å; I208-E210 PolarHBondContact O-N 3Å; I208-N211 CarbonylContact O-C 3.25Å; I208-N211 PolarHBondContact O-N 3.47Å; I208-K212 WeakPolarHBondContact O-CA 3.43Å; I208-K212 WeakPolarHBondContact O-CB 3.34Å; I208-K212 PolarHBondContact O-N 3Å; I208-V218 HydrophobicContact CG1-CG1 4.46Å; I208-V218 HydrophobicContact CG2-CG1 4.41Å; I208-I221 HydrophobicContact CD1-CG2 3.99Å; I208-I221 HydrophobicContact CG1-CD1 4.17Å; I208-I221 HydrophobicContact CG1-CG2 3.94Å; I208-Y222 HydrophobicContact CD1-CD2 4.49Å; I208-Y222 HydrophobicContact CD1-CE2 3.86Å; I208-L228 HydrophobicContact CD1-CD1 3.83Å; I208-Y343 HydrophobicContact CD1-CE2 4.12Å; I208-F346 HydrophobicContact CG2-CD1 3.79Å; I208-F346 HydrophobicContact CG2-CE1 3.63Å; I208-F346 HydrophobicContact CG2-CG 4.47Å; I208-F346 HydrophobicContact CG2-CZ 4.19Å
209	E	96.6	Very high	96.3	Very high	54 Å²	54	60.5 Å²	60.5	25%	0.252	30%	0.3	S	S	.	.	H	α-helix	trans	-62.9	-33.2	177.3	168.4	70.9	171.5	0	0	112.1	I205 R206 K212 K342	I205-E209 WeakPolarHBondContact O-CB 3.45Å; I205-E209 PolarHBondContact O-N 3.26Å; R206-E209 PolarHBondContact O-N 3.19Å; E209-K212 WeakPolarHBondContact O-CD 3.29Å; E209-K212 WeakPolarHBondContact O-CE 3.21Å; E209-K212 WeakPolarHBondContact O-CG 3.37Å; E209-K212 IonicContact OE1-NZ 3.51Å; E209-K212 PolarHBondContact OE1-NZ 3.19Å; E209-K212 WeakPolarHBondContact OE2-CD 3.49Å; E209-K212 WeakPolarHBondContact OE2-CE 3.4Å; E209-K212 IonicContact OE2-NZ 4Å; E209-K212 PolarHBondContact OE2-NZ 3.37Å; E209-K342 WeakPolarHBondContact OE1-CD 3.4Å; E209-K342 IonicContact OE1-NZ 3.51Å; E209-K342 PolarHBondContact OE1-NZ 2.94Å
210	E	97.5	Very high	96.5	Very high	131 Å²	131	65 Å²	65	61%	0.612	32%	0.32	S	S	*	.	H	α-helix	trans	-71.8	-39.8	173	-70.9	177.4	-163.5	0	0	112	R206 I208	R206-E210 VanDerWaalsContact CD-OE1 3.3Å; R206-E210 WeakPolarHBondContact CD-OE1 3.37Å; R206-E210 HydrophobicContact CG-CG 4.3Å; R206-E210 WeakPolarHBondContact CG-OE1 3.23Å; R206-E210 IonicContact NE-OE1 3.58Å; R206-E210 WeakPolarHBondContact O-CG 3.3Å; R206-E210 PolarHBondContact O-N 3.07Å; I208-E210 VanDerWaalsContact C-N 3.27Å; I208-E210 PolarHBondContact O-N 3Å
211	N	97.4	Very high	96.5	Very high	57 Å²	57	63.2 Å²	63.2	31%	0.305	31%	0.307	S	S	.	.	H	α-helix	trans	-99.1	7.6	-176	-69.2	-84.8	0	0	0	115	D207 I208 F213 N214 V217 V218	D207-N211 WeakPolarHBondContact O-CB 3.44Å; D207-N211 PolarHBondContact O-N 3.19Å; D207-N211 VanDerWaalsContact O-N 3.07Å; D207-N211 PolarHBondContact O-ND2 3.36Å; I208-N211 CarbonylContact O-C 3.25Å; I208-N211 PolarHBondContact O-N 3.47Å; N211-F213 PolarHBondContact O-N 3.28Å; N211-N214 WeakPolarHBondContact O-CA 3.36Å; N211-N214 PolarHBondContact O-N 3.47Å; N211-V217 HydrophobicContact CB-CB 4.34Å; N211-V217 HydrophobicContact CB-CG1 3.78Å; N211-V218 HydrophobicContact CB-CG2 4.38Å; N211-V218 WeakPolarHBondContact O-CG2 3.29Å
212	K	94.6	Very high	96.5	Very high	69 Å²	69	62.9 Å²	62.9	30%	0.3	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-17.4	-171.3	63.1	-174.2	160.1	-169	0	117.1	I208 E209 F346	I208-K212 WeakPolarHBondContact O-CA 3.43Å; I208-K212 WeakPolarHBondContact O-CB 3.34Å; I208-K212 PolarHBondContact O-N 3Å; E209-K212 WeakPolarHBondContact O-CD 3.29Å; E209-K212 WeakPolarHBondContact O-CE 3.21Å; E209-K212 WeakPolarHBondContact O-CG 3.37Å; E209-K212 IonicContact OE1-NZ 3.51Å; E209-K212 PolarHBondContact OE1-NZ 3.19Å; E209-K212 WeakPolarHBondContact OE2-CD 3.49Å; E209-K212 WeakPolarHBondContact OE2-CE 3.4Å; E209-K212 IonicContact OE2-NZ 4Å; E209-K212 PolarHBondContact OE2-NZ 3.37Å; K212-F346 HydrophobicContact CB-CD2 3.92Å; K212-F346 HydrophobicContact CB-CE2 3.75Å
213	F	94.5	Very high	96.5	Very high	188 Å²	188	64.7 Å²	64.7	83%	0.825	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-3.4	175.5	-59	-65.9	0	0	0	113.5	N211 P215	N211-F213 PolarHBondContact O-N 3.28Å; F213-P215 WeakPolarHBondContact O-CD 3.42Å
214	N	96.4	Very high	96.5	Very high	65 Å²	65	68.6 Å²	68.6	35%	0.348	33%	0.33	S	S	.	.			trans	-110.7	95.2	174.5	-174.6	-27	0	0	0	109.3	N211 E216 V217 V218	N211-N214 WeakPolarHBondContact O-CA 3.36Å; N211-N214 PolarHBondContact O-N 3.47Å; N214-E216 VanDerWaalsContact C-N 3.28Å; N214-E216 PolarHBondContact O-N 3.35Å; N214-E216 PolarHBondContact OD1-N 3.11Å; N214-V217 HydrophobicContact CB-CB 4.25Å; N214-V217 HydrophobicContact CB-CG2 4.42Å; N214-V217 VanDerWaalsContact ND2-CG2 3.33Å; N214-V217 WeakPolarHBondContact ND2-CG2 3.29Å; N214-V217 PolarHBondContact O-N 2.91Å; N214-V217 PolarHBondContact OD1-N 3.42Å; N214-V217 VanDerWaalsContact OD1-N 3.12Å; N214-V218 PolarHBondContact O-N 3.21Å; N214-V218 VanDerWaalsContact O-N 3.14Å
215	P	93.8	Very high	96.4	Very high	93 Å²	93	70.2 Å²	70.2	60%	0.604	34%	0.339	S	S	*	.	H	α-helix	trans	-66.2	-29.4	-174.4	27	-34.5	0	0	0	112.8	F213 E219	F213-P215 WeakPolarHBondContact O-CD 3.42Å; P215-E219 WeakPolarHBondContact O-CB 3.43Å; P215-E219 PolarHBondContact O-N 3.47Å
216	E	96.3	Very high	96.3	Very high	158 Å²	158	75.1 Å²	75.1	74%	0.738	37%	0.37	S	S	*	.	H	α-helix	trans	-67.6	-43.9	178.4	-61.4	179.3	-179.2	0	0	111.3	N214 E219 H220	N214-E216 VanDerWaalsContact C-N 3.28Å; N214-E216 PolarHBondContact O-N 3.35Å; N214-E216 PolarHBondContact OD1-N 3.11Å; E216-E219 PolarHBondContact O-N 3.29Å; E216-H220 WeakPolarHBondContact O-CB 3.44Å; E216-H220 PolarHBondContact O-N 3.47Å
217	V	97.3	Very high	96.2	Very high	48 Å²	48	73 Å²	73	29%	0.291	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-41.5	177	173.2	0	0	0	0	111.4	N211 N214 E219 H220 I221	N211-V217 HydrophobicContact CB-CB 4.34Å; N211-V217 HydrophobicContact CB-CG1 3.78Å; N214-V217 HydrophobicContact CB-CB 4.25Å; N214-V217 HydrophobicContact CB-CG2 4.42Å; N214-V217 VanDerWaalsContact ND2-CG2 3.33Å; N214-V217 WeakPolarHBondContact ND2-CG2 3.29Å; N214-V217 PolarHBondContact O-N 2.91Å; N214-V217 PolarHBondContact OD1-N 3.42Å; N214-V217 VanDerWaalsContact OD1-N 3.12Å; V217-E219 VanDerWaalsContact C-N 3.35Å; V217-E219 PolarHBondContact O-N 2.94Å; V217-H220 PolarHBondContact O-N 3.24Å; V217-I221 HydrophobicContact CG1-CD1 4.09Å; V217-I221 VanDerWaalsContact O-CG1 3.3Å; V217-I221 WeakPolarHBondContact O-CG1 3.35Å; V217-I221 PolarHBondContact O-N 3Å
218	V	96.8	Very high	96.2	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-42.2	175.2	174.7	0	0	0	0	111.3	I208 N211 N214 I221 Y222 F346	I208-V218 HydrophobicContact CG1-CG1 4.46Å; I208-V218 HydrophobicContact CG2-CG1 4.41Å; N211-V218 HydrophobicContact CB-CG2 4.38Å; N211-V218 WeakPolarHBondContact O-CG2 3.29Å; N214-V218 PolarHBondContact O-N 3.21Å; N214-V218 VanDerWaalsContact O-N 3.14Å; V218-I221 WeakPolarHBondContact O-CB 3.4Å; V218-I221 PolarHBondContact O-N 2.96Å; V218-Y222 HydrophobicContact CG1-CD2 3.79Å; V218-Y222 HydrophobicContact CG1-CE2 3.72Å; V218-Y222 WeakPolarHBondContact O-CD2 3.43Å; V218-Y222 PolarHBondContact O-N 3.01Å; V218-F346 HydrophobicContact CG1-CE1 4.02Å; V218-F346 HydrophobicContact CG1-CZ 3.89Å; V218-F346 HydrophobicContact CG2-CZ 4.36Å
219	E	95.1	Very high	96.1	Very high	50 Å²	50	72.3 Å²	72.3	23%	0.234	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-42.9	176.1	-176.9	56.7	-149.7	0	0	111.4	P215 E216 V217 I221 Y222 Q223 H311 R350	P215-E219 WeakPolarHBondContact O-CB 3.43Å; P215-E219 PolarHBondContact O-N 3.47Å; E216-E219 PolarHBondContact O-N 3.29Å; V217-E219 VanDerWaalsContact C-N 3.35Å; V217-E219 PolarHBondContact O-N 2.94Å; E219-I221 VanDerWaalsContact C-N 3.3Å; E219-I221 PolarHBondContact O-N 2.99Å; E219-Y222 PolarHBondContact O-N 2.69Å; E219-Q223 HydrophobicContact CG-CG 4.43Å; E219-Q223 VanDerWaalsContact CG-NE2 3.34Å; E219-Q223 WeakPolarHBondContact O-CB 3.47Å; E219-Q223 VanDerWaalsContact O-CG 3.27Å; E219-Q223 WeakPolarHBondContact O-CG 3Å; E219-Q223 PolarHBondContact O-N 2.95Å; E219-Q223 WeakPolarHBondContact OE1-CG 3.47Å; E219-Q223 PolarHBondContact OE1-NE2 2.87Å; E219-H311 IonicContact OE1-CE1 3.8Å; E219-H311 IonicContact OE2-CE1 3.52Å; E219-R350 IonicContact OE2-CZ 2.64Å; E219-R350 IonicContact OE2-NH1 3.55Å; E219-R350 PolarHBondContact OE2-NH1 2.84Å; E219-R350 IonicContact OE2-NH2 3.66Å; E219-R350 PolarHBondContact OE2-NH2 3.34Å
220	H	96.8	Very high	96	Very high	109 Å²	109	71.4 Å²	71.4	51%	0.505	35%	0.353	S	S	.	.	H	α-helix	trans	-58.4	-39.9	172.8	-177.7	-78.8	0	0	0	112.4	E216 V217 Q223 H224	E216-H220 WeakPolarHBondContact O-CB 3.44Å; E216-H220 PolarHBondContact O-N 3.47Å; V217-H220 PolarHBondContact O-N 3.24Å; H220-Q223 PolarHBondContact O-N 2.85Å; H220-H224 AromaticContact CD2-CE1 3.53Å; H220-H224 AromaticContact CD2-ND1 3.78Å; H220-H224 AromaticContact CE1-CE1 3.58Å; H220-H224 AromaticContact CE1-ND1 3.41Å; H220-H224 PolarHBondContact CE1-ND1 3.11Å; H220-H224 AromaticContact CG-ND1 3.78Å; H220-H224 AromaticContact ND1-ND1 3.56Å; H220-H224 AromaticContact NE2-CE1 3.24Å; H220-H224 PolarHBondContact NE2-CE1 3.32Å; H220-H224 AromaticContact NE2-ND1 3.55Å; H220-H224 PolarHBondContact O-N 3.18Å; H220-H224 PolarHBondContact O-ND1 3.31Å
221	I	97.4	Very high	95.8	Very high	17 Å²	17	67 Å²	67	9%	0.087	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-51.9	174.2	-70.9	164	0	0	0	110.4	L204 D207 I208 V217 V218 E219 Q223 H224 N225 L228	L204-I221 HydrophobicContact CD2-CG2 4.11Å; D207-I221 HydrophobicContact CB-CD1 4.18Å; I208-I221 HydrophobicContact CD1-CG2 3.99Å; I208-I221 HydrophobicContact CG1-CD1 4.17Å; I208-I221 HydrophobicContact CG1-CG2 3.94Å; V217-I221 HydrophobicContact CG1-CD1 4.09Å; V217-I221 VanDerWaalsContact O-CG1 3.3Å; V217-I221 WeakPolarHBondContact O-CG1 3.35Å; V217-I221 PolarHBondContact O-N 3Å; V218-I221 WeakPolarHBondContact O-CB 3.4Å; V218-I221 PolarHBondContact O-N 2.96Å; E219-I221 VanDerWaalsContact C-N 3.3Å; E219-I221 PolarHBondContact O-N 2.99Å; I221-Q223 VanDerWaalsContact C-N 3.33Å; I221-Q223 PolarHBondContact O-N 2.75Å; I221-H224 PolarHBondContact O-N 2.95Å; I221-N225 WeakPolarHBondContact O-CB 3.45Å; I221-N225 PolarHBondContact O-N 3.39Å; I221-N225 VanDerWaalsContact O-N 3.1Å; I221-N225 PolarHBondContact O-ND2 3.31Å; I221-L228 HydrophobicContact CG2-CD1 3.83Å
222	Y	96.1	Very high	95.6	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-38.6	177.6	-83.1	-75.9	0	0	0	112.3	I208 V218 E219 H224 L228 K229 H311 Y343	I208-Y222 HydrophobicContact CD1-CD2 4.49Å; I208-Y222 HydrophobicContact CD1-CE2 3.86Å; V218-Y222 HydrophobicContact CG1-CD2 3.79Å; V218-Y222 HydrophobicContact CG1-CE2 3.72Å; V218-Y222 WeakPolarHBondContact O-CD2 3.43Å; V218-Y222 PolarHBondContact O-N 3.01Å; E219-Y222 PolarHBondContact O-N 2.69Å; Y222-H224 PolarHBondContact O-N 2.62Å; Y222-L228 HydrophobicContact CD1-CB 3.75Å; Y222-L228 HydrophobicContact CD1-CD1 4.12Å; Y222-L228 HydrophobicContact CE1-CB 3.72Å; Y222-L228 HydrophobicContact CE1-CD1 4.17Å; Y222-K229 HydrophobicContact CD1-CG 4.12Å; Y222-K229 WeakPolarHBondContact O-CD 3.49Å; Y222-K229 WeakPolarHBondContact O-CE 3.41Å; Y222-K229 PolarHBondContact O-NZ 3.29Å; Y222-H311 AromaticContact CD1-NE2 3.96Å; Y222-H311 AromaticContact CG-NE2 3.67Å; Y222-Y343 WeakPolarHBondContact OH-CE2 3.15Å; Y222-Y343 PolarHBondContact OH-OH 3.3Å
223	Q	94.9	Very high	95.4	Very high	107 Å²	107	68.2 Å²	68.2	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-49.1	179.7	-77	175.7	8	0	0	111.9	E219 H220 I221 K229	E219-Q223 HydrophobicContact CG-CG 4.43Å; E219-Q223 VanDerWaalsContact CG-NE2 3.34Å; E219-Q223 WeakPolarHBondContact O-CB 3.47Å; E219-Q223 VanDerWaalsContact O-CG 3.27Å; E219-Q223 WeakPolarHBondContact O-CG 3Å; E219-Q223 PolarHBondContact O-N 2.95Å; E219-Q223 WeakPolarHBondContact OE1-CG 3.47Å; E219-Q223 PolarHBondContact OE1-NE2 2.87Å; H220-Q223 PolarHBondContact O-N 2.85Å; I221-Q223 VanDerWaalsContact C-N 3.33Å; I221-Q223 PolarHBondContact O-N 2.75Å; Q223-K229 PolarHBondContact O-NZ 3.16Å
224	H	96.5	Very high	95.4	Very high	127 Å²	127	62 Å²	62	59%	0.588	33%	0.327	S	S	*	.	H	α-helix	trans	-81.4	-17.7	-176.8	-64.6	89.1	0	0	0	114.6	H220 I221 Y222	H220-H224 AromaticContact CD2-CE1 3.53Å; H220-H224 AromaticContact CD2-ND1 3.78Å; H220-H224 AromaticContact CE1-CE1 3.58Å; H220-H224 AromaticContact CE1-ND1 3.41Å; H220-H224 PolarHBondContact CE1-ND1 3.11Å; H220-H224 AromaticContact CG-ND1 3.78Å; H220-H224 AromaticContact ND1-ND1 3.56Å; H220-H224 AromaticContact NE2-CE1 3.24Å; H220-H224 PolarHBondContact NE2-CE1 3.32Å; H220-H224 AromaticContact NE2-ND1 3.55Å; H220-H224 PolarHBondContact O-N 3.18Å; H220-H224 PolarHBondContact O-ND1 3.31Å; I221-H224 PolarHBondContact O-N 2.95Å; Y222-H224 PolarHBondContact O-N 2.62Å
225	N	96.7	Very high	95.2	Very high	49 Å²	49	59.8 Å²	59.8	26%	0.262	32%	0.315	S	S	.	.			trans	-112.7	91.5	-175	-65.2	-82.2	0	0	0	112.5	L204 I221 I227 L228	L204-N225 HydrophobicContact CD1-CB 3.72Å; L204-N225 WeakPolarHBondContact CD1-OD1 3.5Å; L204-N225 HydrophobicContact CD2-CB 4.47Å; I221-N225 WeakPolarHBondContact O-CB 3.45Å; I221-N225 PolarHBondContact O-N 3.39Å; I221-N225 VanDerWaalsContact O-N 3.1Å; I221-N225 PolarHBondContact O-ND2 3.31Å; N225-I227 HydrophobicContact CB-CG2 4.35Å; N225-I227 PolarHBondContact O-N 3Å; N225-L228 HydrophobicContact CB-CD1 4.13Å; N225-L228 HydrophobicContact CB-CG 4.2Å; N225-L228 PolarHBondContact O-N 3.48Å
226	T	95.1	Very high	95	Very high	109 Å²	109	64 Å²	64	67%	0.669	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-60.1	-24.9	175.5	53.4	0	0	0	0	113.5	L228 K229 K307	T226-L228 PolarHBondContact O-N 3.22Å; T226-K229 PolarHBondContact O-N 2.97Å; T226-K229 VanDerWaalsContact O-N 3.12Å; T226-K307 PolarHBondContact O-NZ 2.93Å; T226-K307 VanDerWaalsContact O-NZ 3.14Å
227	I	95.6	Very high	94.8	Very high	44 Å²	44	58.4 Å²	58.4	23%	0.226	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-58.8	-29.6	176.4	-165.9	60.3	0	0	0	112.6	L204 N225 L239 K307	L204-I227 HydrophobicContact CD1-CG2 3.65Å; N225-I227 HydrophobicContact CB-CG2 4.35Å; N225-I227 PolarHBondContact O-N 3Å; I227-L239 HydrophobicContact CD1-CD2 3.6Å; I227-L239 HydrophobicContact CG1-CD2 4.08Å; I227-K307 VanDerWaalsContact O-CD 3.31Å; I227-K307 WeakPolarHBondContact O-CD 3.47Å; I227-K307 PolarHBondContact O-NZ 3Å
228	L	96.8	Very high	94.7	Very high	2 Å²	2	57 Å²	57	1%	0.01	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-85.7	-11.3	179.2	-57.4	178.7	0	0	0	114.9	T201 L204 I208 I221 Y222 N225 T226 S310	T201-L228 HydrophobicContact CG2-CD2 4.28Å; L204-L228 HydrophobicContact CB-CD1 4.08Å; L204-L228 HydrophobicContact CB-CD2 4.07Å; L204-L228 HydrophobicContact CB-CG 4.43Å; L204-L228 HydrophobicContact CD1-CD1 4.15Å; L204-L228 HydrophobicContact CD1-CD2 4.15Å; L204-L228 HydrophobicContact CD1-CG 4.01Å; I208-L228 HydrophobicContact CD1-CD1 3.83Å; I221-L228 HydrophobicContact CG2-CD1 3.83Å; Y222-L228 HydrophobicContact CD1-CB 3.75Å; Y222-L228 HydrophobicContact CD1-CD1 4.12Å; Y222-L228 HydrophobicContact CE1-CB 3.72Å; Y222-L228 HydrophobicContact CE1-CD1 4.17Å; N225-L228 HydrophobicContact CB-CD1 4.13Å; N225-L228 HydrophobicContact CB-CG 4.2Å; N225-L228 PolarHBondContact O-N 3.48Å; T226-L228 PolarHBondContact O-N 3.22Å; L228-S310 WeakPolarHBondContact O-CB 3.45Å
229	K	95	Very high	94.7	Very high	40 Å²	40	57.1 Å²	57.1	17%	0.174	29%	0.294	C	S	.	.	S	Bend	trans	-110.1	164.5	-171.9	-65.9	-177.8	-64.9	-157	0	112.3	Y222 Q223 T226 K307 H311	Y222-K229 HydrophobicContact CD1-CG 4.12Å; Y222-K229 WeakPolarHBondContact O-CD 3.49Å; Y222-K229 WeakPolarHBondContact O-CE 3.41Å; Y222-K229 PolarHBondContact O-NZ 3.29Å; Q223-K229 PolarHBondContact O-NZ 3.16Å; T226-K229 PolarHBondContact O-N 2.97Å; T226-K229 VanDerWaalsContact O-N 3.12Å; K229-K307 CarbonylContact C-O 3.53Å; K229-K307 VanDerWaalsContact C-O 3.25Å; K229-K307 WeakPolarHBondContact O-CG 3.47Å; K229-K307 PolarHBondContact O-NZ 3Å; K229-H311 HydrophobicContact CB-CB 4.45Å; K229-H311 HydrophobicContact CD-CB 3.93Å; K229-H311 HydrophobicContact CG-CB 4.1Å
230	Y	95.5	Very high	94.7	Very high	34 Å²	34	55.6 Å²	55.6	13%	0.133	29%	0.287	C	S	.	.			trans	-48.5	140.4	175.2	176.5	-100.8	0	0	0	113.2	Q232 E275 K307 Q308 S310 T312 P313 H320 Y323	Y230-Q232 HydrophobicContact CE1-CG 4.04Å; Y230-Q232 PolarHBondContact OH-NE2 3.36Å; Y230-E275 VanDerWaalsContact CE2-OE1 3.32Å; Y230-E275 WeakPolarHBondContact CE2-OE1 3.34Å; Y230-E275 PolarHBondContact OH-OE1 3.14Å; Y230-K307 WeakPolarHBondContact CA-O 3.43Å; Y230-K307 PolarHBondContact N-O 3.33Å; Y230-Q308 HydrophobicContact CD2-CB 4.26Å; Y230-Q308 VanDerWaalsContact CD2-O 3.25Å; Y230-Q308 WeakPolarHBondContact CD2-O 3.29Å; Y230-S310 PolarHBondContact N-O 2.74Å; Y230-T312 HydrophobicContact CD2-CG2 4.07Å; Y230-T312 HydrophobicContact CE2-CG2 4.21Å; Y230-T312 HydrophobicContact CG-CG2 4.2Å; Y230-P313 HydrophobicContact CD1-CG 4.02Å; Y230-P313 HydrophobicContact CE1-CG 4.22Å; Y230-H320 AromaticContact CZ-NE2 3.62Å; Y230-H320 PolarHBondContact OH-NE2 2.91Å; Y230-H320 VanDerWaalsContact OH-NE2 3.14Å; Y230-Y323 HydrophobicContact CE2-CE2 4.01Å
231	T	94.3	Very high	94.5	Very high	40 Å²	40	52 Å²	52	25%	0.245	27%	0.274	C	S	.	.			trans	-141.9	145	173	-176.3	0	0	0	0	112.7	G233 F268 Q272 Q308	T231-G233 WeakPolarHBondContact CG2-O 3.5Å; T231-G233 PolarHBondContact OG1-N 3.15Å; T231-G233 PolarHBondContact OG1-O 3.44Å; T231-F268 HydrophobicContact CG2-CE1 4.14Å; T231-F268 HydrophobicContact CG2-CZ 3.67Å; T231-Q272 PolarHBondContact O-NE2 3.41Å; T231-Q308 PolarHBondContact O-NE2 3.49Å; T231-Q308 PolarHBondContact O-OE1 3.49Å
232	Q	91.2	Very high	94.2	Very high	121 Å²	121	52.1 Å²	52.1	57%	0.565	27%	0.274	S	S	*	.	S	Bend	trans	-94.6	-12.9	167.2	-83.3	-76.4	-14.7	0	0	112.6	Y230 Q272 E275	Y230-Q232 HydrophobicContact CE1-CG 4.04Å; Y230-Q232 PolarHBondContact OH-NE2 3.36Å; Q232-Q272 PolarHBondContact O-NE2 3.37Å; Q232-E275 PolarHBondContact NE2-OE2 3.24Å
233	G	91.8	Very high	93.6	Very high	30 Å²	30	54.2 Å²	54.2	31%	0.309	29%	0.287	S	S	.	.	S	Bend	trans	-79.1	153.4	170.1	0	0	0	0	0	111.7	T231 Q272	T231-G233 WeakPolarHBondContact CG2-O 3.5Å; T231-G233 PolarHBondContact OG1-N 3.15Å; T231-G233 PolarHBondContact OG1-O 3.44Å; G233-Q272 PolarHBondContact O-NE2 2.96Å
234	P	93.6	Very high	93	Very high	57 Å²	57	50.5 Å²	50.5	37%	0.37	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-69.9	163.7	177.9	31.6	-37	0	0	0	112	Y236	P234-Y236 HydrophobicContact CG-CE1 4.11Å; P234-Y236 HydrophobicContact CG-CE2 4.32Å
235	L	91.8	Very high	91.8	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.094	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-91.3	131.1	164.2	-74	-178.4	0	0	0	110.2	L239 V265 F268 Q304	L235-L239 HydrophobicContact CD1-CD2 3.91Å; L235-L239 HydrophobicContact CD1-CG 3.98Å; L235-L239 HydrophobicContact CD2-CD2 4.18Å; L235-V265 VanDerWaalsContact O-CG1 3.25Å; L235-V265 WeakPolarHBondContact O-CG1 3.45Å; L235-F268 HydrophobicContact CB-CB 4.41Å; L235-F268 HydrophobicContact CB-CD1 3.88Å; L235-F268 HydrophobicContact CB-CE1 4.38Å; L235-F268 HydrophobicContact CB-CG 4.11Å; L235-F268 HydrophobicContact CD1-CB 4.14Å; L235-F268 HydrophobicContact CD1-CD1 4.06Å; L235-F268 HydrophobicContact CD1-CD2 3.56Å; L235-F268 HydrophobicContact CD1-CE1 4.37Å; L235-F268 HydrophobicContact CD1-CE2 3.94Å; L235-F268 HydrophobicContact CD1-CG 3.62Å; L235-F268 HydrophobicContact CD1-CZ 4.34Å; L235-F268 HydrophobicContact CG-CB 4.5Å; L235-F268 HydrophobicContact CG-CD1 3.66Å; L235-F268 HydrophobicContact CG-CD2 4.05Å; L235-F268 HydrophobicContact CG-CE1 3.79Å; L235-F268 HydrophobicContact CG-CE2 4.19Å; L235-F268 HydrophobicContact CG-CG 3.78Å; L235-F268 HydrophobicContact CG-CZ 4.07Å; L235-Q304 HydrophobicContact CD1-CG 4.3Å
236	Y	90.4	Very high	90.4	Very high	181 Å²	181	45 Å²	45	71%	0.71	25%	0.245	S	C	*	.	S	Bend	trans	-93.8	-12.4	173.9	-57.4	-74.7	0	0	0	113.1	P234	P234-Y236 HydrophobicContact CG-CE1 4.11Å; P234-Y236 HydrophobicContact CG-CE2 4.32Å
237	A	91.7	Very high	88.5	Confident	42 Å²	42	44.8 Å²	44.8	35%	0.347	24%	0.239	S	C	.	.	S	Bend	trans	-146.7	155.8	173.6	0	0	0	0	0	109.9
238	P	95.4	Very high	86.5	Confident	19 Å²	19	44.3 Å²	44.3	12%	0.123	24%	0.235	C	C	.	.			trans	-63.9	157.3	174.3	-20.3	34.6	0	0	0	112.2	L240 F242 R261 A264 V265 E300	P238-L240 VanDerWaalsContact C-N 3.34Å; P238-F242 HydrophobicContact CB-CD2 3.75Å; P238-F242 HydrophobicContact CB-CE2 3.85Å; P238-F242 HydrophobicContact CG-CD2 3.92Å; P238-F242 HydrophobicContact CG-CE2 4.41Å; P238-R261 HydrophobicContact CG-CB 4.48Å; P238-R261 HydrophobicContact CG-CG 3.84Å; P238-A264 HydrophobicContact CB-CB 3.82Å; P238-A264 HydrophobicContact CG-CB 3.59Å; P238-V265 HydrophobicContact CG-CG2 4.48Å; P238-E300 WeakPolarHBondContact CA-OE1 3.49Å; P238-E300 HydrophobicContact CB-CG 4.49Å
239	L	97.1	Very high	84.1	Confident	3 Å²	3	50 Å²	50	2%	0.016	26%	0.262	C	S	.	.	S	Bend	trans	-72.6	-29.4	175.7	-59.2	-180	0	0	0	112	T199 T201 I227 L235 E300 C303 Q304 K307	T199-L239 WeakPolarHBondContact CB-O 3.3Å; T199-L239 PolarHBondContact OG1-O 2.77Å; T201-L239 VanDerWaalsContact CB-O 3.22Å; T201-L239 WeakPolarHBondContact CB-O 3.41Å; T201-L239 HydrophobicContact CG2-CB 4.15Å; T201-L239 PolarHBondContact OG1-O 3.34Å; I227-L239 HydrophobicContact CD1-CD2 3.6Å; I227-L239 HydrophobicContact CG1-CD2 4.08Å; L235-L239 HydrophobicContact CD1-CD2 3.91Å; L235-L239 HydrophobicContact CD1-CG 3.98Å; L235-L239 HydrophobicContact CD2-CD2 4.18Å; L239-E300 VanDerWaalsContact N-CD 3.3Å; L239-E300 PolarHBondContact N-OE1 3.27Å; L239-E300 PolarHBondContact N-OE2 2.91Å; L239-C303 HydrophobicContact CB-CB 4.43Å; L239-C303 HydrophobicContact CD1-CB 3.96Å; L239-Q304 HydrophobicContact CD1-CB 4.33Å; L239-Q304 HydrophobicContact CD1-CG 3.75Å; L239-Q304 HydrophobicContact CG-CG 4.28Å; L239-K307 HydrophobicContact CD1-CB 4.42Å; L239-K307 HydrophobicContact CD1-CD 3.99Å; L239-K307 HydrophobicContact CD2-CD 4.19Å
240	L	95.6	Very high	81.7	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.094	29%	0.286	C	S	.	.	S	Bend	trans	-110.2	157.2	-179.2	-59.9	-175.4	0	0	0	112.4	Q202 P238 F242 D299 E300 V340	Q202-L240 HydrophobicContact CG-CD2 3.82Å; P238-L240 VanDerWaalsContact C-N 3.34Å; L240-F242 HydrophobicContact CB-CE2 4.18Å; L240-F242 HydrophobicContact CB-CZ 4.44Å; L240-F242 WeakPolarHBondContact O-CD2 3.49Å; L240-F242 PolarHBondContact O-N 3.43Å; L240-D299 HydrophobicContact CD1-CB 3.68Å; L240-E300 WeakPolarHBondContact CB-OE2 3.36Å; L240-E300 HydrophobicContact CD1-CB 4.44Å; L240-E300 PolarHBondContact N-OE2 3.22Å; L240-V340 HydrophobicContact CD1-CG2 4.43Å
241	P	92.3	Very high	79.2	Confident	34 Å²	34	61.5 Å²	61.5	22%	0.221	32%	0.318	C	S	.	.			trans	-77.9	124.7	-176.6	30.1	-33.1	0	0	0	111.5	L142 T199 Q202	L142-P241 HydrophobicContact CD1-CB 3.97Å; L142-P241 HydrophobicContact CD2-CB 3.93Å; T199-P241 HydrophobicContact CG2-CB 3.96Å; T199-P241 HydrophobicContact CG2-CG 4.28Å; Q202-P241 VanDerWaalsContact NE2-CD 3.26Å
242	F	89.9	Confident	77.2	Confident	20 Å²	20	61.9 Å²	61.9	9%	0.088	32%	0.317	C	S	.	.			trans	-123.1	146.1	172.4	-65.9	-72.3	0	0	0	110.7	P238 L240 V260 A264 P296 L297 E300	P238-F242 HydrophobicContact CB-CD2 3.75Å; P238-F242 HydrophobicContact CB-CE2 3.85Å; P238-F242 HydrophobicContact CG-CD2 3.92Å; P238-F242 HydrophobicContact CG-CE2 4.41Å; L240-F242 HydrophobicContact CB-CE2 4.18Å; L240-F242 HydrophobicContact CB-CZ 4.44Å; L240-F242 WeakPolarHBondContact O-CD2 3.49Å; L240-F242 PolarHBondContact O-N 3.43Å; F242-V260 HydrophobicContact CD1-CG1 3.54Å; F242-V260 HydrophobicContact CE1-CG1 3.83Å; F242-V260 HydrophobicContact CG-CG1 4.01Å; F242-V260 HydrophobicContact CZ-CG1 4.48Å; F242-A264 HydrophobicContact CE2-CB 4.32Å; F242-P296 HydrophobicContact CD1-CB 4.23Å; F242-P296 HydrophobicContact CE1-CB 3.63Å; F242-P296 WeakPolarHBondContact CE1-O 3.34Å; F242-P296 WeakPolarHBondContact CZ-O 3.29Å; F242-L297 HydrophobicContact CE2-CD2 4.46Å; F242-L297 HydrophobicContact CZ-CD2 4.13Å; F242-E300 HydrophobicContact CE2-CB 3.9Å; F242-E300 HydrophobicContact CE2-CG 4.06Å; F242-E300 HydrophobicContact CZ-CB 3.79Å; F242-E300 HydrophobicContact CZ-CG 4.42Å
243	P	84.6	Confident	75	Confident	44 Å²	44	63.1 Å²	63.1	29%	0.286	33%	0.327	S	S	.	.			trans	-55.8	147.5	171.7	-27.1	36.9	0	0	0	112.8	L142 L247	L142-P243 CarbonylContact O-C 3.59Å; L142-P243 VanDerWaalsContact O-CA 3.28Å; L142-P243 WeakPolarHBondContact O-CA 3.17Å; P243-L247 HydrophobicContact CB-CD1 4.09Å; P243-L247 HydrophobicContact CG-CD1 3.88Å
244	Y	82.4	Confident	73.3	Confident	29 Å²	29	65.6 Å²	65.6	11%	0.114	35%	0.353	C	S	.	.	S	Bend	trans	-77.7	-19.7	-174.7	-58.4	-44.8	0	0	0	114.2	T140 L142 G165 R166	T140-Y244 WeakPolarHBondContact OG1-CE2 3.32Å; L142-Y244 HydrophobicContact CB-CD1 4.41Å; L142-Y244 HydrophobicContact CB-CD2 4.11Å; L142-Y244 HydrophobicContact CB-CE1 4.04Å; L142-Y244 HydrophobicContact CB-CE2 3.74Å; L142-Y244 HydrophobicContact CB-CG 4.45Å; L142-Y244 HydrophobicContact CD1-CE1 4.26Å; L142-Y244 VanDerWaalsContact O-CD2 3.24Å; L142-Y244 WeakPolarHBondContact O-CD2 3.42Å; L142-Y244 PolarHBondContact O-N 3.09Å; G165-Y244 VanDerWaalsContact C-CD2 3.49Å; R166-Y244 HydrophobicContact CB-CE1 4.12Å; R166-Y244 HydrophobicContact CB-CE2 3.87Å; R166-Y244 HydrophobicContact CG-CE1 4.29Å; R166-Y244 VanDerWaalsContact N-CD2 3.33Å
245	G	71.6	Confident	72.2	Confident	4 Å²	4	68.3 Å²	68.3	4%	0.041	36%	0.359	C	S	.	.	S	Bend	trans	-105.2	160.4	174.1	0	0	0	0	0	112.3	S144 Y164	S144-G245 VanDerWaalsContact OG-CA 3.29Å; S144-G245 WeakPolarHBondContact OG-CA 3.34Å; S144-G245 PolarHBondContact OG-N 3.02Å; Y164-G245 VanDerWaalsContact CD1-CA 3.47Å
246	N	66.3	Low	71.5	Confident	56 Å²	56	71.1 Å²	71.1	30%	0.299	39%	0.392	S	S	.	.			trans	-69.6	137	-179.9	-157.8	-6.2	0	0	0	111.2	G258	N246-G258 PolarHBondContact ND2-O 3.47Å
247	L	55.4	Low	71.1	Confident	104 Å²	104	65.4 Å²	65.4	55%	0.545	37%	0.37	S	S	.	.	S	Bend	trans	-86.3	-12.5	-169.9	-136.7	76.4	0	0	0	113.5	P243	P243-L247 HydrophobicContact CB-CD1 4.09Å; P243-L247 HydrophobicContact CG-CD1 3.88Å
248	E	53.6	Low	70.6	Confident	34 Å²	34	64.3 Å²	64.3	16%	0.159	36%	0.362	C	S	.	.			trans	-119.4	47.3	-154	-63.7	176.4	162.3	0	0	114.4	T250 H252 L294	E248-T250 PolarHBondContact O-N 2.67Å; E248-H252 HydrophobicContact CB-CB 4.04Å; E248-H252 HydrophobicContact CG-CB 4.5Å; E248-H252 IonicContact OE1-CD2 2.71Å; E248-H252 IonicContact OE1-CG 2.78Å; E248-H252 IonicContact OE1-NE2 3.08Å; E248-H252 WeakPolarHBondContact OE2-CB 3.4Å; E248-H252 IonicContact OE2-CD2 2.8Å; E248-H252 IonicContact OE2-CG 3.88Å; E248-H252 IonicContact OE2-ND1 3.22Å; E248-L294 WeakPolarHBondContact OE1-CD2 3.33Å; E248-L294 WeakPolarHBondContact OE2-CD2 3.48Å
249	H	46.8	Very low	70	Confident	123 Å²	123	64.1 Å²	64.1	57%	0.569	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	0.2	170.4	-91	-79.2	0	0	0	114.7	I146	I146-H249 VanDerWaalsContact CD1-NE2 3.32Å; I146-H249 WeakPolarHBondContact CD1-NE2 3.17Å
250	T	44.4	Very low	69.5	Low	111 Å²	111	64.5 Å²	64.5	68%	0.681	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-19	-175.3	39.9	0	0	0	0	116.2	E248	E248-T250 PolarHBondContact O-N 2.67Å
251	Y	43.4	Very low	69.2	Low	203 Å²	203	67 Å²	67	80%	0.796	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.5	-30.2	-170.2	-76.2	-77	0	0	0	118
252	H	51.3	Low	69	Low	49 Å²	49	69.7 Å²	69.7	23%	0.227	38%	0.382	C	S	.	.			trans	-113	5.4	-166.5	-65.4	-108.9	0	0	0	115.1	E248 G254 K255 D293	E248-H252 HydrophobicContact CB-CB 4.04Å; E248-H252 HydrophobicContact CG-CB 4.5Å; E248-H252 IonicContact OE1-CD2 2.71Å; E248-H252 IonicContact OE1-CG 2.78Å; E248-H252 IonicContact OE1-NE2 3.08Å; E248-H252 WeakPolarHBondContact OE2-CB 3.4Å; E248-H252 IonicContact OE2-CD2 2.8Å; E248-H252 IonicContact OE2-CG 3.88Å; E248-H252 IonicContact OE2-ND1 3.22Å; H252-G254 PolarHBondContact O-N 3.29Å; H252-K255 PolarHBondContact O-N 3.4Å; H252-D293 PolarHBondContact CE1-O 3.1Å
253	N	46.8	Very low	69.2	Low	147 Å²	147	69.4 Å²	69.4	79%	0.786	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	12.6	-170.9	-150.5	23.2	0	0	0	115.8
254	G	56	Low	69.7	Low	82 Å²	82	67.3 Å²	67.3	85%	0.845	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-5.8	172.2	0	0	0	0	0	115.1	H252	H252-G254 PolarHBondContact O-N 3.29Å
255	K	68.8	Low	70.3	Confident	114 Å²	114	67.3 Å²	67.3	50%	0.496	37%	0.37	S	S	.	.	S	Bend	trans	-93.6	-16.5	-177.6	-68.6	-163.5	169.4	-165.3	0	115	H252 Y257 D293	H252-K255 PolarHBondContact O-N 3.4Å; K255-Y257 HydrophobicContact CB-CD2 3.84Å; K255-Y257 HydrophobicContact CB-CE2 3.79Å; K255-Y257 HydrophobicContact CD-CE2 4.15Å; K255-D293 WeakPolarHBondContact CD-OD2 3.45Å; K255-D293 IonicContact NZ-OD1 2.76Å; K255-D293 PolarHBondContact NZ-OD1 3.02Å; K255-D293 IonicContact NZ-OD2 3.29Å; K255-D293 PolarHBondContact NZ-OD2 2.93Å
256	G	77.1	Confident	71.4	Confident	77 Å²	77	70.3 Å²	70.3	79%	0.794	38%	0.382	S	S	*	.			trans	83.5	12.8	170.7	0	0	0	0	0	116.6
257	Y	83.1	Confident	72.8	Confident	60 Å²	60	68 Å²	68	24%	0.235	37%	0.369	C	S	.	.			trans	-67	151.6	170.9	-62.8	-65.8	0	0	0	112.3	K255 E263 T290 D293 L294	K255-Y257 HydrophobicContact CB-CD2 3.84Å; K255-Y257 HydrophobicContact CB-CE2 3.79Å; K255-Y257 HydrophobicContact CD-CE2 4.15Å; Y257-E263 HydrophobicContact CD1-CG 4.23Å; Y257-T290 HydrophobicContact CD1-CG2 4.3Å; Y257-T290 HydrophobicContact CE1-CG2 3.73Å; Y257-D293 HydrophobicContact CE2-CB 4.04Å; Y257-L294 HydrophobicContact CD1-CD1 4.1Å; Y257-L294 HydrophobicContact CD2-CD1 4.19Å; Y257-L294 HydrophobicContact CD2-CD2 4.33Å; Y257-L294 HydrophobicContact CD2-CG 4.25Å; Y257-L294 HydrophobicContact CG-CD1 3.87Å; Y257-L294 HydrophobicContact CG-CG 4.44Å
258	G	81.3	Confident	74.8	Confident	19 Å²	19	63 Å²	63	20%	0.196	34%	0.344	C	S	.	.			trans	-79.4	-154.8	168.2	0	0	0	0	0	112.2	N246 E263	N246-G258 PolarHBondContact ND2-O 3.47Å; G258-E263 WeakPolarHBondContact CA-OE1 3.31Å; G258-E263 PolarHBondContact N-OE1 3.29Å
259	S	82.4	Confident	76.7	Confident	15 Å²	15	64 Å²	64	11%	0.105	35%	0.35	C	S	.	.			trans	-70.1	151.4	169.8	70.6	0	0	0	0	111.4	R261 E262 E263	S259-R261 PolarHBondContact O-N 3.25Å; S259-R261 VanDerWaalsContact O-N 3.08Å; S259-E262 WeakPolarHBondContact CB-OE1 3.22Å; S259-E262 PolarHBondContact N-OE1 3.44Å; S259-E262 VanDerWaalsContact N-OE1 3.09Å; S259-E262 WeakPolarHBondContact O-CA 3.48Å; S259-E262 WeakPolarHBondContact O-CB 3.14Å; S259-E262 PolarHBondContact O-N 3.28Å; S259-E262 VanDerWaalsContact OG-CD 3.29Å; S259-E262 WeakPolarHBondContact OG-CG 3.3Å; S259-E262 PolarHBondContact OG-N 2.73Å; S259-E262 PolarHBondContact OG-OE1 3.44Å; S259-E263 PolarHBondContact O-N 2.89Å
260	V	87.3	Confident	79	Confident	11 Å²	11	59 Å²	59	7%	0.067	33%	0.329	C	S	.	.	H	α-helix	trans	-51.4	-35.8	175.7	-176.6	0	0	0	0	111.7	F242 E263 A264 P296 L297	F242-V260 HydrophobicContact CD1-CG1 3.54Å; F242-V260 HydrophobicContact CE1-CG1 3.83Å; F242-V260 HydrophobicContact CG-CG1 4.01Å; F242-V260 HydrophobicContact CZ-CG1 4.48Å; V260-E263 PolarHBondContact O-N 3.1Å; V260-A264 WeakPolarHBondContact O-CB 3.23Å; V260-A264 PolarHBondContact O-N 2.91Å; V260-P296 HydrophobicContact CG1-CB 4.3Å; V260-L297 HydrophobicContact CG1-CD2 3.51Å; V260-L297 HydrophobicContact CG1-CG 3.99Å
261	R	88.8	Confident	81.4	Confident	71 Å²	71	53.8 Å²	53.8	27%	0.268	30%	0.297	S	S	.	.	H	α-helix	trans	-66.5	-36.1	176.3	-175.6	172	179.9	-143.1	-10.1	113.4	R166 P238 S259	R166-R261 PolarHBondContact O-NH1 3.18Å; P238-R261 HydrophobicContact CG-CB 4.48Å; P238-R261 HydrophobicContact CG-CG 3.84Å; S259-R261 PolarHBondContact O-N 3.25Å; S259-R261 VanDerWaalsContact O-N 3.08Å
262	E	88.4	Confident	83.7	Confident	91 Å²	91	45.7 Å²	45.7	43%	0.425	27%	0.266	S	S	.	.	H	α-helix	trans	-72.7	-43.7	173.4	-67.6	153.6	-119.6	0	0	111.5	S259 A264 V265 K266	S259-E262 WeakPolarHBondContact CB-OE1 3.22Å; S259-E262 PolarHBondContact N-OE1 3.44Å; S259-E262 VanDerWaalsContact N-OE1 3.09Å; S259-E262 WeakPolarHBondContact O-CA 3.48Å; S259-E262 WeakPolarHBondContact O-CB 3.14Å; S259-E262 PolarHBondContact O-N 3.28Å; S259-E262 VanDerWaalsContact OG-CD 3.29Å; S259-E262 WeakPolarHBondContact OG-CG 3.3Å; S259-E262 PolarHBondContact OG-N 2.73Å; S259-E262 PolarHBondContact OG-OE1 3.44Å; E262-A264 PolarHBondContact O-N 2.8Å; E262-V265 PolarHBondContact O-N 2.8Å; E262-V265 VanDerWaalsContact O-N 3.14Å; E262-K266 WeakPolarHBondContact O-CG 3.35Å; E262-K266 PolarHBondContact O-N 3.2Å; E262-K266 IonicContact OE2-NZ 2.69Å
263	E	93.1	Very high	85.6	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.065	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-40.3	-179.4	-61.7	-48.3	135	0	0	111.6	Y257 G258 S259 V260 V265 K266 L267 L294 L297	Y257-E263 HydrophobicContact CD1-CG 4.23Å; G258-E263 WeakPolarHBondContact CA-OE1 3.31Å; G258-E263 PolarHBondContact N-OE1 3.29Å; S259-E263 PolarHBondContact O-N 2.89Å; V260-E263 PolarHBondContact O-N 3.1Å; E263-V265 VanDerWaalsContact C-N 3.28Å; E263-V265 PolarHBondContact O-N 3.34Å; E263-K266 PolarHBondContact O-N 3.49Å; E263-K266 IonicContact OE1-NZ 3.56Å; E263-K266 PolarHBondContact OE1-NZ 3.28Å; E263-K266 WeakPolarHBondContact OE2-CD 3.36Å; E263-K266 IonicContact OE2-NZ 3.21Å; E263-L267 WeakPolarHBondContact O-CB 3.32Å; E263-L267 VanDerWaalsContact O-CG 3.23Å; E263-L267 WeakPolarHBondContact O-CG 3.48Å; E263-L267 PolarHBondContact O-N 2.93Å; E263-L294 HydrophobicContact CB-CD1 4Å; E263-L294 HydrophobicContact CG-CD1 3.75Å; E263-L297 HydrophobicContact CB-CD1 3.71Å
264	A	95.2	Very high	87.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-52.8	-42.7	170.4	0	0	0	0	0	113.4	P238 F242 V260 E262 F268 L297 E300 Q304	P238-A264 HydrophobicContact CB-CB 3.82Å; P238-A264 HydrophobicContact CG-CB 3.59Å; F242-A264 HydrophobicContact CE2-CB 4.32Å; V260-A264 WeakPolarHBondContact O-CB 3.23Å; V260-A264 PolarHBondContact O-N 2.91Å; E262-A264 PolarHBondContact O-N 2.8Å; A264-F268 PolarHBondContact O-N 2.66Å; A264-L297 HydrophobicContact CB-CD2 3.69Å; A264-E300 HydrophobicContact CB-CG 3.88Å; A264-Q304 PolarHBondContact O-NE2 3.25Å
265	V	94.3	Very high	89.4	Confident	29 Å²	29	38.5 Å²	38.5	18%	0.176	21%	0.206	C	C	.	.	H	α-helix	trans	-73.5	-41	177.6	165.2	0	0	0	0	111.7	L235 P238 E262 E263 L267 F268 N269	L235-V265 VanDerWaalsContact O-CG1 3.25Å; L235-V265 WeakPolarHBondContact O-CG1 3.45Å; P238-V265 HydrophobicContact CG-CG2 4.48Å; E262-V265 PolarHBondContact O-N 2.8Å; E262-V265 VanDerWaalsContact O-N 3.14Å; E263-V265 VanDerWaalsContact C-N 3.28Å; E263-V265 PolarHBondContact O-N 3.34Å; V265-L267 VanDerWaalsContact C-N 3.33Å; V265-L267 PolarHBondContact O-N 2.89Å; V265-F268 PolarHBondContact O-N 3.35Å; V265-N269 PolarHBondContact O-N 3.09Å; V265-N269 PolarHBondContact O-ND2 3.14Å
266	K	94.7	Very high	90.3	Very high	66 Å²	66	37.9 Å²	37.9	29%	0.287	22%	0.216	S	C	.	.	H	α-helix	trans	-60.1	-42.8	174.5	-69.7	165.3	-167.3	166.5	0	111.2	E262 E263 F268 N269 C270	E262-K266 WeakPolarHBondContact O-CG 3.35Å; E262-K266 PolarHBondContact O-N 3.2Å; E262-K266 IonicContact OE2-NZ 2.69Å; E263-K266 PolarHBondContact O-N 3.49Å; E263-K266 IonicContact OE1-NZ 3.56Å; E263-K266 PolarHBondContact OE1-NZ 3.28Å; E263-K266 WeakPolarHBondContact OE2-CD 3.36Å; E263-K266 IonicContact OE2-NZ 3.21Å; K266-F268 PolarHBondContact O-N 3.33Å; K266-N269 WeakPolarHBondContact O-CB 3.27Å; K266-N269 PolarHBondContact O-N 3.37Å; K266-N269 VanDerWaalsContact O-N 3.17Å; K266-C270 PolarHBondContact O-N 3.47Å; K266-C270 PolarHBondContact O-SG 3.22Å; K266-C270 VanDerWaalsContact O-SG 3.42Å
267	L	97	Very high	90.9	Very high	7 Å²	7	35 Å²	35	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-42.1	177.4	-71.2	173.2	0	0	0	111.7	E263 V265 N269 C270 L271 V287 T290 L297 V301	E263-L267 WeakPolarHBondContact O-CB 3.32Å; E263-L267 VanDerWaalsContact O-CG 3.23Å; E263-L267 WeakPolarHBondContact O-CG 3.48Å; E263-L267 PolarHBondContact O-N 2.93Å; V265-L267 VanDerWaalsContact C-N 3.33Å; V265-L267 PolarHBondContact O-N 2.89Å; L267-N269 VanDerWaalsContact C-N 3.3Å; L267-N269 PolarHBondContact O-N 2.92Å; L267-C270 CarbonylContact O-C 3.55Å; L267-C270 WeakPolarHBondContact O-CA 3.31Å; L267-C270 WeakPolarHBondContact O-CB 3.43Å; L267-C270 PolarHBondContact O-N 2.88Å; L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 2.99Å; L267-V287 HydrophobicContact CD2-CB 4.22Å; L267-V287 HydrophobicContact CD2-CG1 4.2Å; L267-V287 HydrophobicContact CD2-CG2 3.9Å; L267-T290 HydrophobicContact CD1-CG2 3.98Å; L267-T290 HydrophobicContact CD2-CG2 4.12Å; L267-T290 HydrophobicContact CG-CG2 4.35Å; L267-L297 HydrophobicContact CD1-CB 4.27Å; L267-L297 HydrophobicContact CD1-CD1 3.7Å; L267-L297 HydrophobicContact CD1-CG 4.49Å; L267-V301 HydrophobicContact CB-CG2 4.28Å; L267-V301 HydrophobicContact CD1-CG2 3.75Å
268	F	97.2	Very high	91.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.1	-40.9	174.7	-169.4	-101	0	0	0	112.5	T231 L235 A264 V265 K266 C270 L271 Q272 Q304 K307 Q308	T231-F268 HydrophobicContact CG2-CE1 4.14Å; T231-F268 HydrophobicContact CG2-CZ 3.67Å; L235-F268 HydrophobicContact CB-CB 4.41Å; L235-F268 HydrophobicContact CB-CD1 3.88Å; L235-F268 HydrophobicContact CB-CE1 4.38Å; L235-F268 HydrophobicContact CB-CG 4.11Å; L235-F268 HydrophobicContact CD1-CB 4.14Å; L235-F268 HydrophobicContact CD1-CD1 4.06Å; L235-F268 HydrophobicContact CD1-CD2 3.56Å; L235-F268 HydrophobicContact CD1-CE1 4.37Å; L235-F268 HydrophobicContact CD1-CE2 3.94Å; L235-F268 HydrophobicContact CD1-CG 3.62Å; L235-F268 HydrophobicContact CD1-CZ 4.34Å; L235-F268 HydrophobicContact CG-CB 4.5Å; L235-F268 HydrophobicContact CG-CD1 3.66Å; L235-F268 HydrophobicContact CG-CD2 4.05Å; L235-F268 HydrophobicContact CG-CE1 3.79Å; L235-F268 HydrophobicContact CG-CE2 4.19Å; L235-F268 HydrophobicContact CG-CG 3.78Å; L235-F268 HydrophobicContact CG-CZ 4.07Å; A264-F268 PolarHBondContact O-N 2.66Å; V265-F268 PolarHBondContact O-N 3.35Å; K266-F268 PolarHBondContact O-N 3.33Å; F268-C270 VanDerWaalsContact C-N 3.32Å; F268-C270 PolarHBondContact O-N 3.48Å; F268-L271 HydrophobicContact CD2-CD1 4.25Å; F268-L271 WeakPolarHBondContact O-CB 3.43Å; F268-L271 PolarHBondContact O-N 3.47Å; F268-L271 VanDerWaalsContact O-N 3.13Å; F268-Q272 HydrophobicContact CD1-CG 4.42Å; F268-Q272 HydrophobicContact CE1-CG 4Å; F268-Q272 HydrophobicContact CZ-CG 4.36Å; F268-Q272 PolarHBondContact O-N 2.99Å; F268-Q304 HydrophobicContact CD2-CB 3.97Å; F268-Q304 HydrophobicContact CD2-CG 3.82Å; F268-Q304 HydrophobicContact CE2-CB 4.44Å; F268-K307 HydrophobicContact CE2-CD 4.46Å; F268-Q308 HydrophobicContact CE2-CG 3.93Å; F268-Q308 HydrophobicContact CZ-CG 4.3Å
269	N	93.9	Very high	91.7	Very high	54 Å²	54	49.4 Å²	49.4	29%	0.289	24%	0.238	S	C	.	.	H	α-helix	trans	-65.2	-35.5	174.7	-62.3	-38	0	0	0	111.7	V265 K266 L267 Q272 Q273	V265-N269 PolarHBondContact O-N 3.09Å; V265-N269 PolarHBondContact O-ND2 3.14Å; K266-N269 WeakPolarHBondContact O-CB 3.27Å; K266-N269 PolarHBondContact O-N 3.37Å; K266-N269 VanDerWaalsContact O-N 3.17Å; L267-N269 VanDerWaalsContact C-N 3.3Å; L267-N269 PolarHBondContact O-N 2.92Å; N269-Q272 PolarHBondContact O-N 3.39Å; N269-Q273 VanDerWaalsContact O-CG 3.27Å; N269-Q273 WeakPolarHBondContact O-CG 3.33Å; N269-Q273 PolarHBondContact O-N 2.87Å
270	C	94.8	Very high	92.3	Very high	20 Å²	20	49 Å²	49	14%	0.135	24%	0.236	C	C	.	.	H	α-helix	trans	-65.7	-35.7	170.7	-64.5	0	0	0	0	112.6	K266 L267 F268 Q273 L274 I283 V287	K266-C270 PolarHBondContact O-N 3.47Å; K266-C270 PolarHBondContact O-SG 3.22Å; K266-C270 VanDerWaalsContact O-SG 3.42Å; L267-C270 CarbonylContact O-C 3.55Å; L267-C270 WeakPolarHBondContact O-CA 3.31Å; L267-C270 WeakPolarHBondContact O-CB 3.43Å; L267-C270 PolarHBondContact O-N 2.88Å; F268-C270 VanDerWaalsContact C-N 3.32Å; F268-C270 PolarHBondContact O-N 3.48Å; C270-Q273 PolarHBondContact O-N 2.97Å; C270-L274 PolarHBondContact O-N 3.19Å; C270-L274 VanDerWaalsContact O-N 3.1Å; C270-I283 HydrophobicContact CB-CG2 4.22Å; C270-V287 HydrophobicContact CB-CG2 4.18Å
271	L	94.3	Very high	92.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-45.2	172.8	-58.2	-172	0	0	0	111.2	L267 F268 L274 V301 Q304 L305 Y323 L326	L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 2.99Å; F268-L271 HydrophobicContact CD2-CD1 4.25Å; F268-L271 WeakPolarHBondContact O-CB 3.43Å; F268-L271 PolarHBondContact O-N 3.47Å; F268-L271 VanDerWaalsContact O-N 3.13Å; L271-L274 VanDerWaalsContact O-CB 3.22Å; L271-L274 WeakPolarHBondContact O-CB 3.35Å; L271-L274 PolarHBondContact O-N 3.15Å; L271-V301 HydrophobicContact CD2-CG1 4.45Å; L271-Q304 HydrophobicContact CD1-CB 3.63Å; L271-L305 HydrophobicContact CD1-CD2 4.17Å; L271-L305 HydrophobicContact CD1-CG 4.31Å; L271-L305 HydrophobicContact CD2-CD2 4.11Å; L271-Y323 HydrophobicContact CB-CE1 4Å; L271-Y323 WeakPolarHBondContact O-CE1 3.42Å; L271-L326 HydrophobicContact CD2-CD2 3.28Å
272	Q	91.9	Very high	93	Very high	32 Å²	32	47.3 Å²	47.3	15%	0.15	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-38.1	178.3	-70.8	-178.6	-43.6	0	0	112.3	T231 Q232 G233 F268 N269 L274 E275	T231-Q272 PolarHBondContact O-NE2 3.41Å; Q232-Q272 PolarHBondContact O-NE2 3.37Å; G233-Q272 PolarHBondContact O-NE2 2.96Å; F268-Q272 HydrophobicContact CD1-CG 4.42Å; F268-Q272 HydrophobicContact CE1-CG 4Å; F268-Q272 HydrophobicContact CZ-CG 4.36Å; F268-Q272 PolarHBondContact O-N 2.99Å; N269-Q272 PolarHBondContact O-N 3.39Å; Q272-L274 PolarHBondContact O-N 2.98Å; Q272-E275 PolarHBondContact O-N 3.17Å
273	Q	91.4	Very high	93.4	Very high	96 Å²	96	45.1 Å²	45.1	45%	0.449	23%	0.225	S	C	.	.	H	α-helix	trans	-59.5	-33.9	172.7	-73.6	170	19.8	0	0	112.3	N269 C270 E275 S276 A277	N269-Q273 VanDerWaalsContact O-CG 3.27Å; N269-Q273 WeakPolarHBondContact O-CG 3.33Å; N269-Q273 PolarHBondContact O-N 2.87Å; C270-Q273 PolarHBondContact O-N 2.97Å; Q273-E275 VanDerWaalsContact C-N 3.27Å; Q273-E275 PolarHBondContact O-N 2.91Å; Q273-S276 PolarHBondContact O-N 3.22Å; Q273-S276 PolarHBondContact O-OG 3.48Å; Q273-A277 PolarHBondContact O-N 3.38Å
274	L	91.9	Very high	93.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-33.7	-178.5	-161.7	70.4	0	0	0	112.9	C270 L271 Q272 S276 A277 P280 I283 I284 R322 L326	C270-L274 PolarHBondContact O-N 3.19Å; C270-L274 VanDerWaalsContact O-N 3.1Å; L271-L274 VanDerWaalsContact O-CB 3.22Å; L271-L274 WeakPolarHBondContact O-CB 3.35Å; L271-L274 PolarHBondContact O-N 3.15Å; Q272-L274 PolarHBondContact O-N 2.98Å; L274-S276 PolarHBondContact O-N 3.49Å; L274-S276 VanDerWaalsContact O-N 3.16Å; L274-A277 HydrophobicContact CD1-CB 4.38Å; L274-A277 WeakPolarHBondContact O-CB 3.35Å; L274-A277 PolarHBondContact O-N 3.4Å; L274-A277 VanDerWaalsContact O-N 3.1Å; L274-P280 HydrophobicContact CD1-CB 3.67Å; L274-P280 HydrophobicContact CG-CB 4.5Å; L274-I283 HydrophobicContact CD1-CB 3.75Å; L274-I283 HydrophobicContact CD1-CD1 4.23Å; L274-I283 HydrophobicContact CD1-CG2 3.82Å; L274-I284 HydrophobicContact CD1-CG1 4.06Å; L274-I284 HydrophobicContact CD2-CG1 4.14Å; L274-R322 HydrophobicContact CD2-CB 3.79Å; L274-R322 HydrophobicContact CG-CB 3.82Å; L274-R322 HydrophobicContact CG-CG 4.29Å; L274-L326 HydrophobicContact CD2-CB 4.19Å; L274-L326 HydrophobicContact CD2-CD2 4.16Å
275	E	89.6	Confident	93.6	Very high	32 Å²	32	44.9 Å²	44.9	15%	0.15	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-35.9	174.3	-70.8	-171.1	171.9	0	0	112.4	Y230 Q232 Q272 Q273 A319 H320 Y323	Y230-E275 VanDerWaalsContact CE2-OE1 3.32Å; Y230-E275 WeakPolarHBondContact CE2-OE1 3.34Å; Y230-E275 PolarHBondContact OH-OE1 3.14Å; Q232-E275 PolarHBondContact NE2-OE2 3.24Å; Q272-E275 PolarHBondContact O-N 3.17Å; Q273-E275 VanDerWaalsContact C-N 3.27Å; Q273-E275 PolarHBondContact O-N 2.91Å; E275-A319 HydrophobicContact CB-CB 4.11Å; E275-A319 WeakPolarHBondContact O-CB 3.23Å; E275-H320 IonicContact OE1-CD2 2.69Å; E275-H320 IonicContact OE1-NE2 3.59Å; E275-Y323 HydrophobicContact CG-CE2 3.92Å; E275-Y323 WeakPolarHBondContact CG-OH 3.28Å; E275-Y323 VanDerWaalsContact OE1-CE2 3.25Å; E275-Y323 WeakPolarHBondContact OE1-CE2 3.22Å; E275-Y323 VanDerWaalsContact OE1-CZ 3.3Å; E275-Y323 PolarHBondContact OE1-OH 3.25Å
276	S	88.7	Confident	93.7	Very high	101 Å²	101	44.7 Å²	44.7	71%	0.706	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.1	-176.8	73.5	0	0	0	0	114.4	Q273 L274 R278	Q273-S276 PolarHBondContact O-N 3.22Å; Q273-S276 PolarHBondContact O-OG 3.48Å; L274-S276 PolarHBondContact O-N 3.49Å; L274-S276 VanDerWaalsContact O-N 3.16Å; S276-R278 PolarHBondContact O-N 2.87Å
277	A	90.6	Very high	93.8	Very high	16 Å²	16	41.7 Å²	41.7	13%	0.132	22%	0.215	C	C	.	.			trans	-74.1	121.3	-167.9	0	0	0	0	0	112.9	Q273 L274 P280 I283 R322	Q273-A277 PolarHBondContact O-N 3.38Å; L274-A277 HydrophobicContact CD1-CB 4.38Å; L274-A277 WeakPolarHBondContact O-CB 3.35Å; L274-A277 PolarHBondContact O-N 3.4Å; L274-A277 VanDerWaalsContact O-N 3.1Å; A277-P280 HydrophobicContact CB-CB 4.39Å; A277-I283 HydrophobicContact CB-CD1 3.77Å; A277-R322 PolarHBondContact O-NH2 3.46Å
278	R	89.2	Confident	93.9	Very high	241 Å²	241	41.4 Å²	41.4	91%	0.909	21%	0.213	S	C	*	.	S	Bend	trans	-64.6	-46.3	169.9	-65.3	-176	179.7	-171.2	-0.3	111.3	S276 P280	S276-R278 PolarHBondContact O-N 2.87Å; R278-P280 WeakPolarHBondContact O-CD 3.45Å
279	E	91.6	Very high	93.8	Very high	140 Å²	140	43.5 Å²	43.5	65%	0.654	22%	0.223	S	C	*	.	S	Bend	trans	-114.2	96.5	175.9	-66.9	177.5	106.8	0	0	107.6	P282	E279-P282 WeakPolarHBondContact O-CD 3.14Å
280	P	94.3	Very high	93.8	Very high	7 Å²	7	41.7 Å²	41.7	5%	0.045	21%	0.214	C	C	.	.			trans	-81.5	-23.7	-174.7	32.5	-37.7	0	0	0	113.2	L274 A277 R278 P282 I283 I284 M390	L274-P280 HydrophobicContact CD1-CB 3.67Å; L274-P280 HydrophobicContact CG-CB 4.5Å; A277-P280 HydrophobicContact CB-CB 4.39Å; R278-P280 WeakPolarHBondContact O-CD 3.45Å; P280-P282 VanDerWaalsContact C-CD 3.48Å; P280-I283 PolarHBondContact O-N 3.25Å; P280-I283 VanDerWaalsContact O-N 3.13Å; P280-I284 HydrophobicContact CB-CD1 4.14Å; P280-I284 WeakPolarHBondContact O-CG1 3.33Å; P280-I284 PolarHBondContact O-N 3.28Å; P280-M390 HydrophobicContact CG-CE 3.43Å; P280-M390 VanDerWaalsContact CG-CE 3.43Å; P280-M390 HydrophobicContact CG-SD 3.93Å
281	V	96.1	Very high	93.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.3	-42.8	-173.6	179.3	0	0	0	0	114.7	I283 I284 Q285 W383 I386 Q387 M390	V281-I283 PolarHBondContact O-N 3.01Å; V281-I284 PolarHBondContact O-N 3Å; V281-Q285 WeakPolarHBondContact O-CB 3.08Å; V281-Q285 PolarHBondContact O-N 3.43Å; V281-W383 HydrophobicContact CB-CD2 4.17Å; V281-W383 HydrophobicContact CB-CE3 4.08Å; V281-W383 HydrophobicContact CB-CH2 4.04Å; V281-W383 HydrophobicContact CB-CZ2 4.1Å; V281-W383 HydrophobicContact CB-CZ3 4.02Å; V281-W383 HydrophobicContact CG1-CD2 3.54Å; V281-W383 HydrophobicContact CG1-CE3 3.47Å; V281-W383 VanDerWaalsContact CG1-CE3 3.47Å; V281-W383 HydrophobicContact CG1-CG 4.04Å; V281-W383 HydrophobicContact CG1-CH2 4.35Å; V281-W383 HydrophobicContact CG1-CZ2 4.39Å; V281-W383 HydrophobicContact CG1-CZ3 3.9Å; V281-I386 HydrophobicContact CB-CG2 4.24Å; V281-I386 HydrophobicContact CG1-CB 3.87Å; V281-I386 HydrophobicContact CG1-CD1 3.98Å; V281-I386 HydrophobicContact CG1-CG2 3.84Å; V281-I386 HydrophobicContact CG2-CB 4.44Å; V281-I386 HydrophobicContact CG2-CG2 3.82Å; V281-Q387 HydrophobicContact CG2-CG 4.06Å; V281-Q387 VanDerWaalsContact CG2-NE2 3.29Å; V281-M390 HydrophobicContact CG2-SD 3.6Å
282	P	94.9	Very high	93.8	Very high	47 Å²	47	42 Å²	42	31%	0.305	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-35.4	176.3	-7.9	16.2	0	0	0	112.4	E279 P280 G286 W383	E279-P282 WeakPolarHBondContact O-CD 3.14Å; P280-P282 VanDerWaalsContact C-CD 3.48Å; P282-G286 PolarHBondContact O-N 3.2Å; P282-W383 HydrophobicContact CB-CZ3 4.25Å; P282-W383 HydrophobicContact CG-CH2 3.73Å; P282-W383 HydrophobicContact CG-CZ3 3.64Å
283	I	95.9	Very high	93.7	Very high	44 Å²	44	41.6 Å²	41.6	23%	0.226	21%	0.213	C	C	.	.	H	α-helix	trans	-73.1	-45.1	179.4	-55.2	175.1	0	0	0	109.7	C270 L274 A277 P280 V281 G286 V287	C270-I283 HydrophobicContact CB-CG2 4.22Å; L274-I283 HydrophobicContact CD1-CB 3.75Å; L274-I283 HydrophobicContact CD1-CD1 4.23Å; L274-I283 HydrophobicContact CD1-CG2 3.82Å; A277-I283 HydrophobicContact CB-CD1 3.77Å; P280-I283 PolarHBondContact O-N 3.25Å; P280-I283 VanDerWaalsContact O-N 3.13Å; V281-I283 PolarHBondContact O-N 3.01Å; I283-G286 PolarHBondContact O-N 3.4Å; I283-V287 WeakPolarHBondContact O-CG2 3.37Å; I283-V287 PolarHBondContact O-N 3.4Å
284	I	98	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-50.3	174.8	-70.5	167.3	0	0	0	110.5	L274 P280 V281 G286 V287 L288 L326 C329 I386 M390	L274-I284 HydrophobicContact CD1-CG1 4.06Å; L274-I284 HydrophobicContact CD2-CG1 4.14Å; P280-I284 HydrophobicContact CB-CD1 4.14Å; P280-I284 WeakPolarHBondContact O-CG1 3.33Å; P280-I284 PolarHBondContact O-N 3.28Å; V281-I284 PolarHBondContact O-N 3Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 PolarHBondContact O-N 2.9Å; I284-V287 PolarHBondContact O-N 3.27Å; I284-L288 HydrophobicContact CG2-CD1 3.7Å; I284-L288 HydrophobicContact CG2-CG 4.41Å; I284-L288 WeakPolarHBondContact O-CB 3.29Å; I284-L288 VanDerWaalsContact O-CG 3.23Å; I284-L288 WeakPolarHBondContact O-CG 3.38Å; I284-L288 PolarHBondContact O-N 3.37Å; I284-L326 HydrophobicContact CB-CD1 4.27Å; I284-L326 HydrophobicContact CG1-CB 4.3Å; I284-L326 HydrophobicContact CG1-CD1 4.2Å; I284-L326 HydrophobicContact CG2-CD1 3.84Å; I284-C329 HydrophobicContact CG2-CB 4.05Å; I284-I386 HydrophobicContact CB-CG2 4.14Å; I284-I386 HydrophobicContact CD1-CG2 4.18Å; I284-I386 HydrophobicContact CG2-CD1 4.15Å; I284-I386 HydrophobicContact CG2-CG1 4.34Å; I284-I386 HydrophobicContact CG2-CG2 3.62Å; I284-M390 HydrophobicContact CD1-CG 4.12Å; I284-M390 HydrophobicContact CD1-SD 3.86Å
285	Q	96.4	Very high	93.7	Very high	10 Å²	10	44.6 Å²	44.6	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-38.5	179.9	-156.1	173.2	37.1	0	0	111.7	V281 L288 Q289 V380 P381 I386	V281-Q285 WeakPolarHBondContact O-CB 3.08Å; V281-Q285 PolarHBondContact O-N 3.43Å; Q285-L288 PolarHBondContact O-N 3.08Å; Q285-Q289 VanDerWaalsContact O-CB 3.28Å; Q285-Q289 WeakPolarHBondContact O-CB 3.38Å; Q285-Q289 PolarHBondContact O-N 3.27Å; Q285-V380 HydrophobicContact CG-CG2 4.13Å; Q285-P381 PolarHBondContact NE2-O 3.45Å; Q285-I386 HydrophobicContact CB-CD1 3.58Å; Q285-I386 HydrophobicContact CG-CD1 3.73Å
286	G	95.6	Very high	93.7	Very high	25 Å²	25	45.8 Å²	45.8	26%	0.258	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-41.1	174.4	0	0	0	0	0	114	P282 I283 I284 Q289 T290	P282-G286 PolarHBondContact O-N 3.2Å; I283-G286 PolarHBondContact O-N 3.4Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 PolarHBondContact O-N 2.9Å; G286-Q289 PolarHBondContact O-N 2.88Å; G286-T290 WeakPolarHBondContact O-CB 3.44Å; G286-T290 PolarHBondContact O-N 3.01Å; G286-T290 PolarHBondContact O-OG1 2.97Å
287	V	97.6	Very high	94.1	Very high	3 Å²	3	41 Å²	41	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-63.8	-46.5	173.3	170.5	0	0	0	0	110.4	L267 C270 I283 I284 Q289 T290 C291 V301 L326	L267-V287 HydrophobicContact CD2-CB 4.22Å; L267-V287 HydrophobicContact CD2-CG1 4.2Å; L267-V287 HydrophobicContact CD2-CG2 3.9Å; C270-V287 HydrophobicContact CB-CG2 4.18Å; I283-V287 WeakPolarHBondContact O-CG2 3.37Å; I283-V287 PolarHBondContact O-N 3.4Å; I284-V287 PolarHBondContact O-N 3.27Å; V287-Q289 PolarHBondContact O-N 3.35Å; V287-T290 PolarHBondContact O-N 3.49Å; V287-C291 PolarHBondContact O-N 3.24Å; V287-C291 PolarHBondContact O-SG 3.33Å; V287-V301 HydrophobicContact CG1-CG1 4.1Å; V287-L326 HydrophobicContact CB-CD1 4.41Å; V287-L326 HydrophobicContact CB-CD2 4.46Å; V287-L326 HydrophobicContact CG1-CD1 4.21Å; V287-L326 HydrophobicContact CG1-CD2 4.11Å
288	L	97.5	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-42.5	177	-67.8	167.3	0	0	0	111.5	I284 Q285 T290 C291 L292 L326 C329 M330 F334 V380 P381 I386	I284-L288 HydrophobicContact CG2-CD1 3.7Å; I284-L288 HydrophobicContact CG2-CG 4.41Å; I284-L288 WeakPolarHBondContact O-CB 3.29Å; I284-L288 VanDerWaalsContact O-CG 3.23Å; I284-L288 WeakPolarHBondContact O-CG 3.38Å; I284-L288 PolarHBondContact O-N 3.37Å; Q285-L288 PolarHBondContact O-N 3.08Å; L288-T290 PolarHBondContact O-N 2.96Å; L288-C291 CarbonylContact O-C 3.57Å; L288-C291 PolarHBondContact O-N 3.16Å; L288-C291 VanDerWaalsContact O-N 3.16Å; L288-L292 PolarHBondContact O-N 3.02Å; L288-L326 HydrophobicContact CG-CD1 4.37Å; L288-C329 HydrophobicContact CD1-CB 3.87Å; L288-M330 HydrophobicContact CD2-CB 4.29Å; L288-M330 HydrophobicContact CD2-CG 3.55Å; L288-F334 HydrophobicContact CD2-CD2 4.47Å; L288-F334 HydrophobicContact CD2-CE2 3.94Å; L288-F334 WeakPolarHBondContact O-CZ 3.22Å; L288-V380 VanDerWaalsContact C-CG1 3.46Å; L288-V380 HydrophobicContact CB-CB 4.12Å; L288-V380 HydrophobicContact CB-CG1 3.75Å; L288-V380 WeakPolarHBondContact O-CG1 3.42Å; L288-P381 HydrophobicContact CD1-CG 4.4Å; L288-I386 HydrophobicContact CD1-CD1 4.35Å
289	Q	95.4	Very high	94.7	Very high	44 Å²	44	32 Å²	32	21%	0.206	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-40.2	-179.4	-178.4	56.8	49.8	0	0	111.3	Q285 G286 V287 C291 L292 D293 V380	Q285-Q289 VanDerWaalsContact O-CB 3.28Å; Q285-Q289 WeakPolarHBondContact O-CB 3.38Å; Q285-Q289 PolarHBondContact O-N 3.27Å; G286-Q289 PolarHBondContact O-N 2.88Å; V287-Q289 PolarHBondContact O-N 3.35Å; Q289-C291 VanDerWaalsContact C-N 3.3Å; Q289-C291 PolarHBondContact O-N 3.43Å; Q289-L292 WeakPolarHBondContact O-CB 3.12Å; Q289-L292 PolarHBondContact O-N 3.13Å; Q289-D293 VanDerWaalsContact NE2-CG 3.32Å; Q289-D293 PolarHBondContact NE2-OD2 2.71Å; Q289-D293 PolarHBondContact O-N 2.91Å; Q289-V380 HydrophobicContact CB-CG1 4.37Å
290	T	94.8	Very high	95.1	Very high	16 Å²	16	25.3 Å²	25.3	10%	0.098	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-35.8	174.3	-51.7	0	0	0	0	111.2	Y257 L267 G286 V287 L288 L294 L297	Y257-T290 HydrophobicContact CD1-CG2 4.3Å; Y257-T290 HydrophobicContact CE1-CG2 3.73Å; L267-T290 HydrophobicContact CD1-CG2 3.98Å; L267-T290 HydrophobicContact CD2-CG2 4.12Å; L267-T290 HydrophobicContact CG-CG2 4.35Å; G286-T290 WeakPolarHBondContact O-CB 3.44Å; G286-T290 PolarHBondContact O-N 3.01Å; G286-T290 PolarHBondContact O-OG1 2.97Å; V287-T290 PolarHBondContact O-N 3.49Å; L288-T290 PolarHBondContact O-N 2.96Å; T290-L294 HydrophobicContact CG2-CD1 4.14Å; T290-L294 WeakPolarHBondContact O-CA 3.27Å; T290-L294 WeakPolarHBondContact O-CB 3.43Å; T290-L294 PolarHBondContact O-N 2.85Å; T290-L297 HydrophobicContact CG2-CD1 4.04Å
291	C	95.1	Very high	95.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-75.3	-25.6	173.2	-64.9	0	0	0	0	114	V287 L288 Q289 R298 F334	V287-C291 PolarHBondContact O-N 3.24Å; V287-C291 PolarHBondContact O-SG 3.33Å; L288-C291 CarbonylContact O-C 3.57Å; L288-C291 PolarHBondContact O-N 3.16Å; L288-C291 VanDerWaalsContact O-N 3.16Å; Q289-C291 VanDerWaalsContact C-N 3.3Å; Q289-C291 PolarHBondContact O-N 3.43Å; C291-R298 HydrophobicContact CB-CG 4.11Å; C291-R298 PolarHBondContact O-NE 2.65Å; C291-R298 PolarHBondContact O-NH2 3.2Å; C291-F334 HydrophobicContact CB-CD2 4.22Å; C291-F334 HydrophobicContact CB-CE2 3.55Å; C291-F334 HydrophobicContact CB-CZ 3.99Å
292	L	93.3	Very high	95.4	Very high	27 Å²	27	25 Å²	25	14%	0.141	13%	0.13	C	C	.	.	H	α-helix	trans	-67.2	-51.5	172.8	178.1	58.8	0	0	0	109.5	L288 Q289 R298 F334 V380	L288-L292 PolarHBondContact O-N 3.02Å; Q289-L292 WeakPolarHBondContact O-CB 3.12Å; Q289-L292 PolarHBondContact O-N 3.13Å; L292-R298 PolarHBondContact O-NH2 2.91Å; L292-R298 VanDerWaalsContact O-NH2 3.16Å; L292-F334 HydrophobicContact CB-CE1 4.18Å; L292-F334 HydrophobicContact CB-CZ 3.92Å; L292-F334 HydrophobicContact CD1-CE1 4.08Å; L292-V380 HydrophobicContact CB-CG1 3.92Å; L292-V380 HydrophobicContact CD2-CG1 3.93Å
293	D	90.5	Very high	95.6	Very high	24 Å²	24	22.9 Å²	22.9	13%	0.128	12%	0.116	C	C	.	.	H	α-helix	trans	-71.3	-57.1	-178	-74.7	-34.8	0	0	0	112.5	H252 K255 Y257 Q289 R295	H252-D293 PolarHBondContact CE1-O 3.1Å; K255-D293 WeakPolarHBondContact CD-OD2 3.45Å; K255-D293 IonicContact NZ-OD1 2.76Å; K255-D293 PolarHBondContact NZ-OD1 3.02Å; K255-D293 IonicContact NZ-OD2 3.29Å; K255-D293 PolarHBondContact NZ-OD2 2.93Å; Y257-D293 HydrophobicContact CE2-CB 4.04Å; Q289-D293 VanDerWaalsContact NE2-CG 3.32Å; Q289-D293 PolarHBondContact NE2-OD2 2.71Å; Q289-D293 PolarHBondContact O-N 2.91Å; D293-R295 PolarHBondContact O-N 3.39Å
294	L	90.3	Very high	95.7	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.105	C	C	.	.	S	Bend	trans	-92.7	74.5	-179	-56.8	179.2	0	0	0	109.8	E248 Y257 E263 T290 P296 L297	E248-L294 WeakPolarHBondContact OE1-CD2 3.33Å; E248-L294 WeakPolarHBondContact OE2-CD2 3.48Å; Y257-L294 HydrophobicContact CD1-CD1 4.1Å; Y257-L294 HydrophobicContact CD2-CD1 4.19Å; Y257-L294 HydrophobicContact CD2-CD2 4.33Å; Y257-L294 HydrophobicContact CD2-CG 4.25Å; Y257-L294 HydrophobicContact CG-CD1 3.87Å; Y257-L294 HydrophobicContact CG-CG 4.44Å; E263-L294 HydrophobicContact CB-CD1 4Å; E263-L294 HydrophobicContact CG-CD1 3.75Å; T290-L294 HydrophobicContact CG2-CD1 4.14Å; T290-L294 WeakPolarHBondContact O-CA 3.27Å; T290-L294 WeakPolarHBondContact O-CB 3.43Å; T290-L294 PolarHBondContact O-N 2.85Å; L294-P296 VanDerWaalsContact C-N 3.28Å; L294-P296 WeakPolarHBondContact O-CD 3.37Å; L294-L297 HydrophobicContact CB-CD1 3.68Å; L294-L297 HydrophobicContact CB-CG 4.01Å; L294-L297 HydrophobicContact CD1-CD1 3.73Å; L294-L297 HydrophobicContact CG-CD1 4.36Å; L294-L297 WeakPolarHBondContact O-CB 3.47Å; L294-L297 PolarHBondContact O-N 2.9Å
295	R	91.9	Very high	95.7	Very high	158 Å²	158	20.8 Å²	20.8	60%	0.596	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46	-37.5	-175.7	-57.3	-166.7	175.3	-157	-2.2	115.7	D293 L297 R298	D293-R295 PolarHBondContact O-N 3.39Å; R295-L297 PolarHBondContact O-N 2.92Å; R295-R298 WeakPolarHBondContact O-CD 3.25Å; R295-R298 VanDerWaalsContact O-CG 3.31Å; R295-R298 WeakPolarHBondContact O-CG 3.4Å; R295-R298 PolarHBondContact O-N 2.93Å
296	P	90.6	Very high	95.8	Very high	57 Å²	57	20.4 Å²	20.4	37%	0.37	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.9	177.8	-24.7	36	0	0	0	114.8	F242 V260 L294 R298	F242-P296 HydrophobicContact CD1-CB 4.23Å; F242-P296 HydrophobicContact CE1-CB 3.63Å; F242-P296 WeakPolarHBondContact CE1-O 3.34Å; F242-P296 WeakPolarHBondContact CZ-O 3.29Å; V260-P296 HydrophobicContact CG1-CB 4.3Å; L294-P296 VanDerWaalsContact C-N 3.28Å; L294-P296 WeakPolarHBondContact O-CD 3.37Å; P296-R298 VanDerWaalsContact C-N 3.28Å; P296-R298 PolarHBondContact O-N 3.33Å
297	L	95.6	Very high	95.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-75.4	-12.9	-179	-63.1	-179.3	0	0	0	114.1	F242 V260 E263 A264 L267 T290 L294 R295 D299 E300 V301	F242-L297 HydrophobicContact CE2-CD2 4.46Å; F242-L297 HydrophobicContact CZ-CD2 4.13Å; V260-L297 HydrophobicContact CG1-CD2 3.51Å; V260-L297 HydrophobicContact CG1-CG 3.99Å; E263-L297 HydrophobicContact CB-CD1 3.71Å; A264-L297 HydrophobicContact CB-CD2 3.69Å; L267-L297 HydrophobicContact CD1-CB 4.27Å; L267-L297 HydrophobicContact CD1-CD1 3.7Å; L267-L297 HydrophobicContact CD1-CG 4.49Å; T290-L297 HydrophobicContact CG2-CD1 4.04Å; L294-L297 HydrophobicContact CB-CD1 3.68Å; L294-L297 HydrophobicContact CB-CG 4.01Å; L294-L297 HydrophobicContact CD1-CD1 3.73Å; L294-L297 HydrophobicContact CG-CD1 4.36Å; L294-L297 WeakPolarHBondContact O-CB 3.47Å; L294-L297 PolarHBondContact O-N 2.9Å; R295-L297 PolarHBondContact O-N 2.92Å; L297-D299 PolarHBondContact O-N 2.8Å; L297-E300 PolarHBondContact O-N 3.38Å; L297-V301 WeakPolarHBondContact O-CG2 3.3Å; L297-V301 PolarHBondContact O-N 2.87Å
298	R	96.3	Very high	95.8	Very high	28 Å²	28	19.5 Å²	19.5	11%	0.106	9%	0.092	C	C	.	.	H	α-helix	trans	-57.1	-54.1	-178.8	-66	168.4	-173.1	-160.5	-1.2	111.1	C291 L292 R295 P296 E300 V301 Y302 F334	C291-R298 HydrophobicContact CB-CG 4.11Å; C291-R298 PolarHBondContact O-NE 2.65Å; C291-R298 PolarHBondContact O-NH2 3.2Å; L292-R298 PolarHBondContact O-NH2 2.91Å; L292-R298 VanDerWaalsContact O-NH2 3.16Å; R295-R298 WeakPolarHBondContact O-CD 3.25Å; R295-R298 VanDerWaalsContact O-CG 3.31Å; R295-R298 WeakPolarHBondContact O-CG 3.4Å; R295-R298 PolarHBondContact O-N 2.93Å; P296-R298 VanDerWaalsContact C-N 3.28Å; P296-R298 PolarHBondContact O-N 3.33Å; R298-E300 VanDerWaalsContact C-N 3.32Å; R298-E300 PolarHBondContact O-N 2.91Å; R298-V301 PolarHBondContact O-N 3.08Å; R298-Y302 WeakPolarHBondContact O-CD2 3.37Å; R298-Y302 PolarHBondContact O-N 3.34Å; R298-F334 HydrophobicContact CG-CD2 4.42Å; R298-F334 HydrophobicContact CG-CG 4.27Å; R298-F334 VanDerWaalsContact CZ-CD1 3.41Å
299	D	97.8	Very high	95.7	Very high	41 Å²	41	19.7 Å²	19.7	22%	0.219	9%	0.093	C	C	.	.	H	α-helix	trans	-64	-36.6	-179.9	-82.7	26.3	0	0	0	112.3	L240 L297 Y302 C303 P336 G337 V340	L240-D299 HydrophobicContact CD1-CB 3.68Å; L297-D299 PolarHBondContact O-N 2.8Å; D299-Y302 PolarHBondContact O-N 3Å; D299-C303 PolarHBondContact O-N 3.04Å; D299-P336 WeakPolarHBondContact OD1-CA 3.22Å; D299-P336 WeakPolarHBondContact OD1-CB 3.32Å; D299-G337 PolarHBondContact OD1-N 2.95Å; D299-G337 WeakPolarHBondContact OD2-CA 3.42Å; D299-G337 PolarHBondContact OD2-N 3.49Å; D299-V340 HydrophobicContact CB-CB 4.41Å; D299-V340 HydrophobicContact CB-CG2 3.94Å; D299-V340 WeakPolarHBondContact OD2-CG2 3.36Å
300	E	98.3	Very high	95.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.2	-50.4	175.3	172.7	66	-158.6	0	0	111.2	P238 L239 L240 F242 A264 L297 R298 Y302 C303 Q304	P238-E300 WeakPolarHBondContact CA-OE1 3.49Å; P238-E300 HydrophobicContact CB-CG 4.49Å; L239-E300 VanDerWaalsContact N-CD 3.3Å; L239-E300 PolarHBondContact N-OE1 3.27Å; L239-E300 PolarHBondContact N-OE2 2.91Å; L240-E300 WeakPolarHBondContact CB-OE2 3.36Å; L240-E300 HydrophobicContact CD1-CB 4.44Å; L240-E300 PolarHBondContact N-OE2 3.22Å; F242-E300 HydrophobicContact CE2-CB 3.9Å; F242-E300 HydrophobicContact CE2-CG 4.06Å; F242-E300 HydrophobicContact CZ-CB 3.79Å; F242-E300 HydrophobicContact CZ-CG 4.42Å; A264-E300 HydrophobicContact CB-CG 3.88Å; L297-E300 PolarHBondContact O-N 3.38Å; R298-E300 VanDerWaalsContact C-N 3.32Å; R298-E300 PolarHBondContact O-N 2.91Å; E300-Y302 VanDerWaalsContact C-N 3.33Å; E300-Y302 PolarHBondContact O-N 2.96Å; E300-C303 CarbonylContact O-C 3.54Å; E300-C303 WeakPolarHBondContact O-CA 3.47Å; E300-C303 WeakPolarHBondContact O-CB 3.42Å; E300-C303 PolarHBondContact O-N 3.37Å; E300-C303 VanDerWaalsContact O-N 3.1Å; E300-Q304 HydrophobicContact CG-CG 4.42Å; E300-Q304 WeakPolarHBondContact O-CG 3.42Å; E300-Q304 PolarHBondContact O-N 3.37Å; E300-Q304 PolarHBondContact OE1-NE2 3.48Å
301	V	98.5	Very high	95.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67.6	-33.2	-179.7	-177.9	0	0	0	0	111.3	L267 L271 V287 L297 R298 Q304 L305 M330	L267-V301 HydrophobicContact CB-CG2 4.28Å; L267-V301 HydrophobicContact CD1-CG2 3.75Å; L271-V301 HydrophobicContact CD2-CG1 4.45Å; V287-V301 HydrophobicContact CG1-CG1 4.1Å; L297-V301 WeakPolarHBondContact O-CG2 3.3Å; L297-V301 PolarHBondContact O-N 2.87Å; R298-V301 PolarHBondContact O-N 3.08Å; V301-Q304 PolarHBondContact O-N 2.93Å; V301-L305 HydrophobicContact CG1-CD1 4Å; V301-L305 HydrophobicContact CG1-CG 4.28Å; V301-L305 WeakPolarHBondContact O-CB 3.22Å; V301-L305 VanDerWaalsContact O-CG 3.29Å; V301-L305 WeakPolarHBondContact O-CG 3.37Å; V301-L305 PolarHBondContact O-N 3.05Å; V301-M330 HydrophobicContact CB-CE 3.89Å; V301-M330 HydrophobicContact CB-SD 4.14Å; V301-M330 HydrophobicContact CG1-CE 3.93Å; V301-M330 HydrophobicContact CG1-SD 3.47Å; V301-M330 WeakPolarHBondContact CG1-SD 3.33Å
302	Y	98.8	Very high	94.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.7	-44.9	168.4	-79.4	-64.3	0	0	0	112.1	R298 D299 E300 L305 V306 L327 M330 F334 P336 L344	R298-Y302 WeakPolarHBondContact O-CD2 3.37Å; R298-Y302 PolarHBondContact O-N 3.34Å; D299-Y302 PolarHBondContact O-N 3Å; E300-Y302 VanDerWaalsContact C-N 3.33Å; E300-Y302 PolarHBondContact O-N 2.96Å; Y302-L305 PolarHBondContact O-N 2.74Å; Y302-V306 WeakPolarHBondContact O-CB 3.35Å; Y302-V306 WeakPolarHBondContact O-CG2 3.4Å; Y302-V306 PolarHBondContact O-N 3.41Å; Y302-L327 HydrophobicContact CD1-CD1 3.58Å; Y302-L327 HydrophobicContact CE1-CD1 3.81Å; Y302-M330 HydrophobicContact CD1-CE 4.19Å; Y302-M330 HydrophobicContact CD2-CE 3.85Å; Y302-M330 HydrophobicContact CE1-CB 4Å; Y302-M330 HydrophobicContact CE1-CE 4.14Å; Y302-M330 HydrophobicContact CE2-CE 3.78Å; Y302-M330 HydrophobicContact CG-CE 4.04Å; Y302-M330 PolarHBondContact OH-O 2.89Å; Y302-F334 PolarHBondContact OH-O 3.05Å; Y302-P336 HydrophobicContact CD1-CG 4.45Å; Y302-P336 HydrophobicContact CD2-CB 3.52Å; Y302-P336 HydrophobicContact CD2-CG 3.74Å; Y302-P336 HydrophobicContact CE1-CG 4.41Å; Y302-P336 HydrophobicContact CE2-CB 3.78Å; Y302-P336 HydrophobicContact CE2-CG 3.69Å; Y302-P336 HydrophobicContact CG-CB 4.18Å; Y302-P336 HydrophobicContact CG-CG 4.14Å; Y302-L344 HydrophobicContact CD1-CD2 3.72Å; Y302-L344 HydrophobicContact CE1-CD2 3.89Å; Y302-L344 HydrophobicContact CG-CD2 4.48Å
303	C	98.7	Very high	94.2	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.02	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-39.6	174.3	-78.8	0	0	0	0	112.6	L239 D299 E300 K307	L239-C303 HydrophobicContact CB-CB 4.43Å; L239-C303 HydrophobicContact CD1-CB 3.96Å; D299-C303 PolarHBondContact O-N 3.04Å; E300-C303 CarbonylContact O-C 3.54Å; E300-C303 WeakPolarHBondContact O-CA 3.47Å; E300-C303 WeakPolarHBondContact O-CB 3.42Å; E300-C303 PolarHBondContact O-N 3.37Å; E300-C303 VanDerWaalsContact O-N 3.1Å; C303-K307 VanDerWaalsContact O-CB 3.27Å; C303-K307 WeakPolarHBondContact O-CB 3.43Å; C303-K307 PolarHBondContact O-N 2.73Å
304	Q	98.4	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.1	-39.6	176.6	-70.6	179.4	8	0	0	112.3	L235 L239 A264 F268 L271 E300 V301 K307 Q308	L235-Q304 HydrophobicContact CD1-CG 4.3Å; L239-Q304 HydrophobicContact CD1-CB 4.33Å; L239-Q304 HydrophobicContact CD1-CG 3.75Å; L239-Q304 HydrophobicContact CG-CG 4.28Å; A264-Q304 PolarHBondContact O-NE2 3.25Å; F268-Q304 HydrophobicContact CD2-CB 3.97Å; F268-Q304 HydrophobicContact CD2-CG 3.82Å; F268-Q304 HydrophobicContact CE2-CB 4.44Å; L271-Q304 HydrophobicContact CD1-CB 3.63Å; E300-Q304 HydrophobicContact CG-CG 4.42Å; E300-Q304 WeakPolarHBondContact O-CG 3.42Å; E300-Q304 PolarHBondContact O-N 3.37Å; E300-Q304 PolarHBondContact OE1-NE2 3.48Å; V301-Q304 PolarHBondContact O-N 2.93Å; Q304-K307 WeakPolarHBondContact O-CB 3.19Å; Q304-K307 PolarHBondContact O-N 3Å; Q304-Q308 WeakPolarHBondContact O-CG 3.35Å; Q304-Q308 PolarHBondContact O-N 3.34Å
305	L	98.4	Very high	92.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.4	-48.1	175.8	-73.3	168.7	0	0	0	111.3	L271 V301 Y302 K307 Q308 T309 Y323 L326 L327 M330	L271-L305 HydrophobicContact CD1-CD2 4.17Å; L271-L305 HydrophobicContact CD1-CG 4.31Å; L271-L305 HydrophobicContact CD2-CD2 4.11Å; V301-L305 HydrophobicContact CG1-CD1 4Å; V301-L305 HydrophobicContact CG1-CG 4.28Å; V301-L305 WeakPolarHBondContact O-CB 3.22Å; V301-L305 VanDerWaalsContact O-CG 3.29Å; V301-L305 WeakPolarHBondContact O-CG 3.37Å; V301-L305 PolarHBondContact O-N 3.05Å; Y302-L305 PolarHBondContact O-N 2.74Å; L305-K307 PolarHBondContact O-N 3.49Å; L305-Q308 PolarHBondContact O-N 2.92Å; L305-T309 PolarHBondContact O-N 3.41Å; L305-T309 PolarHBondContact O-OG1 3.4Å; L305-Y323 HydrophobicContact CD2-CD1 4.02Å; L305-L326 HydrophobicContact CD1-CG 4.15Å; L305-L326 HydrophobicContact CD2-CB 4.47Å; L305-L326 HydrophobicContact CD2-CD2 4.21Å; L305-L326 HydrophobicContact CD2-CG 4.38Å; L305-L327 HydrophobicContact CB-CD1 4.23Å; L305-L327 HydrophobicContact CD1-CB 4.05Å; L305-L327 HydrophobicContact CD1-CD1 4Å; L305-M330 HydrophobicContact CD1-SD 3.45Å; L305-M330 WeakPolarHBondContact CD1-SD 3.47Å
306	V	98.3	Very high	92.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-57.5	-36	174.4	168.5	0	0	0	0	111.7	Y302 T309 S310 Y343 L344 H347	Y302-V306 WeakPolarHBondContact O-CB 3.35Å; Y302-V306 WeakPolarHBondContact O-CG2 3.4Å; Y302-V306 PolarHBondContact O-N 3.41Å; V306-T309 WeakPolarHBondContact CA-OG1 3.31Å; V306-T309 PolarHBondContact O-OG1 3.39Å; V306-S310 VanDerWaalsContact O-CB 3.24Å; V306-S310 WeakPolarHBondContact O-CB 3.26Å; V306-S310 PolarHBondContact O-N 2.82Å; V306-S310 PolarHBondContact O-OG 3.39Å; V306-Y343 HydrophobicContact CB-CE1 4.19Å; V306-Y343 HydrophobicContact CG1-CD1 4.14Å; V306-Y343 HydrophobicContact CG1-CE1 3.38Å; V306-L344 HydrophobicContact CG2-CD1 3.66Å; V306-H347 HydrophobicContact CG1-CB 3.84Å; V306-H347 HydrophobicContact CG2-CB 4.38Å
307	K	97.8	Very high	92	Very high	9 Å²	9	26.2 Å²	26.2	4%	0.039	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-51.7	171.7	173.4	-176.1	173.7	56.4	0	111.4	T226 I227 K229 Y230 L239 F268 C303 Q304 L305 T309 S310	T226-K307 PolarHBondContact O-NZ 2.93Å; T226-K307 VanDerWaalsContact O-NZ 3.14Å; I227-K307 VanDerWaalsContact O-CD 3.31Å; I227-K307 WeakPolarHBondContact O-CD 3.47Å; I227-K307 PolarHBondContact O-NZ 3Å; K229-K307 CarbonylContact C-O 3.53Å; K229-K307 VanDerWaalsContact C-O 3.25Å; K229-K307 WeakPolarHBondContact O-CG 3.47Å; K229-K307 PolarHBondContact O-NZ 3Å; Y230-K307 WeakPolarHBondContact CA-O 3.43Å; Y230-K307 PolarHBondContact N-O 3.33Å; L239-K307 HydrophobicContact CD1-CB 4.42Å; L239-K307 HydrophobicContact CD1-CD 3.99Å; L239-K307 HydrophobicContact CD2-CD 4.19Å; F268-K307 HydrophobicContact CE2-CD 4.46Å; C303-K307 VanDerWaalsContact O-CB 3.27Å; C303-K307 WeakPolarHBondContact O-CB 3.43Å; C303-K307 PolarHBondContact O-N 2.73Å; Q304-K307 WeakPolarHBondContact O-CB 3.19Å; Q304-K307 PolarHBondContact O-N 3Å; L305-K307 PolarHBondContact O-N 3.49Å; K307-T309 VanDerWaalsContact C-N 3.31Å; K307-T309 PolarHBondContact O-N 3.35Å; K307-S310 PolarHBondContact O-N 2.94Å; K307-S310 VanDerWaalsContact O-N 3.15Å
308	Q	95.9	Very high	91.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-23.2	-178	-65.9	-60.7	90.5	0	0	113.9	Y230 T231 F268 Q304 L305 T312 Y323	Y230-Q308 HydrophobicContact CD2-CB 4.26Å; Y230-Q308 VanDerWaalsContact CD2-O 3.25Å; Y230-Q308 WeakPolarHBondContact CD2-O 3.29Å; T231-Q308 PolarHBondContact O-NE2 3.49Å; T231-Q308 PolarHBondContact O-OE1 3.49Å; F268-Q308 HydrophobicContact CE2-CG 3.93Å; F268-Q308 HydrophobicContact CZ-CG 4.3Å; Q304-Q308 WeakPolarHBondContact O-CG 3.35Å; Q304-Q308 PolarHBondContact O-N 3.34Å; L305-Q308 PolarHBondContact O-N 2.92Å; Q308-T312 PolarHBondContact O-OG1 3.32Å; Q308-Y323 HydrophobicContact CB-CD1 3.84Å; Q308-Y323 HydrophobicContact CB-CD2 3.91Å; Q308-Y323 HydrophobicContact CB-CE1 3.77Å; Q308-Y323 HydrophobicContact CB-CE2 3.86Å; Q308-Y323 HydrophobicContact CB-CG 3.9Å; Q308-Y323 HydrophobicContact CG-CD1 4.31Å; Q308-Y323 HydrophobicContact CG-CE1 3.84Å; Q308-Y323 HydrophobicContact CG-CE2 4.49Å; Q308-Y323 PolarHBondContact NE2-OH 2.98Å
309	T	95.5	Very high	91	Very high	4 Å²	4	30 Å²	30	3%	0.025	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.9	172	56.6	0	0	0	0	113.9	L305 V306 K307 W324 H347	L305-T309 PolarHBondContact O-N 3.41Å; L305-T309 PolarHBondContact O-OG1 3.4Å; V306-T309 WeakPolarHBondContact CA-OG1 3.31Å; V306-T309 PolarHBondContact O-OG1 3.39Å; K307-T309 VanDerWaalsContact C-N 3.31Å; K307-T309 PolarHBondContact O-N 3.35Å; T309-W324 HydrophobicContact CG2-CD2 3.96Å; T309-W324 HydrophobicContact CG2-CG 4.2Å; T309-W324 HydrophobicContact CG2-CZ2 3.87Å; T309-H347 PolarHBondContact OG1-CE1 3.29Å; T309-H347 PolarHBondContact OG1-NE2 3.35Å
310	S	94.4	Very high	90.4	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.021	18%	0.183	C	C	.	.	S	Bend	trans	-99.3	119.8	-179.9	-70	0	0	0	0	112.5	L228 Y230 V306 K307 T312 H347	L228-S310 WeakPolarHBondContact O-CB 3.45Å; Y230-S310 PolarHBondContact N-O 2.74Å; V306-S310 VanDerWaalsContact O-CB 3.24Å; V306-S310 WeakPolarHBondContact O-CB 3.26Å; V306-S310 PolarHBondContact O-N 2.82Å; V306-S310 PolarHBondContact O-OG 3.39Å; K307-S310 PolarHBondContact O-N 2.94Å; K307-S310 VanDerWaalsContact O-N 3.15Å; S310-T312 VanDerWaalsContact C-N 3.31Å; S310-T312 PolarHBondContact O-N 2.65Å; S310-H347 PolarHBondContact OG-CE1 2.95Å; S310-H347 VanDerWaalsContact OG-CE1 3.26Å; S310-H347 PolarHBondContact OG-ND1 3.15Å
311	H	89.2	Confident	90.2	Very high	78 Å²	78	30 Å²	30	36%	0.361	19%	0.188	S	C	.	.	S	Bend	trans	56.9	37.8	179.7	-60.2	-105.8	0	0	0	114.1	E219 Y222 K229 R350	E219-H311 IonicContact OE1-CE1 3.8Å; E219-H311 IonicContact OE2-CE1 3.52Å; Y222-H311 AromaticContact CD1-NE2 3.96Å; Y222-H311 AromaticContact CG-NE2 3.67Å; K229-H311 HydrophobicContact CB-CB 4.45Å; K229-H311 HydrophobicContact CD-CB 3.93Å; K229-H311 HydrophobicContact CG-CB 4.1Å; H311-R350 PolarHBondContact CE1-NH2 3.46Å; H311-R350 VanDerWaalsContact CE1-NH2 3.25Å; H311-R350 PolarHBondContact NE2-NH2 2.91Å
312	T	84.9	Confident	90.1	Very high	21 Å²	21	32.2 Å²	32.2	13%	0.129	20%	0.197	C	C	.	.			trans	-61.9	128.7	177.4	-42.5	0	0	0	0	111.4	Y230 Q308 S310 S314 H320	Y230-T312 HydrophobicContact CD2-CG2 4.07Å; Y230-T312 HydrophobicContact CE2-CG2 4.21Å; Y230-T312 HydrophobicContact CG-CG2 4.2Å; Q308-T312 PolarHBondContact O-OG1 3.32Å; S310-T312 VanDerWaalsContact C-N 3.31Å; S310-T312 PolarHBondContact O-N 2.65Å; T312-S314 PolarHBondContact O-N 3.27Å; T312-H320 HydrophobicContact CG2-CB 4.15Å; T312-H320 WeakPolarHBondContact CG2-ND1 3.49Å
313	P	78.1	Confident	90	Very high	105 Å²	105	32.3 Å²	32.3	68%	0.682	20%	0.197	S	C	*	.	S	Bend	trans	-65	-27.5	-170.7	-27.1	35.3	0	0	0	116.7	Y230	Y230-P313 HydrophobicContact CD1-CG 4.02Å; Y230-P313 HydrophobicContact CE1-CG 4.22Å
314	S	76.8	Confident	89.9	Confident	59 Å²	59	32.3 Å²	32.3	41%	0.413	20%	0.197	S	C	.	.	S	Bend	trans	-134	79	177.4	48.7	0	0	0	0	110.1	T312 T317 H320	T312-S314 PolarHBondContact O-N 3.27Å; S314-T317 WeakPolarHBondContact O-CG2 3.41Å; S314-H320 PolarHBondContact O-CE1 2.94Å; S314-H320 PolarHBondContact O-ND1 3.42Å; S314-H320 PolarHBondContact OG-CE1 3.37Å; S314-H320 VanDerWaalsContact OG-CE1 3.26Å
315	P	73.8	Confident	89.9	Confident	66 Å²	66	33 Å²	33	43%	0.429	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	158.4	-179.7	26	-33.7	0	0	0	111.9	T317 M360	P315-T317 VanDerWaalsContact C-N 3.3Å; P315-T317 PolarHBondContact O-N 2.71Å; P315-M360 HydrophobicContact CB-CE 3.6Å; P315-M360 HydrophobicContact CB-SD 3.78Å
316	N	79.2	Confident	89.9	Confident	80 Å²	80	33 Å²	33	43%	0.428	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	10.6	-179.8	-45.5	-66	0	0	0	117
317	T	86.7	Confident	89.9	Confident	53 Å²	53	33 Å²	33	33%	0.325	20%	0.2	S	C	.	.			trans	-70.6	146.8	165.9	67.7	0	0	0	0	110.6	S314 P315 A319 H320 L321	S314-T317 WeakPolarHBondContact O-CG2 3.41Å; P315-T317 VanDerWaalsContact C-N 3.3Å; P315-T317 PolarHBondContact O-N 2.71Å; T317-A319 PolarHBondContact O-N 2.72Å; T317-A319 VanDerWaalsContact O-N 3.11Å; T317-H320 PolarHBondContact O-N 3.36Å; T317-H320 WeakPolarHBondContact OG1-CB 3.28Å; T317-H320 VanDerWaalsContact OG1-CG 3.25Å; T317-H320 PolarHBondContact OG1-N 3.07Å; T317-H320 VanDerWaalsContact OG1-N 3.15Å; T317-H320 PolarHBondContact OG1-ND1 3.22Å; T317-L321 WeakPolarHBondContact O-CG 3.11Å; T317-L321 PolarHBondContact O-N 2.92Å
318	A	85.7	Confident	90	Very high	76 Å²	76	32.5 Å²	32.5	63%	0.628	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26	176.3	0	0	0	0	0	113.3	R322	A318-R322 WeakPolarHBondContact O-CG 3.47Å
319	A	85.3	Confident	90.1	Very high	30 Å²	30	32.5 Å²	32.5	25%	0.248	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-49	172.3	0	0	0	0	0	112.2	E275 T317 R322	E275-A319 HydrophobicContact CB-CB 4.11Å; E275-A319 WeakPolarHBondContact O-CB 3.23Å; T317-A319 PolarHBondContact O-N 2.72Å; T317-A319 VanDerWaalsContact O-N 3.11Å; A319-R322 WeakPolarHBondContact O-CB 3.37Å; A319-R322 VanDerWaalsContact O-CG 3.23Å; A319-R322 WeakPolarHBondContact O-CG 3.45Å; A319-R322 PolarHBondContact O-N 2.9Å
320	H	86.9	Confident	90.2	Very high	19 Å²	19	32.3 Å²	32.3	9%	0.088	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-28.4	180	-63	147.7	0	0	0	113.2	Y230 E275 T312 S314 T317 R322 Y323	Y230-H320 AromaticContact CZ-NE2 3.62Å; Y230-H320 PolarHBondContact OH-NE2 2.91Å; Y230-H320 VanDerWaalsContact OH-NE2 3.14Å; E275-H320 IonicContact OE1-CD2 2.69Å; E275-H320 IonicContact OE1-NE2 3.59Å; T312-H320 HydrophobicContact CG2-CB 4.15Å; T312-H320 WeakPolarHBondContact CG2-ND1 3.49Å; S314-H320 PolarHBondContact O-CE1 2.94Å; S314-H320 PolarHBondContact O-ND1 3.42Å; S314-H320 PolarHBondContact OG-CE1 3.37Å; S314-H320 VanDerWaalsContact OG-CE1 3.26Å; T317-H320 PolarHBondContact O-N 3.36Å; T317-H320 WeakPolarHBondContact OG1-CB 3.28Å; T317-H320 VanDerWaalsContact OG1-CG 3.25Å; T317-H320 PolarHBondContact OG1-N 3.07Å; T317-H320 VanDerWaalsContact OG1-N 3.15Å; T317-H320 PolarHBondContact OG1-ND1 3.22Å; H320-R322 PolarHBondContact O-N 3Å; H320-Y323 WeakPolarHBondContact O-CD2 3.45Å; H320-Y323 PolarHBondContact O-N 2.92Å
321	L	93.7	Very high	90.4	Very high	22 Å²	22	32.2 Å²	32.2	12%	0.115	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-16.5	171.6	-65.7	-176.9	0	0	0	112.7	T317 Y323 W324 Q325 E359 M360 Y363	T317-L321 WeakPolarHBondContact O-CG 3.11Å; T317-L321 PolarHBondContact O-N 2.92Å; L321-Y323 VanDerWaalsContact C-N 3.3Å; L321-Y323 PolarHBondContact O-N 2.54Å; L321-W324 WeakPolarHBondContact O-CB 3.27Å; L321-W324 PolarHBondContact O-N 3.36Å; L321-Q325 WeakPolarHBondContact O-CG 3.23Å; L321-Q325 PolarHBondContact O-N 3.32Å; L321-E359 HydrophobicContact CD1-CB 4.15Å; L321-E359 HydrophobicContact CD1-CG 4.42Å; L321-E359 HydrophobicContact CD2-CB 4.05Å; L321-M360 HydrophobicContact CD2-CG 4.16Å; L321-Y363 HydrophobicContact CB-CE2 4.41Å; L321-Y363 HydrophobicContact CD2-CD2 4.33Å; L321-Y363 HydrophobicContact CD2-CE2 4.05Å
322	R	95.1	Very high	90.8	Very high	48 Å²	48	28.6 Å²	28.6	18%	0.181	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-35.7	173.7	-62	-52.1	-160	-159.5	2.3	113.6	L274 A277 A318 A319 H320 Q325 L326	L274-R322 HydrophobicContact CD2-CB 3.79Å; L274-R322 HydrophobicContact CG-CB 3.82Å; L274-R322 HydrophobicContact CG-CG 4.29Å; A277-R322 PolarHBondContact O-NH2 3.46Å; A318-R322 WeakPolarHBondContact O-CG 3.47Å; A319-R322 WeakPolarHBondContact O-CB 3.37Å; A319-R322 VanDerWaalsContact O-CG 3.23Å; A319-R322 WeakPolarHBondContact O-CG 3.45Å; A319-R322 PolarHBondContact O-N 2.9Å; H320-R322 PolarHBondContact O-N 3Å; R322-Q325 PolarHBondContact O-N 2.76Å; R322-L326 PolarHBondContact O-N 2.89Å
323	Y	97	Very high	91.4	Very high	1 Å²	1	27.6 Å²	27.6	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-42.9	175.6	-58.7	-61.4	0	0	0	111.1	Y230 L271 E275 L305 Q308 H320 L321 L326 L327	Y230-Y323 HydrophobicContact CE2-CE2 4.01Å; L271-Y323 HydrophobicContact CB-CE1 4Å; L271-Y323 WeakPolarHBondContact O-CE1 3.42Å; E275-Y323 HydrophobicContact CG-CE2 3.92Å; E275-Y323 WeakPolarHBondContact CG-OH 3.28Å; E275-Y323 VanDerWaalsContact OE1-CE2 3.25Å; E275-Y323 WeakPolarHBondContact OE1-CE2 3.22Å; E275-Y323 VanDerWaalsContact OE1-CZ 3.3Å; E275-Y323 PolarHBondContact OE1-OH 3.25Å; L305-Y323 HydrophobicContact CD2-CD1 4.02Å; Q308-Y323 HydrophobicContact CB-CD1 3.84Å; Q308-Y323 HydrophobicContact CB-CD2 3.91Å; Q308-Y323 HydrophobicContact CB-CE1 3.77Å; Q308-Y323 HydrophobicContact CB-CE2 3.86Å; Q308-Y323 HydrophobicContact CB-CG 3.9Å; Q308-Y323 HydrophobicContact CG-CD1 4.31Å; Q308-Y323 HydrophobicContact CG-CE1 3.84Å; Q308-Y323 HydrophobicContact CG-CE2 4.49Å; Q308-Y323 PolarHBondContact NE2-OH 2.98Å; H320-Y323 WeakPolarHBondContact O-CD2 3.45Å; H320-Y323 PolarHBondContact O-N 2.92Å; L321-Y323 VanDerWaalsContact C-N 3.3Å; L321-Y323 PolarHBondContact O-N 2.54Å; Y323-L326 PolarHBondContact O-N 3.13Å; Y323-L327 VanDerWaalsContact O-CB 3.24Å; Y323-L327 WeakPolarHBondContact O-CB 3.29Å; Y323-L327 PolarHBondContact O-N 2.98Å
324	W	97.8	Very high	92.2	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-64.4	-38.2	174.7	-71.5	105.1	0	0	0	112.8	T309 L321 L327 T328 H347 L348 I351 M360 Y363 A364 I367	T309-W324 HydrophobicContact CG2-CD2 3.96Å; T309-W324 HydrophobicContact CG2-CG 4.2Å; T309-W324 HydrophobicContact CG2-CZ2 3.87Å; L321-W324 WeakPolarHBondContact O-CB 3.27Å; L321-W324 PolarHBondContact O-N 3.36Å; W324-L327 HydrophobicContact CE3-CD2 4.14Å; W324-L327 HydrophobicContact CZ3-CD2 4.07Å; W324-L327 PolarHBondContact O-N 3.27Å; W324-T328 WeakPolarHBondContact O-CB 3.48Å; W324-T328 PolarHBondContact O-N 3.27Å; W324-T328 PolarHBondContact O-OG1 2.71Å; W324-H347 AromaticContact CH2-NE2 3.62Å; W324-H347 AromaticContact CZ2-NE2 3.93Å; W324-L348 HydrophobicContact CH2-CD2 4.22Å; W324-L348 HydrophobicContact CZ3-CD2 3.74Å; W324-I351 HydrophobicContact CH2-CB 4.19Å; W324-I351 HydrophobicContact CH2-CG1 3.94Å; W324-I351 HydrophobicContact CH2-CG2 3.94Å; W324-I351 HydrophobicContact CZ2-CB 4.38Å; W324-I351 HydrophobicContact CZ2-CD1 4.34Å; W324-I351 HydrophobicContact CZ2-CG1 3.95Å; W324-I351 HydrophobicContact CZ2-CG2 3.86Å; W324-M360 HydrophobicContact CZ2-CB 4.13Å; W324-Y363 HydrophobicContact CB-CD1 4.29Å; W324-Y363 HydrophobicContact CB-CD2 3.53Å; W324-Y363 HydrophobicContact CB-CE2 4.09Å; W324-Y363 HydrophobicContact CB-CG 3.68Å; W324-Y363 HydrophobicContact CG-CD2 4.15Å; W324-Y363 HydrophobicContact CG-CG 4.42Å; W324-A364 HydrophobicContact CH2-CB 4.28Å; W324-A364 HydrophobicContact CZ3-CB 4Å; W324-I367 HydrophobicContact CE3-CD1 3.72Å; W324-I367 HydrophobicContact CZ3-CD1 3.99Å
325	Q	98.1	Very high	93.1	Very high	13 Å²	13	23.5 Å²	23.5	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-45.3	174.4	-75.5	179.9	-27.2	0	0	112.6	L321 R322 T328 C329 Y363 M390	L321-Q325 WeakPolarHBondContact O-CG 3.23Å; L321-Q325 PolarHBondContact O-N 3.32Å; R322-Q325 PolarHBondContact O-N 2.76Å; Q325-T328 WeakPolarHBondContact O-CB 3.36Å; Q325-T328 PolarHBondContact O-N 3.03Å; Q325-C329 PolarHBondContact O-N 3.25Å; Q325-C329 PolarHBondContact O-SG 3.33Å; Q325-Y363 HydrophobicContact CG-CE1 3.94Å; Q325-Y363 VanDerWaalsContact CG-OH 3.31Å; Q325-Y363 WeakPolarHBondContact CG-OH 3.28Å; Q325-Y363 PolarHBondContact NE2-OH 3.3Å; Q325-M390 HydrophobicContact CB-CG 4.07Å; Q325-M390 HydrophobicContact CG-CB 4.23Å; Q325-M390 HydrophobicContact CG-CG 4.29Å; Q325-M390 WeakPolarHBondContact CG-O 3.32Å; Q325-M390 PolarHBondContact NE2-O 3.31Å
326	L	98.5	Very high	94.2	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-68.7	-39.8	175.3	175.2	55.9	0	0	0	112.1	L271 L274 I284 V287 L288 L305 R322 Y323 T328 C329 M330	L271-L326 HydrophobicContact CD2-CD2 3.28Å; L274-L326 HydrophobicContact CD2-CB 4.19Å; L274-L326 HydrophobicContact CD2-CD2 4.16Å; I284-L326 HydrophobicContact CB-CD1 4.27Å; I284-L326 HydrophobicContact CG1-CB 4.3Å; I284-L326 HydrophobicContact CG1-CD1 4.2Å; I284-L326 HydrophobicContact CG2-CD1 3.84Å; V287-L326 HydrophobicContact CB-CD1 4.41Å; V287-L326 HydrophobicContact CB-CD2 4.46Å; V287-L326 HydrophobicContact CG1-CD1 4.21Å; V287-L326 HydrophobicContact CG1-CD2 4.11Å; L288-L326 HydrophobicContact CG-CD1 4.37Å; L305-L326 HydrophobicContact CD1-CG 4.15Å; L305-L326 HydrophobicContact CD2-CB 4.47Å; L305-L326 HydrophobicContact CD2-CD2 4.21Å; L305-L326 HydrophobicContact CD2-CG 4.38Å; R322-L326 PolarHBondContact O-N 2.89Å; Y323-L326 PolarHBondContact O-N 3.13Å; L326-T328 VanDerWaalsContact C-N 3.26Å; L326-T328 PolarHBondContact O-N 3.11Å; L326-C329 PolarHBondContact O-N 3.21Å; L326-M330 HydrophobicContact CD1-CG 4.26Å; L326-M330 PolarHBondContact O-N 2.91Å
327	L	98.6	Very high	95	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.2	-37.1	174.6	-174.4	59.9	0	0	0	111.6	Y302 L305 Y323 W324 S331 L344 I367	Y302-L327 HydrophobicContact CD1-CD1 3.58Å; Y302-L327 HydrophobicContact CE1-CD1 3.81Å; L305-L327 HydrophobicContact CB-CD1 4.23Å; L305-L327 HydrophobicContact CD1-CB 4.05Å; L305-L327 HydrophobicContact CD1-CD1 4Å; Y323-L327 VanDerWaalsContact O-CB 3.24Å; Y323-L327 WeakPolarHBondContact O-CB 3.29Å; Y323-L327 PolarHBondContact O-N 2.98Å; W324-L327 HydrophobicContact CE3-CD2 4.14Å; W324-L327 HydrophobicContact CZ3-CD2 4.07Å; W324-L327 PolarHBondContact O-N 3.27Å; L327-S331 WeakPolarHBondContact O-CB 3.43Å; L327-S331 PolarHBondContact O-N 3.48Å; L327-S331 PolarHBondContact O-OG 3.01Å; L327-L344 HydrophobicContact CD1-CD1 4.23Å; L327-L344 HydrophobicContact CD2-CD1 4.22Å; L327-I367 HydrophobicContact CB-CD1 4.13Å; L327-I367 HydrophobicContact CD2-CD1 3.84Å; L327-I367 HydrophobicContact CG-CD1 3.76Å
328	T	98.6	Very high	95.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-52.8	171.1	-60	0	0	0	0	111	W324 Q325 L326 M330 S331 C332 Y363 F366 L389	W324-T328 WeakPolarHBondContact O-CB 3.48Å; W324-T328 PolarHBondContact O-N 3.27Å; W324-T328 PolarHBondContact O-OG1 2.71Å; Q325-T328 WeakPolarHBondContact O-CB 3.36Å; Q325-T328 PolarHBondContact O-N 3.03Å; L326-T328 VanDerWaalsContact C-N 3.26Å; L326-T328 PolarHBondContact O-N 3.11Å; T328-M330 VanDerWaalsContact C-N 3.34Å; T328-M330 PolarHBondContact O-N 3.32Å; T328-S331 PolarHBondContact O-N 2.88Å; T328-S331 VanDerWaalsContact O-N 3.1Å; T328-S331 PolarHBondContact O-OG 2.8Å; T328-C332 PolarHBondContact O-N 3.47Å; T328-C332 VanDerWaalsContact O-N 3.17Å; T328-Y363 WeakPolarHBondContact OG1-CD1 3.47Å; T328-F366 HydrophobicContact CG2-CD1 3.59Å; T328-F366 HydrophobicContact CG2-CE1 3.51Å; T328-F366 HydrophobicContact CG2-CZ 4.49Å; T328-L389 HydrophobicContact CG2-CB 4.49Å; T328-L389 WeakPolarHBondContact CG2-O 3.47Å
329	C	98.4	Very high	95.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.9	-41	178.7	-58.8	0	0	0	0	112.3	I284 L288 Q325 L326 C332 T333	I284-C329 HydrophobicContact CG2-CB 4.05Å; L288-C329 HydrophobicContact CD1-CB 3.87Å; Q325-C329 PolarHBondContact O-N 3.25Å; Q325-C329 PolarHBondContact O-SG 3.33Å; L326-C329 PolarHBondContact O-N 3.21Å; C329-C332 PolarHBondContact O-N 2.75Å; C329-T333 PolarHBondContact O-N 3Å; C329-T333 PolarHBondContact O-OG1 2.89Å
330	M	97.9	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-44.8	172.8	-78	-173.6	72	0	0	111.9	L288 V301 Y302 L305 L326 T328 C332 T333 F334	L288-M330 HydrophobicContact CD2-CB 4.29Å; L288-M330 HydrophobicContact CD2-CG 3.55Å; V301-M330 HydrophobicContact CB-CE 3.89Å; V301-M330 HydrophobicContact CB-SD 4.14Å; V301-M330 HydrophobicContact CG1-CE 3.93Å; V301-M330 HydrophobicContact CG1-SD 3.47Å; V301-M330 WeakPolarHBondContact CG1-SD 3.33Å; Y302-M330 HydrophobicContact CD1-CE 4.19Å; Y302-M330 HydrophobicContact CD2-CE 3.85Å; Y302-M330 HydrophobicContact CE1-CB 4Å; Y302-M330 HydrophobicContact CE1-CE 4.14Å; Y302-M330 HydrophobicContact CE2-CE 3.78Å; Y302-M330 HydrophobicContact CG-CE 4.04Å; Y302-M330 PolarHBondContact OH-O 2.89Å; L305-M330 HydrophobicContact CD1-SD 3.45Å; L305-M330 WeakPolarHBondContact CD1-SD 3.47Å; L326-M330 HydrophobicContact CD1-CG 4.26Å; L326-M330 PolarHBondContact O-N 2.91Å; T328-M330 VanDerWaalsContact C-N 3.34Å; T328-M330 PolarHBondContact O-N 3.32Å; M330-C332 PolarHBondContact O-N 3.02Å; M330-T333 PolarHBondContact O-N 2.82Å; M330-F334 PolarHBondContact O-N 3.35Å
331	S	98.1	Very high	97.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.9	-24.1	179.9	74.1	0	0	0	0	114	L327 T328 A370 T374	L327-S331 WeakPolarHBondContact O-CB 3.43Å; L327-S331 PolarHBondContact O-N 3.48Å; L327-S331 PolarHBondContact O-OG 3.01Å; T328-S331 PolarHBondContact O-N 2.88Å; T328-S331 VanDerWaalsContact O-N 3.1Å; T328-S331 PolarHBondContact O-OG 2.8Å; S331-A370 WeakPolarHBondContact OG-CB 3.5Å; S331-T374 WeakPolarHBondContact O-CB 3.37Å; S331-T374 PolarHBondContact O-OG1 2.8Å
332	C	97.9	Very high	97.3	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.014	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9	172	-68.7	0	0	0	0	114.4	T328 C329 M330 T374 R377 L389	T328-C332 PolarHBondContact O-N 3.47Å; T328-C332 VanDerWaalsContact O-N 3.17Å; C329-C332 PolarHBondContact O-N 2.75Å; M330-C332 PolarHBondContact O-N 3.02Å; C332-T374 WeakPolarHBondContact CA-OG1 3.27Å; C332-R377 WeakPolarHBondContact O-CD 3.37Å; C332-L389 HydrophobicContact CB-CD1 3.88Å; C332-L389 HydrophobicContact CB-CD2 4.42Å
333	T	97.3	Very high	97.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-36.8	-173.9	-46	0	0	0	0	113	C329 M330 P381	C329-T333 PolarHBondContact O-N 3Å; C329-T333 PolarHBondContact O-OG1 2.89Å; M330-T333 PolarHBondContact O-N 2.82Å; T333-P381 WeakPolarHBondContact OG1-CD 3.39Å; T333-P381 VanDerWaalsContact OG1-CG 3.29Å; T333-P381 WeakPolarHBondContact OG1-CG 3.21Å
334	F	95.6	Very high	97.5	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.022	14%	0.135	C	C	.	.			trans	-135.3	162.6	-172.7	-51.3	-58	0	0	0	111.5	L288 C291 L292 R298 Y302 M330	L288-F334 HydrophobicContact CD2-CD2 4.47Å; L288-F334 HydrophobicContact CD2-CE2 3.94Å; L288-F334 WeakPolarHBondContact O-CZ 3.22Å; C291-F334 HydrophobicContact CB-CD2 4.22Å; C291-F334 HydrophobicContact CB-CE2 3.55Å; C291-F334 HydrophobicContact CB-CZ 3.99Å; L292-F334 HydrophobicContact CB-CE1 4.18Å; L292-F334 HydrophobicContact CB-CZ 3.92Å; L292-F334 HydrophobicContact CD1-CE1 4.08Å; R298-F334 HydrophobicContact CG-CD2 4.42Å; R298-F334 HydrophobicContact CG-CG 4.27Å; R298-F334 VanDerWaalsContact CZ-CD1 3.41Å; Y302-F334 PolarHBondContact OH-O 3.05Å; M330-F334 PolarHBondContact O-N 3.35Å
335	L	95.8	Very high	97.5	Very high	73 Å²	73	27.3 Å²	27.3	38%	0.382	15%	0.151	S	C	.	.			trans	-115	138.6	160.6	-64.5	179.3	0	0	0	108.6	L371 T374	L335-L371 HydrophobicContact CD2-CD2 3.97Å; L335-T374 HydrophobicContact CD2-CG2 4.23Å; L335-T374 HydrophobicContact CG-CG2 4.33Å
336	P	95.9	Very high	97.5	Very high	10 Å²	10	28.7 Å²	28.7	7%	0.065	16%	0.156	C	C	.	.			trans	-71.5	161.3	168.7	15.2	-12.6	0	0	0	112.6	D299 Y302 V340 L341 L344	D299-P336 WeakPolarHBondContact OD1-CA 3.22Å; D299-P336 WeakPolarHBondContact OD1-CB 3.32Å; Y302-P336 HydrophobicContact CD1-CG 4.45Å; Y302-P336 HydrophobicContact CD2-CB 3.52Å; Y302-P336 HydrophobicContact CD2-CG 3.74Å; Y302-P336 HydrophobicContact CE1-CG 4.41Å; Y302-P336 HydrophobicContact CE2-CB 3.78Å; Y302-P336 HydrophobicContact CE2-CG 3.69Å; Y302-P336 HydrophobicContact CG-CB 4.18Å; Y302-P336 HydrophobicContact CG-CG 4.14Å; P336-V340 HydrophobicContact CB-CB 3.98Å; P336-V340 HydrophobicContact CB-CG1 3.85Å; P336-L341 HydrophobicContact CB-CB 4.44Å; P336-L341 HydrophobicContact CG-CB 3.99Å; P336-L341 HydrophobicContact CG-CD1 4.07Å; P336-L344 HydrophobicContact CG-CD2 4.1Å
337	G	95.6	Very high	97.5	Very high	31 Å²	31	28.7 Å²	28.7	32%	0.32	16%	0.156	S	C	.	.			trans	-57.6	154.6	167.1	0	0	0	0	0	112.3	D299 T339 V340 L341	D299-G337 PolarHBondContact OD1-N 2.95Å; D299-G337 WeakPolarHBondContact OD2-CA 3.42Å; D299-G337 PolarHBondContact OD2-N 3.49Å; G337-T339 VanDerWaalsContact C-N 3.28Å; G337-T339 PolarHBondContact O-N 3.04Å; G337-T339 VanDerWaalsContact O-N 3.1Å; G337-V340 PolarHBondContact O-N 3.23Å; G337-L341 WeakPolarHBondContact O-CB 3.44Å; G337-L341 PolarHBondContact O-N 3.29Å
338	S	96.3	Very high	97.5	Very high	93 Å²	93	28.7 Å²	28.7	65%	0.65	16%	0.156	S	C	*	.	H	α-helix	trans	-56.4	-35.2	-166.3	58.3	0	0	0	0	114.8	K342	S338-K342 WeakPolarHBondContact O-CG 3.22Å; S338-K342 PolarHBondContact O-N 3.21Å
339	T	95.9	Very high	97.4	Very high	91 Å²	91	35.6 Å²	35.6	56%	0.558	19%	0.187	S	C	*	.	H	α-helix	trans	-68.7	-47.3	175.5	-53.7	0	0	0	0	112	I205 G337 K342 Y343	I205-T339 HydrophobicContact CG2-CG2 4.1Å; G337-T339 VanDerWaalsContact C-N 3.28Å; G337-T339 PolarHBondContact O-N 3.04Å; G337-T339 VanDerWaalsContact O-N 3.1Å; T339-K342 WeakPolarHBondContact O-CB 3.41Å; T339-K342 PolarHBondContact O-N 2.94Å; T339-Y343 PolarHBondContact O-N 3.04Å; T339-Y343 VanDerWaalsContact O-N 3.13Å
340	V	98	Very high	97.3	Very high	8 Å²	8	36.9 Å²	36.9	5%	0.048	19%	0.191	C	C	.	.	H	α-helix	trans	-70.6	-33.6	179.4	177.6	0	0	0	0	111	L240 D299 P336 G337 K342 Y343 L344	L240-V340 HydrophobicContact CD1-CG2 4.43Å; D299-V340 HydrophobicContact CB-CB 4.41Å; D299-V340 HydrophobicContact CB-CG2 3.94Å; D299-V340 WeakPolarHBondContact OD2-CG2 3.36Å; P336-V340 HydrophobicContact CB-CB 3.98Å; P336-V340 HydrophobicContact CB-CG1 3.85Å; G337-V340 PolarHBondContact O-N 3.23Å; V340-K342 PolarHBondContact O-N 3.11Å; V340-Y343 PolarHBondContact O-N 2.61Å; V340-L344 VanDerWaalsContact O-CB 3.26Å; V340-L344 WeakPolarHBondContact O-CB 3.38Å; V340-L344 PolarHBondContact O-N 2.98Å
341	L	97.9	Very high	97.1	Very high	27 Å²	27	37.5 Å²	37.5	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-37.5	173.2	-178.1	58.1	0	0	0	112.8	P336 G337 R345 L371	P336-L341 HydrophobicContact CB-CB 4.44Å; P336-L341 HydrophobicContact CG-CB 3.99Å; P336-L341 HydrophobicContact CG-CD1 4.07Å; G337-L341 WeakPolarHBondContact O-CB 3.44Å; G337-L341 PolarHBondContact O-N 3.29Å; L341-R345 HydrophobicContact CD1-CG 4.42Å; L341-R345 WeakPolarHBondContact O-CB 3.44Å; L341-R345 WeakPolarHBondContact O-CG 3.37Å; L341-R345 PolarHBondContact O-N 2.65Å; L341-L371 HydrophobicContact CD1-CB 4.45Å; L341-L371 HydrophobicContact CD1-CD1 4.18Å; L341-L371 HydrophobicContact CD1-CD2 4.15Å
342	K	98.1	Very high	97	Very high	115 Å²	115	40 Å²	40	50%	0.5	21%	0.206	S	C	.	.	H	α-helix	trans	-64.5	-49.1	171.3	-74.9	170.8	165	-153.3	0	111.5	E209 S338 T339 V340 L344 R345 F346	E209-K342 WeakPolarHBondContact OE1-CD 3.4Å; E209-K342 IonicContact OE1-NZ 3.51Å; E209-K342 PolarHBondContact OE1-NZ 2.94Å; S338-K342 WeakPolarHBondContact O-CG 3.22Å; S338-K342 PolarHBondContact O-N 3.21Å; T339-K342 WeakPolarHBondContact O-CB 3.41Å; T339-K342 PolarHBondContact O-N 2.94Å; V340-K342 PolarHBondContact O-N 3.11Å; K342-L344 PolarHBondContact O-N 2.8Å; K342-R345 PolarHBondContact O-N 2.71Å; K342-F346 PolarHBondContact O-N 2.79Å
343	Y	98.5	Very high	96.8	Very high	12 Å²	12	44.1 Å²	44.1	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-41.8	-179.7	-179.2	-122.5	0	0	0	112.3	I205 I208 Y222 V306 T339 V340 F346 H347	I205-Y343 HydrophobicContact CD1-CD1 3.6Å; I205-Y343 HydrophobicContact CD1-CE1 3.85Å; I205-Y343 HydrophobicContact CD1-CG 4Å; I205-Y343 HydrophobicContact CG1-CD1 3.79Å; I205-Y343 HydrophobicContact CG1-CD2 3.87Å; I205-Y343 HydrophobicContact CG1-CE1 3.9Å; I205-Y343 HydrophobicContact CG1-CE2 3.99Å; I205-Y343 HydrophobicContact CG1-CG 3.78Å; I205-Y343 HydrophobicContact CG2-CD2 4.29Å; I205-Y343 HydrophobicContact CG2-CG 4.08Å; I208-Y343 HydrophobicContact CD1-CE2 4.12Å; Y222-Y343 WeakPolarHBondContact OH-CE2 3.15Å; Y222-Y343 PolarHBondContact OH-OH 3.3Å; V306-Y343 HydrophobicContact CB-CE1 4.19Å; V306-Y343 HydrophobicContact CG1-CD1 4.14Å; V306-Y343 HydrophobicContact CG1-CE1 3.38Å; T339-Y343 PolarHBondContact O-N 3.04Å; T339-Y343 VanDerWaalsContact O-N 3.13Å; V340-Y343 PolarHBondContact O-N 2.61Å; Y343-F346 WeakPolarHBondContact O-CB 3.4Å; Y343-F346 PolarHBondContact O-N 3.3Å; Y343-H347 PolarHBondContact O-N 2.96Å
344	L	98.6	Very high	96.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-52.8	173	178.4	56.5	0	0	0	110.8	Y302 V306 L327 P336 V340 K342 F346 H347 L348 L371	Y302-L344 HydrophobicContact CD1-CD2 3.72Å; Y302-L344 HydrophobicContact CE1-CD2 3.89Å; Y302-L344 HydrophobicContact CG-CD2 4.48Å; V306-L344 HydrophobicContact CG2-CD1 3.66Å; L327-L344 HydrophobicContact CD1-CD1 4.23Å; L327-L344 HydrophobicContact CD2-CD1 4.22Å; P336-L344 HydrophobicContact CG-CD2 4.1Å; V340-L344 VanDerWaalsContact O-CB 3.26Å; V340-L344 WeakPolarHBondContact O-CB 3.38Å; V340-L344 PolarHBondContact O-N 2.98Å; K342-L344 PolarHBondContact O-N 2.8Å; L344-F346 PolarHBondContact O-N 3.04Å; L344-H347 PolarHBondContact O-N 3.35Å; L344-H347 VanDerWaalsContact O-N 3.07Å; L344-L348 HydrophobicContact CD1-CD1 4.2Å; L344-L348 HydrophobicContact CD1-CD2 4.19Å; L344-L348 HydrophobicContact CD1-CG 4.04Å; L344-L348 HydrophobicContact CG-CD1 4.13Å; L344-L348 HydrophobicContact CG-CG 4.4Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.48Å; L344-L348 PolarHBondContact O-N 3.33Å; L344-L371 HydrophobicContact CD2-CD1 3.63Å; L344-L371 HydrophobicContact CD2-CD2 4.34Å; L344-L371 HydrophobicContact CG-CD1 4.1Å
345	R	98.4	Very high	96.1	Very high	92 Å²	92	50.2 Å²	50.2	35%	0.347	27%	0.267	S	S	.	.	H	α-helix	trans	-59.6	-30.8	176.9	-76.4	174.2	169.5	155.5	-0.6	113.4	L341 K342 K349 L371	L341-R345 HydrophobicContact CD1-CG 4.42Å; L341-R345 WeakPolarHBondContact O-CB 3.44Å; L341-R345 WeakPolarHBondContact O-CG 3.37Å; L341-R345 PolarHBondContact O-N 2.65Å; K342-R345 PolarHBondContact O-N 2.71Å; R345-K349 WeakPolarHBondContact O-CG 3.19Å; R345-K349 PolarHBondContact O-N 3.09Å; R345-L371 PolarHBondContact NH2-O 2.89Å
346	F	98.3	Very high	95.9	Very high	42 Å²	42	50.9 Å²	50.9	18%	0.184	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-50	170.8	175.6	-96.8	0	0	0	111.8	I208 K212 V218 K342 Y343 L344 L348 K349 R350	I208-F346 HydrophobicContact CG2-CD1 3.79Å; I208-F346 HydrophobicContact CG2-CE1 3.63Å; I208-F346 HydrophobicContact CG2-CG 4.47Å; I208-F346 HydrophobicContact CG2-CZ 4.19Å; K212-F346 HydrophobicContact CB-CD2 3.92Å; K212-F346 HydrophobicContact CB-CE2 3.75Å; V218-F346 HydrophobicContact CG1-CE1 4.02Å; V218-F346 HydrophobicContact CG1-CZ 3.89Å; V218-F346 HydrophobicContact CG2-CZ 4.36Å; K342-F346 PolarHBondContact O-N 2.79Å; Y343-F346 WeakPolarHBondContact O-CB 3.4Å; Y343-F346 PolarHBondContact O-N 3.3Å; L344-F346 PolarHBondContact O-N 3.04Å; F346-L348 PolarHBondContact O-N 2.86Å; F346-K349 PolarHBondContact O-N 2.78Å; F346-R350 WeakPolarHBondContact O-CB 3.42Å; F346-R350 PolarHBondContact O-N 2.76Å
347	H	98.1	Very high	95.6	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-58	-46.2	177.9	170.8	81.8	0	0	0	112.1	V306 T309 S310 W324 Y343 L344 K349 R350 I351	V306-H347 HydrophobicContact CG1-CB 3.84Å; V306-H347 HydrophobicContact CG2-CB 4.38Å; T309-H347 PolarHBondContact OG1-CE1 3.29Å; T309-H347 PolarHBondContact OG1-NE2 3.35Å; S310-H347 PolarHBondContact OG-CE1 2.95Å; S310-H347 VanDerWaalsContact OG-CE1 3.26Å; S310-H347 PolarHBondContact OG-ND1 3.15Å; W324-H347 AromaticContact CH2-NE2 3.62Å; W324-H347 AromaticContact CZ2-NE2 3.93Å; Y343-H347 PolarHBondContact O-N 2.96Å; L344-H347 PolarHBondContact O-N 3.35Å; L344-H347 VanDerWaalsContact O-N 3.07Å; H347-K349 PolarHBondContact O-N 3.29Å; H347-R350 WeakPolarHBondContact O-CB 3.33Å; H347-R350 PolarHBondContact O-N 3.23Å; H347-I351 WeakPolarHBondContact O-CG1 3.42Å; H347-I351 PolarHBondContact O-N 2.94Å
348	L	98.3	Very high	95.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-56	-54.8	177.8	-63.2	173.8	0	0	0	110.4	W324 L344 F346 R350 I351 Q352 A364 I367 S368 L371	W324-L348 HydrophobicContact CH2-CD2 4.22Å; W324-L348 HydrophobicContact CZ3-CD2 3.74Å; L344-L348 HydrophobicContact CD1-CD1 4.2Å; L344-L348 HydrophobicContact CD1-CD2 4.19Å; L344-L348 HydrophobicContact CD1-CG 4.04Å; L344-L348 HydrophobicContact CG-CD1 4.13Å; L344-L348 HydrophobicContact CG-CG 4.4Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.48Å; L344-L348 PolarHBondContact O-N 3.33Å; F346-L348 PolarHBondContact O-N 2.86Å; L348-R350 VanDerWaalsContact C-N 3.29Å; L348-R350 PolarHBondContact O-N 3.26Å; L348-I351 PolarHBondContact O-N 3.06Å; L348-I351 VanDerWaalsContact O-N 3.09Å; L348-Q352 WeakPolarHBondContact O-CG 3.19Å; L348-Q352 PolarHBondContact O-N 2.91Å; L348-A364 HydrophobicContact CB-CB 4.27Å; L348-A364 HydrophobicContact CD2-CB 3.88Å; L348-I367 HydrophobicContact CD1-CB 4.33Å; L348-I367 HydrophobicContact CD1-CG2 3.66Å; L348-I367 HydrophobicContact CD2-CB 4.34Å; L348-I367 HydrophobicContact CD2-CD1 4.45Å; L348-I367 HydrophobicContact CD2-CG2 4.04Å; L348-S368 WeakPolarHBondContact CD1-OG 3.34Å; L348-L371 HydrophobicContact CD1-CD1 4.11Å
349	K	97.3	Very high	95.4	Very high	146 Å²	146	57 Å²	57	64%	0.635	29%	0.287	S	S	*	.	H	α-helix	trans	-59	-37	177.8	-70.7	-176.2	178.8	-167.7	0	113.3	R345 F346 H347 Q352 S353	R345-K349 WeakPolarHBondContact O-CG 3.19Å; R345-K349 PolarHBondContact O-N 3.09Å; F346-K349 PolarHBondContact O-N 2.78Å; H347-K349 PolarHBondContact O-N 3.29Å; K349-Q352 PolarHBondContact O-N 3.28Å; K349-S353 WeakPolarHBondContact O-CB 3.49Å; K349-S353 PolarHBondContact O-N 3.31Å; K349-S353 PolarHBondContact O-OG 2.89Å
350	R	95.4	Very high	95.4	Very high	26 Å²	26	53.4 Å²	53.4	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-47.2	174.3	176.4	171.4	162.5	101.8	-2.3	111	E219 H311 F346 H347 L348 S353 Q354	E219-R350 IonicContact OE2-CZ 2.64Å; E219-R350 IonicContact OE2-NH1 3.55Å; E219-R350 PolarHBondContact OE2-NH1 2.84Å; E219-R350 IonicContact OE2-NH2 3.66Å; E219-R350 PolarHBondContact OE2-NH2 3.34Å; H311-R350 PolarHBondContact CE1-NH2 3.46Å; H311-R350 VanDerWaalsContact CE1-NH2 3.25Å; H311-R350 PolarHBondContact NE2-NH2 2.91Å; F346-R350 WeakPolarHBondContact O-CB 3.42Å; F346-R350 PolarHBondContact O-N 2.76Å; H347-R350 WeakPolarHBondContact O-CB 3.33Å; H347-R350 PolarHBondContact O-N 3.23Å; L348-R350 VanDerWaalsContact C-N 3.29Å; L348-R350 PolarHBondContact O-N 3.26Å; R350-S353 PolarHBondContact O-N 3.09Å; R350-S353 PolarHBondContact O-OG 2.97Å; R350-Q354 HydrophobicContact CG-CG 4.4Å; R350-Q354 VanDerWaalsContact CZ-NE2 3.33Å; R350-Q354 WeakPolarHBondContact O-CB 3.28Å; R350-Q354 VanDerWaalsContact O-CG 3.31Å; R350-Q354 WeakPolarHBondContact O-CG 3.26Å; R350-Q354 PolarHBondContact O-N 2.96Å
351	I	94.7	Very high	95.3	Very high	13 Å²	13	54.3 Å²	54.3	7%	0.067	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-45.8	176.8	-67.4	-67.1	0	0	0	111.8	W324 H347 L348 S353 Q354 S355 M360	W324-I351 HydrophobicContact CH2-CB 4.19Å; W324-I351 HydrophobicContact CH2-CG1 3.94Å; W324-I351 HydrophobicContact CH2-CG2 3.94Å; W324-I351 HydrophobicContact CZ2-CB 4.38Å; W324-I351 HydrophobicContact CZ2-CD1 4.34Å; W324-I351 HydrophobicContact CZ2-CG1 3.95Å; W324-I351 HydrophobicContact CZ2-CG2 3.86Å; H347-I351 WeakPolarHBondContact O-CG1 3.42Å; H347-I351 PolarHBondContact O-N 2.94Å; L348-I351 PolarHBondContact O-N 3.06Å; L348-I351 VanDerWaalsContact O-N 3.09Å; I351-S353 VanDerWaalsContact C-N 3.28Å; I351-S353 PolarHBondContact O-N 2.84Å; I351-Q354 PolarHBondContact O-N 3.36Å; I351-Q354 VanDerWaalsContact O-N 3.17Å; I351-S355 PolarHBondContact O-N 2.91Å; I351-S355 PolarHBondContact O-OG 3.18Å; I351-M360 HydrophobicContact CG2-CB 3.84Å
352	Q	95.4	Very high	95.2	Very high	52 Å²	52	56.2 Å²	56.2	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-59.3	-39.7	176.1	-58.3	-168.7	-83.7	0	0	111.7	L348 K349 P356 D361 A364	L348-Q352 WeakPolarHBondContact O-CG 3.19Å; L348-Q352 PolarHBondContact O-N 2.91Å; K349-Q352 PolarHBondContact O-N 3.28Å; Q352-P356 WeakPolarHBondContact O-CG 3.15Å; Q352-D361 WeakPolarHBondContact CG-OD1 3.5Å; Q352-D361 PolarHBondContact NE2-OD1 3.44Å; Q352-A364 HydrophobicContact CG-CB 3.84Å
353	S	93.8	Very high	95.2	Very high	90 Å²	90	51 Å²	51	63%	0.629	26%	0.256	S	S	*	.	H	α-helix	trans	-73.2	-25.9	177.4	72.4	0	0	0	0	114.8	K349 R350 I351	K349-S353 WeakPolarHBondContact O-CB 3.49Å; K349-S353 PolarHBondContact O-N 3.31Å; K349-S353 PolarHBondContact O-OG 2.89Å; R350-S353 PolarHBondContact O-N 3.09Å; R350-S353 PolarHBondContact O-OG 2.97Å; I351-S353 VanDerWaalsContact C-N 3.28Å; I351-S353 PolarHBondContact O-N 2.84Å
354	Q	90.9	Very high	95.2	Very high	103 Å²	103	50.5 Å²	50.5	48%	0.481	25%	0.254	S	S	.	.	H	α-helix	trans	-92	-26.8	-177.1	-74.6	-178.1	-33.4	0	0	113.2	R350 I351	R350-Q354 HydrophobicContact CG-CG 4.4Å; R350-Q354 VanDerWaalsContact CZ-NE2 3.33Å; R350-Q354 WeakPolarHBondContact O-CB 3.28Å; R350-Q354 VanDerWaalsContact O-CG 3.31Å; R350-Q354 WeakPolarHBondContact O-CG 3.26Å; R350-Q354 PolarHBondContact O-N 2.96Å; I351-Q354 PolarHBondContact O-N 3.36Å; I351-Q354 VanDerWaalsContact O-N 3.17Å
355	S	87.6	Confident	95.2	Very high	30 Å²	30	52.9 Å²	52.9	21%	0.21	27%	0.271	C	S	.	.	S	Bend	trans	-144.7	69.8	178.3	51.3	0	0	0	0	112	I351 S358 M360	I351-S355 PolarHBondContact O-N 2.91Å; I351-S355 PolarHBondContact O-OG 3.18Å; S355-S358 WeakPolarHBondContact O-CB 3.39Å; S355-S358 PolarHBondContact O-OG 2.94Å; S355-S358 PolarHBondContact OG-OG 3.46Å; S355-M360 WeakPolarHBondContact OG-CE 3.43Å
356	P	90.8	Very high	95.2	Very high	87 Å²	87	51.2 Å²	51.2	57%	0.565	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	152.3	174.1	-20.9	31.6	0	0	0	112.3	Q352 S358 D361	Q352-P356 WeakPolarHBondContact O-CG 3.15Å; P356-S358 PolarHBondContact O-N 3.34Å; P356-D361 WeakPolarHBondContact CA-OD2 3.24Å
357	E	90.7	Very high	95.2	Very high	184 Å²	184	49.2 Å²	49.2	86%	0.86	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	7.3	177.2	-54.2	-176.6	169.5	0	0	114.7	D361	E357-D361 PolarHBondContact N-OD2 2.71Å
358	S	93.4	Very high	95.2	Very high	17 Å²	17	50.6 Å²	50.6	12%	0.119	27%	0.267	C	S	.	.	S	Bend	trans	-81.2	162.7	175.6	72	0	0	0	0	112.1	S355 P356 M360 D361 N362	S355-S358 WeakPolarHBondContact O-CB 3.39Å; S355-S358 PolarHBondContact O-OG 2.94Å; S355-S358 PolarHBondContact OG-OG 3.46Å; P356-S358 PolarHBondContact O-N 3.34Å; S358-M360 PolarHBondContact O-N 2.76Å; S358-M360 PolarHBondContact OG-N 2.78Å; S358-D361 WeakPolarHBondContact O-CB 3.37Å; S358-D361 PolarHBondContact O-N 2.99Å; S358-D361 VanDerWaalsContact O-N 3.08Å; S358-D361 PolarHBondContact OG-N 3.27Å; S358-N362 PolarHBondContact O-N 2.69Å
359	E	94.3	Very high	95.2	Very high	62 Å²	62	55.2 Å²	55.2	29%	0.29	29%	0.289	S	S	.	.	H	α-helix	trans	-59.5	-29.2	171.8	-90.7	-64.1	102.7	0	0	112.7	L321 N362 Y363 R392	L321-E359 HydrophobicContact CD1-CB 4.15Å; L321-E359 HydrophobicContact CD1-CG 4.42Å; L321-E359 HydrophobicContact CD2-CB 4.05Å; E359-N362 PolarHBondContact O-N 3.39Å; E359-N362 PolarHBondContact OE1-ND2 2.97Å; E359-Y363 WeakPolarHBondContact O-CD2 3.39Å; E359-Y363 PolarHBondContact O-N 2.85Å; E359-R392 VanDerWaalsContact CD-NH2 3.31Å; E359-R392 IonicContact OE1-CZ 3.4Å; E359-R392 IonicContact OE1-NH1 2.66Å; E359-R392 IonicContact OE1-NH2 2.78Å; E359-R392 PolarHBondContact OE1-NH2 2.94Å; E359-R392 IonicContact OE2-CZ 3.34Å; E359-R392 IonicContact OE2-NH1 2.79Å; E359-R392 PolarHBondContact OE2-NH1 2.94Å; E359-R392 IonicContact OE2-NH2 2.62Å; E359-R392 PolarHBondContact OE2-NH2 3.28Å
360	M	94.6	Very high	95.3	Very high	15 Å²	15	48.4 Å²	48.4	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-71.6	-34.5	177	-54.4	179.7	-60.9	0	0	111.9	P315 L321 W324 I351 S355 S358 A364	P315-M360 HydrophobicContact CB-CE 3.6Å; P315-M360 HydrophobicContact CB-SD 3.78Å; L321-M360 HydrophobicContact CD2-CG 4.16Å; W324-M360 HydrophobicContact CZ2-CB 4.13Å; I351-M360 HydrophobicContact CG2-CB 3.84Å; S355-M360 WeakPolarHBondContact OG-CE 3.43Å; S358-M360 PolarHBondContact O-N 2.76Å; S358-M360 PolarHBondContact OG-N 2.78Å; M360-A364 WeakPolarHBondContact O-CB 3.29Å; M360-A364 PolarHBondContact O-N 2.99Å
361	D	95.6	Very high	95.4	Very high	27 Å²	27	47.4 Å²	47.4	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-45.3	169.7	-179.4	17.9	0	0	0	110.8	Q352 P356 E357 S358 Y363 A364 S365	Q352-D361 WeakPolarHBondContact CG-OD1 3.5Å; Q352-D361 PolarHBondContact NE2-OD1 3.44Å; P356-D361 WeakPolarHBondContact CA-OD2 3.24Å; E357-D361 PolarHBondContact N-OD2 2.71Å; S358-D361 WeakPolarHBondContact O-CB 3.37Å; S358-D361 PolarHBondContact O-N 2.99Å; S358-D361 VanDerWaalsContact O-N 3.08Å; S358-D361 PolarHBondContact OG-N 3.27Å; D361-Y363 VanDerWaalsContact C-N 3.35Å; D361-Y363 PolarHBondContact O-N 2.83Å; D361-A364 PolarHBondContact O-N 3.21Å; D361-S365 WeakPolarHBondContact O-CB 3.5Å; D361-S365 PolarHBondContact O-N 3.25Å
362	N	97	Very high	95.4	Very high	67 Å²	67	54 Å²	54	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-42.6	175.3	-65.9	-26.7	0	0	0	112.7	S358 E359 F366 R392	S358-N362 PolarHBondContact O-N 2.69Å; E359-N362 PolarHBondContact O-N 3.39Å; E359-N362 PolarHBondContact OE1-ND2 2.97Å; N362-F366 PolarHBondContact O-N 3.02Å; N362-R392 WeakPolarHBondContact O-CD 3.29Å
363	Y	98.2	Very high	95.4	Very high	6 Å²	6	56.3 Å²	56.3	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-67.4	-44.8	170.7	-74	-67.4	0	0	0	112	L321 W324 Q325 T328 E359 D361 S365 F366 I367 M390 R392	L321-Y363 HydrophobicContact CB-CE2 4.41Å; L321-Y363 HydrophobicContact CD2-CD2 4.33Å; L321-Y363 HydrophobicContact CD2-CE2 4.05Å; W324-Y363 HydrophobicContact CB-CD1 4.29Å; W324-Y363 HydrophobicContact CB-CD2 3.53Å; W324-Y363 HydrophobicContact CB-CE2 4.09Å; W324-Y363 HydrophobicContact CB-CG 3.68Å; W324-Y363 HydrophobicContact CG-CD2 4.15Å; W324-Y363 HydrophobicContact CG-CG 4.42Å; Q325-Y363 HydrophobicContact CG-CE1 3.94Å; Q325-Y363 VanDerWaalsContact CG-OH 3.31Å; Q325-Y363 WeakPolarHBondContact CG-OH 3.28Å; Q325-Y363 PolarHBondContact NE2-OH 3.3Å; T328-Y363 WeakPolarHBondContact OG1-CD1 3.47Å; E359-Y363 WeakPolarHBondContact O-CD2 3.39Å; E359-Y363 PolarHBondContact O-N 2.85Å; D361-Y363 VanDerWaalsContact C-N 3.35Å; D361-Y363 PolarHBondContact O-N 2.83Å; Y363-S365 VanDerWaalsContact C-N 3.32Å; Y363-S365 PolarHBondContact O-N 3.05Å; Y363-F366 PolarHBondContact O-N 3.23Å; Y363-I367 WeakPolarHBondContact O-CB 3.34Å; Y363-I367 WeakPolarHBondContact O-CD1 3.5Å; Y363-I367 WeakPolarHBondContact O-CG1 3.45Å; Y363-I367 PolarHBondContact O-N 2.96Å; Y363-M390 PolarHBondContact OH-O 3.36Å; Y363-R392 HydrophobicContact CD1-CG 3.86Å; Y363-R392 HydrophobicContact CE1-CG 3.87Å; Y363-R392 VanDerWaalsContact CE1-NH1 3.34Å
364	A	98.1	Very high	95.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-35	-176.5	0	0	0	0	0	113.4	W324 L348 Q352 M360 D361 S368	W324-A364 HydrophobicContact CH2-CB 4.28Å; W324-A364 HydrophobicContact CZ3-CB 4Å; L348-A364 HydrophobicContact CB-CB 4.27Å; L348-A364 HydrophobicContact CD2-CB 3.88Å; Q352-A364 HydrophobicContact CG-CB 3.84Å; M360-A364 WeakPolarHBondContact O-CB 3.29Å; M360-A364 PolarHBondContact O-N 2.99Å; D361-A364 PolarHBondContact O-N 3.21Å; A364-S368 WeakPolarHBondContact O-CB 3.21Å; A364-S368 PolarHBondContact O-N 2.82Å; A364-S368 PolarHBondContact O-OG 2.96Å
365	S	98.3	Very high	95.2	Very high	50 Å²	50	55 Å²	55	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-52.1	172.1	-165.6	0	0	0	0	111.3	D361 Y363 I367 S368 E369	D361-S365 WeakPolarHBondContact O-CB 3.5Å; D361-S365 PolarHBondContact O-N 3.25Å; Y363-S365 VanDerWaalsContact C-N 3.32Å; Y363-S365 PolarHBondContact O-N 3.05Å; S365-I367 PolarHBondContact O-N 3.45Å; S365-S368 WeakPolarHBondContact O-CB 3.37Å; S365-S368 PolarHBondContact O-N 3.25Å; S365-S368 VanDerWaalsContact O-N 3.08Å; S365-E369 PolarHBondContact O-N 3.48Å; S365-E369 VanDerWaalsContact O-N 3.07Å
366	F	98.6	Very high	94.7	Very high	58 Å²	58	57.8 Å²	57.8	25%	0.254	30%	0.296	S	S	.	.	H	α-helix	trans	-58.7	-44.7	177.7	-175.4	-78	0	0	0	112.4	T328 N362 Y363 S368 E369 A370 L389 R392	T328-F366 HydrophobicContact CG2-CD1 3.59Å; T328-F366 HydrophobicContact CG2-CE1 3.51Å; T328-F366 HydrophobicContact CG2-CZ 4.49Å; N362-F366 PolarHBondContact O-N 3.02Å; Y363-F366 PolarHBondContact O-N 3.23Å; F366-S368 VanDerWaalsContact C-N 3.3Å; F366-S368 PolarHBondContact O-N 2.54Å; F366-E369 PolarHBondContact O-N 2.62Å; F366-A370 HydrophobicContact CE1-CB 4.47Å; F366-A370 WeakPolarHBondContact O-CB 3.32Å; F366-A370 PolarHBondContact O-N 2.83Å; F366-L389 HydrophobicContact CE1-CD2 4.24Å; F366-L389 HydrophobicContact CZ-CD2 4Å; F366-R392 HydrophobicContact CB-CG 4.35Å; F366-R392 HydrophobicContact CD2-CB 3.79Å; F366-R392 HydrophobicContact CD2-CG 4.14Å; F366-R392 HydrophobicContact CE2-CB 4.02Å; F366-R392 HydrophobicContact CG-CB 4.29Å; F366-R392 HydrophobicContact CG-CG 4.12Å
367	I	98.7	Very high	94.8	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-40	176.5	-69.4	158	0	0	0	110.6	W324 L327 L348 Y363 S365 A370 L371	W324-I367 HydrophobicContact CE3-CD1 3.72Å; W324-I367 HydrophobicContact CZ3-CD1 3.99Å; L327-I367 HydrophobicContact CB-CD1 4.13Å; L327-I367 HydrophobicContact CD2-CD1 3.84Å; L327-I367 HydrophobicContact CG-CD1 3.76Å; L348-I367 HydrophobicContact CD1-CB 4.33Å; L348-I367 HydrophobicContact CD1-CG2 3.66Å; L348-I367 HydrophobicContact CD2-CB 4.34Å; L348-I367 HydrophobicContact CD2-CD1 4.45Å; L348-I367 HydrophobicContact CD2-CG2 4.04Å; Y363-I367 WeakPolarHBondContact O-CB 3.34Å; Y363-I367 WeakPolarHBondContact O-CD1 3.5Å; Y363-I367 WeakPolarHBondContact O-CG1 3.45Å; Y363-I367 PolarHBondContact O-N 2.96Å; S365-I367 PolarHBondContact O-N 3.45Å; I367-A370 PolarHBondContact O-N 2.73Å; I367-L371 HydrophobicContact CG2-CD1 3.86Å; I367-L371 HydrophobicContact CG2-CG 4.34Å; I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 WeakPolarHBondContact O-CG 3.18Å; I367-L371 PolarHBondContact O-N 3.29Å
368	S	98.4	Very high	94.8	Very high	30 Å²	30	51.6 Å²	51.6	21%	0.21	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-44.8	178	-62.8	0	0	0	0	111.6	L348 A364 S365 F366	L348-S368 WeakPolarHBondContact CD1-OG 3.34Å; A364-S368 WeakPolarHBondContact O-CB 3.21Å; A364-S368 PolarHBondContact O-N 2.82Å; A364-S368 PolarHBondContact O-OG 2.96Å; S365-S368 WeakPolarHBondContact O-CB 3.37Å; S365-S368 PolarHBondContact O-N 3.25Å; S365-S368 VanDerWaalsContact O-N 3.08Å; F366-S368 VanDerWaalsContact C-N 3.3Å; F366-S368 PolarHBondContact O-N 2.54Å
369	E	98.1	Very high	94.8	Very high	97 Å²	97	52 Å²	52	45%	0.453	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-41.8	173.8	-74.2	-168.3	-132.7	0	0	113.2	S365 F366 L371 E372 K373	S365-E369 PolarHBondContact O-N 3.48Å; S365-E369 VanDerWaalsContact O-N 3.07Å; F366-E369 PolarHBondContact O-N 2.62Å; E369-L371 VanDerWaalsContact C-N 3.31Å; E369-L371 PolarHBondContact O-N 2.91Å; E369-E372 PolarHBondContact O-N 3.34Å; E369-E372 VanDerWaalsContact O-N 3.11Å; E369-K373 WeakPolarHBondContact O-CG 3.29Å; E369-K373 PolarHBondContact O-N 3.41Å; E369-K373 IonicContact OE2-NZ 3.17Å; E369-K373 PolarHBondContact OE2-NZ 2.88Å
370	A	98.1	Very high	94.9	Very high	2 Å²	2	49.3 Å²	49.3	2%	0.017	25%	0.25	C	C	.	.	H	α-helix	trans	-61.4	-41	179.5	0	0	0	0	0	111.3	S331 F366 I367 E372 K373 T374	S331-A370 WeakPolarHBondContact OG-CB 3.5Å; F366-A370 HydrophobicContact CE1-CB 4.47Å; F366-A370 WeakPolarHBondContact O-CB 3.32Å; F366-A370 PolarHBondContact O-N 2.83Å; I367-A370 PolarHBondContact O-N 2.73Å; A370-E372 PolarHBondContact O-N 2.81Å; A370-E372 VanDerWaalsContact O-N 3.11Å; A370-K373 PolarHBondContact O-N 3.18Å; A370-T374 WeakPolarHBondContact O-CB 3.42Å; A370-T374 PolarHBondContact O-N 3.28Å; A370-T374 PolarHBondContact O-OG1 3.13Å
371	L	97.5	Very high	95	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-66.5	-5.9	175.9	-69	168.9	0	0	0	114.7	L335 L341 L344 R345 L348 I367 E369	L335-L371 HydrophobicContact CD2-CD2 3.97Å; L341-L371 HydrophobicContact CD1-CB 4.45Å; L341-L371 HydrophobicContact CD1-CD1 4.18Å; L341-L371 HydrophobicContact CD1-CD2 4.15Å; L344-L371 HydrophobicContact CD2-CD1 3.63Å; L344-L371 HydrophobicContact CD2-CD2 4.34Å; L344-L371 HydrophobicContact CG-CD1 4.1Å; R345-L371 PolarHBondContact NH2-O 2.89Å; L348-L371 HydrophobicContact CD1-CD1 4.11Å; I367-L371 HydrophobicContact CG2-CD1 3.86Å; I367-L371 HydrophobicContact CG2-CG 4.34Å; I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 WeakPolarHBondContact O-CG 3.18Å; I367-L371 PolarHBondContact O-N 3.29Å; E369-L371 VanDerWaalsContact C-N 3.31Å; E369-L371 PolarHBondContact O-N 2.91Å
372	E	96.4	Very high	94.9	Very high	152 Å²	152	47.8 Å²	47.8	71%	0.71	24%	0.243	S	C	*	.	H	α-helix	trans	-100	-22.8	170.7	-64.4	-175.6	169.1	0	0	112.6	E369 A370	E369-E372 PolarHBondContact O-N 3.34Å; E369-E372 VanDerWaalsContact O-N 3.11Å; A370-E372 PolarHBondContact O-N 2.81Å; A370-E372 VanDerWaalsContact O-N 3.11Å
373	K	95.3	Very high	94.8	Very high	101 Å²	101	48.8 Å²	48.8	44%	0.439	24%	0.241	S	C	.	.	H	α-helix	trans	-100.4	-30.6	-175.6	-60.5	166.8	-165.4	172	0	113.1	E369 A370 H414	E369-K373 WeakPolarHBondContact O-CG 3.29Å; E369-K373 PolarHBondContact O-N 3.41Å; E369-K373 IonicContact OE2-NZ 3.17Å; E369-K373 PolarHBondContact OE2-NZ 2.88Å; A370-K373 PolarHBondContact O-N 3.18Å; K373-H414 VanDerWaalsContact C-CD2 3.49Å; K373-H414 HydrophobicContact CB-CB 4.36Å
374	T	94.9	Very high	94.6	Very high	8 Å²	8	52.9 Å²	52.9	5%	0.049	26%	0.261	C	S	.	.			trans	-65.9	136.2	-174.3	-67.6	0	0	0	0	112.8	S331 C332 L335 A370 H414	S331-T374 WeakPolarHBondContact O-CB 3.37Å; S331-T374 PolarHBondContact O-OG1 2.8Å; C332-T374 WeakPolarHBondContact CA-OG1 3.27Å; L335-T374 HydrophobicContact CD2-CG2 4.23Å; L335-T374 HydrophobicContact CG-CG2 4.33Å; A370-T374 WeakPolarHBondContact O-CB 3.42Å; A370-T374 PolarHBondContact O-N 3.28Å; A370-T374 PolarHBondContact O-OG1 3.13Å; T374-H414 PolarHBondContact N-NE2 3.12Å; T374-H414 PolarHBondContact OG1-NE2 3.26Å
375	K	85.8	Confident	94.6	Very high	156 Å²	156	53.1 Å²	53.1	68%	0.678	26%	0.262	S	S	*	.			trans	-119.4	-179.8	172.8	-62	176.7	-173.6	172.2	0	108.5	R377	K375-R377 PolarHBondContact O-N 2.83Å; K375-R377 VanDerWaalsContact O-N 3.13Å
376	C	77.1	Confident	94.6	Very high	89 Å²	89	50.7 Å²	50.7	60%	0.601	25%	0.245	S	C	*	.			trans	-67.9	113.1	172	-167.2	0	0	0	0	109.5
377	R	91.5	Very high	94.4	Very high	8 Å²	8	51.1 Å²	51.1	3%	0.03	25%	0.248	C	C	.	.			trans	-75.4	157.2	169.3	-71.4	-166.2	59.2	173.3	-9.6	111.9	C332 K375 C379 E385 L455 A457 D458	C332-R377 WeakPolarHBondContact O-CD 3.37Å; K375-R377 PolarHBondContact O-N 2.83Å; K375-R377 VanDerWaalsContact O-N 3.13Å; R377-C379 WeakPolarHBondContact CB-O 3.22Å; R377-C379 PolarHBondContact NE-O 3.1Å; R377-E385 IonicContact CZ-OE1 3.57Å; R377-E385 IonicContact CZ-OE2 3.5Å; R377-E385 IonicContact NH1-OE1 3.8Å; R377-E385 PolarHBondContact NH1-OE1 2.92Å; R377-E385 IonicContact NH1-OE2 3.63Å; R377-E385 PolarHBondContact NH1-OE2 3.47Å; R377-E385 IonicContact NH2-OE2 2.71Å; R377-E385 PolarHBondContact NH2-OE2 2.96Å; R377-L455 HydrophobicContact CG-CD1 3.83Å; R377-A457 VanDerWaalsContact NH2-C 3.33Å; R377-A457 PolarHBondContact NH2-O 2.81Å; R377-D458 IonicContact CZ-OD1 3.57Å; R377-D458 IonicContact NE-OD1 3.57Å; R377-D458 PolarHBondContact NE-OD1 3.03Å; R377-D458 IonicContact NE-OD2 3.62Å; R377-D458 IonicContact NH2-OD1 3.42Å; R377-D458 PolarHBondContact NH2-OD1 3.41Å
378	E	90.3	Very high	94.4	Very high	134 Å²	134	53.7 Å²	53.7	63%	0.626	26%	0.26	S	S	*	.	S	Bend	trans	-86.4	-35.7	173.3	-65.4	-176	167.2	0	0	111.8	D458	E378-D458 PolarHBondContact N-OD2 3.17Å
379	C	94.1	Very high	94.4	Very high	24 Å²	24	52.6 Å²	52.6	16%	0.162	25%	0.252	C	S	.	.	S	Bend	trans	-117.4	162.4	177.8	-71.7	0	0	0	0	111.1	R377 D458 T461	R377-C379 WeakPolarHBondContact CB-O 3.22Å; R377-C379 PolarHBondContact NE-O 3.1Å; C379-D458 WeakPolarHBondContact CB-OD1 3.31Å; C379-D458 PolarHBondContact N-OD1 2.86Å; C379-T461 HydrophobicContact CB-CG2 4.15Å
380	V	95.5	Very high	94.3	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.036	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-71.2	160.2	158.3	-63.2	0	0	0	0	109.6	Q285 L288 Q289 L292 T461	Q285-V380 HydrophobicContact CG-CG2 4.13Å; L288-V380 VanDerWaalsContact C-CG1 3.46Å; L288-V380 HydrophobicContact CB-CB 4.12Å; L288-V380 HydrophobicContact CB-CG1 3.75Å; L288-V380 WeakPolarHBondContact O-CG1 3.42Å; Q289-V380 HydrophobicContact CB-CG1 4.37Å; L292-V380 HydrophobicContact CB-CG1 3.92Å; L292-V380 HydrophobicContact CD2-CG1 3.93Å; V380-T461 VanDerWaalsContact O-CG2 3.27Å; V380-T461 WeakPolarHBondContact O-CG2 3.38Å
381	P	96.7	Very high	94.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-50	143.1	167.9	-34	38.3	0	0	0	115	Q285 L288 T333 E385 I386 L389	Q285-P381 PolarHBondContact NE2-O 3.45Å; L288-P381 HydrophobicContact CD1-CG 4.4Å; T333-P381 WeakPolarHBondContact OG1-CD 3.39Å; T333-P381 VanDerWaalsContact OG1-CG 3.29Å; T333-P381 WeakPolarHBondContact OG1-CG 3.21Å; P381-E385 VanDerWaalsContact CA-OE2 3.27Å; P381-E385 WeakPolarHBondContact CA-OE2 3.5Å; P381-E385 HydrophobicContact CB-CB 4.02Å; P381-E385 HydrophobicContact CB-CG 3.99Å; P381-E385 WeakPolarHBondContact CB-OE2 3.35Å; P381-I386 HydrophobicContact CB-CD1 4.29Å; P381-I386 HydrophobicContact CB-CG1 3.65Å; P381-L389 HydrophobicContact CG-CD1 4.44Å
382	S	94.7	Very high	94.2	Very high	10 Å²	10	55 Å²	55	7%	0.07	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-66.6	167.4	171.8	66.5	0	0	0	0	111.9	E384 E385 I386 T461 E464	S382-E384 VanDerWaalsContact C-N 3.28Å; S382-E384 PolarHBondContact O-N 3.1Å; S382-E385 PolarHBondContact O-N 3.29Å; S382-E385 WeakPolarHBondContact OG-CB 3.12Å; S382-E385 PolarHBondContact OG-N 3.48Å; S382-I386 WeakPolarHBondContact O-CG1 3.43Å; S382-I386 PolarHBondContact O-N 3.48Å; S382-T461 WeakPolarHBondContact CB-OG1 3.49Å; S382-T461 PolarHBondContact N-OG1 3.44Å; S382-E464 VanDerWaalsContact CA-OE2 3.23Å; S382-E464 WeakPolarHBondContact CA-OE2 3.45Å; S382-E464 WeakPolarHBondContact CB-OE2 3.32Å
383	W	93.9	Very high	94.3	Very high	88 Å²	88	53.2 Å²	53.2	33%	0.333	26%	0.255	S	S	.	.	H	α-helix	trans	-55.9	-44.1	174.2	-177.9	-80.7	0	0	0	112.2	V281 P282 Q387 E464	V281-W383 HydrophobicContact CB-CD2 4.17Å; V281-W383 HydrophobicContact CB-CE3 4.08Å; V281-W383 HydrophobicContact CB-CH2 4.04Å; V281-W383 HydrophobicContact CB-CZ2 4.1Å; V281-W383 HydrophobicContact CB-CZ3 4.02Å; V281-W383 HydrophobicContact CG1-CD2 3.54Å; V281-W383 HydrophobicContact CG1-CE3 3.47Å; V281-W383 VanDerWaalsContact CG1-CE3 3.47Å; V281-W383 HydrophobicContact CG1-CG 4.04Å; V281-W383 HydrophobicContact CG1-CH2 4.35Å; V281-W383 HydrophobicContact CG1-CZ2 4.39Å; V281-W383 HydrophobicContact CG1-CZ3 3.9Å; P282-W383 HydrophobicContact CB-CZ3 4.25Å; P282-W383 HydrophobicContact CG-CH2 3.73Å; P282-W383 HydrophobicContact CG-CZ3 3.64Å; W383-Q387 VanDerWaalsContact O-CG 3.29Å; W383-Q387 WeakPolarHBondContact O-CG 3.44Å; W383-Q387 PolarHBondContact O-N 3.43Å; W383-E464 WeakPolarHBondContact CB-OE1 3.31Å; W383-E464 PolarHBondContact N-OE2 2.83Å
384	E	94.6	Very high	94.3	Very high	93 Å²	93	52.5 Å²	52.5	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-44.2	178.6	-175.2	175.1	179.4	0	0	111.8	S382 I386 Q387 M388	S382-E384 VanDerWaalsContact C-N 3.28Å; S382-E384 PolarHBondContact O-N 3.1Å; E384-I386 VanDerWaalsContact C-N 3.3Å; E384-I386 PolarHBondContact O-N 3.09Å; E384-Q387 PolarHBondContact O-N 3.18Å; E384-Q387 VanDerWaalsContact O-N 3.15Å; E384-M388 HydrophobicContact CG-CE 4.26Å; E384-M388 WeakPolarHBondContact O-CG 3.48Å; E384-M388 PolarHBondContact O-N 3.36Å; E384-M388 VanDerWaalsContact O-N 3.1Å
385	E	97.6	Very high	94.3	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-41.9	178.8	-171.7	-179.6	178.5	0	0	111.3	R377 P381 S382 Q387 M388 L389 M395 S413	R377-E385 IonicContact CZ-OE1 3.57Å; R377-E385 IonicContact CZ-OE2 3.5Å; R377-E385 IonicContact NH1-OE1 3.8Å; R377-E385 PolarHBondContact NH1-OE1 2.92Å; R377-E385 IonicContact NH1-OE2 3.63Å; R377-E385 PolarHBondContact NH1-OE2 3.47Å; R377-E385 IonicContact NH2-OE2 2.71Å; R377-E385 PolarHBondContact NH2-OE2 2.96Å; P381-E385 VanDerWaalsContact CA-OE2 3.27Å; P381-E385 WeakPolarHBondContact CA-OE2 3.5Å; P381-E385 HydrophobicContact CB-CB 4.02Å; P381-E385 HydrophobicContact CB-CG 3.99Å; P381-E385 WeakPolarHBondContact CB-OE2 3.35Å; S382-E385 PolarHBondContact O-N 3.29Å; S382-E385 WeakPolarHBondContact OG-CB 3.12Å; S382-E385 PolarHBondContact OG-N 3.48Å; E385-Q387 PolarHBondContact O-N 3.17Å; E385-M388 PolarHBondContact O-N 3.06Å; E385-L389 HydrophobicContact CG-CD1 3.91Å; E385-L389 HydrophobicContact CG-CG 4.2Å; E385-L389 WeakPolarHBondContact O-CB 3.18Å; E385-L389 WeakPolarHBondContact O-CG 3.26Å; E385-L389 PolarHBondContact O-N 3.4Å; E385-M395 HydrophobicContact CB-CE 4.03Å; E385-M395 HydrophobicContact CB-SD 3.65Å; E385-M395 HydrophobicContact CG-CE 3.82Å; E385-M395 HydrophobicContact CG-SD 3.95Å; E385-S413 WeakPolarHBondContact OE1-CA 3.47Å; E385-S413 WeakPolarHBondContact OE1-CB 3.42Å; E385-S413 PolarHBondContact OE1-OG 2.94Å
386	I	98.1	Very high	94.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-42.8	176.9	-62.9	166.4	0	0	0	111	V281 I284 Q285 L288 P381 S382 E384 M388 L389 M390	V281-I386 HydrophobicContact CB-CG2 4.24Å; V281-I386 HydrophobicContact CG1-CB 3.87Å; V281-I386 HydrophobicContact CG1-CD1 3.98Å; V281-I386 HydrophobicContact CG1-CG2 3.84Å; V281-I386 HydrophobicContact CG2-CB 4.44Å; V281-I386 HydrophobicContact CG2-CG2 3.82Å; I284-I386 HydrophobicContact CB-CG2 4.14Å; I284-I386 HydrophobicContact CD1-CG2 4.18Å; I284-I386 HydrophobicContact CG2-CD1 4.15Å; I284-I386 HydrophobicContact CG2-CG1 4.34Å; I284-I386 HydrophobicContact CG2-CG2 3.62Å; Q285-I386 HydrophobicContact CB-CD1 3.58Å; Q285-I386 HydrophobicContact CG-CD1 3.73Å; L288-I386 HydrophobicContact CD1-CD1 4.35Å; P381-I386 HydrophobicContact CB-CD1 4.29Å; P381-I386 HydrophobicContact CB-CG1 3.65Å; S382-I386 WeakPolarHBondContact O-CG1 3.43Å; S382-I386 PolarHBondContact O-N 3.48Å; E384-I386 VanDerWaalsContact C-N 3.3Å; E384-I386 PolarHBondContact O-N 3.09Å; I386-M388 VanDerWaalsContact C-N 3.26Å; I386-M388 PolarHBondContact O-N 3.33Å; I386-L389 PolarHBondContact O-N 3.33Å; I386-M390 HydrophobicContact CG2-CG 4.17Å; I386-M390 HydrophobicContact CG2-SD 4.02Å; I386-M390 VanDerWaalsContact O-CB 3.3Å; I386-M390 WeakPolarHBondContact O-CB 3.45Å; I386-M390 WeakPolarHBondContact O-CG 3.35Å; I386-M390 PolarHBondContact O-N 2.91Å
387	Q	96.3	Very high	95.7	Very high	67 Å²	67	43.7 Å²	43.7	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-59.6	-37.7	177.5	-65.6	-78.7	-1.2	0	0	111.8	V281 W383 E384 E385 N391	V281-Q387 HydrophobicContact CG2-CG 4.06Å; V281-Q387 VanDerWaalsContact CG2-NE2 3.29Å; W383-Q387 VanDerWaalsContact O-CG 3.29Å; W383-Q387 WeakPolarHBondContact O-CG 3.44Å; W383-Q387 PolarHBondContact O-N 3.43Å; E384-Q387 PolarHBondContact O-N 3.18Å; E384-Q387 VanDerWaalsContact O-N 3.15Å; E385-Q387 PolarHBondContact O-N 3.17Å; Q387-N391 PolarHBondContact O-ND2 2.87Å
388	M	97.8	Very high	95.9	Very high	53 Å²	53	45.8 Å²	45.8	26%	0.261	22%	0.22	S	C	.	.	H	α-helix	trans	-77.4	-43.3	178.2	-57.1	-54	166.3	0	0	112.1	E384 E385 I386 M390 N391 R392 Q393 M395	E384-M388 HydrophobicContact CG-CE 4.26Å; E384-M388 WeakPolarHBondContact O-CG 3.48Å; E384-M388 PolarHBondContact O-N 3.36Å; E384-M388 VanDerWaalsContact O-N 3.1Å; E385-M388 PolarHBondContact O-N 3.06Å; I386-M388 VanDerWaalsContact C-N 3.26Å; I386-M388 PolarHBondContact O-N 3.33Å; M388-M390 VanDerWaalsContact C-N 3.31Å; M388-M390 PolarHBondContact O-N 2.85Å; M388-N391 CarbonylContact O-C 3.48Å; M388-N391 WeakPolarHBondContact O-CA 3.23Å; M388-N391 PolarHBondContact O-N 3.35Å; M388-R392 PolarHBondContact O-N 3.33Å; M388-Q393 HydrophobicContact CB-CB 4.26Å; M388-Q393 WeakPolarHBondContact CB-O 3.47Å; M388-Q393 PolarHBondContact O-N 2.91Å; M388-M395 HydrophobicContact CB-CB 4.33Å; M388-M395 HydrophobicContact CG-CB 3.86Å
389	L	98.1	Very high	96.3	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-62.3	-35.8	175.7	-73.1	178.6	0	0	0	112.8	T328 C332 F366 P381 E385 I386 N391 R392	T328-L389 HydrophobicContact CG2-CB 4.49Å; T328-L389 WeakPolarHBondContact CG2-O 3.47Å; C332-L389 HydrophobicContact CB-CD1 3.88Å; C332-L389 HydrophobicContact CB-CD2 4.42Å; F366-L389 HydrophobicContact CE1-CD2 4.24Å; F366-L389 HydrophobicContact CZ-CD2 4Å; P381-L389 HydrophobicContact CG-CD1 4.44Å; E385-L389 HydrophobicContact CG-CD1 3.91Å; E385-L389 HydrophobicContact CG-CG 4.2Å; E385-L389 WeakPolarHBondContact O-CB 3.18Å; E385-L389 WeakPolarHBondContact O-CG 3.26Å; E385-L389 PolarHBondContact O-N 3.4Å; I386-L389 PolarHBondContact O-N 3.33Å; L389-N391 PolarHBondContact O-N 2.92Å; L389-N391 VanDerWaalsContact O-N 3.1Å; L389-R392 PolarHBondContact O-N 3.03Å
390	M	96.9	Very high	96.4	Very high	9 Å²	9	41 Å²	41	4%	0.044	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.9	170.7	-80.1	175.8	53.7	0	0	113.4	P280 V281 I284 Q325 Y363 I386 M388	P280-M390 HydrophobicContact CG-CE 3.43Å; P280-M390 VanDerWaalsContact CG-CE 3.43Å; P280-M390 HydrophobicContact CG-SD 3.93Å; V281-M390 HydrophobicContact CG2-SD 3.6Å; I284-M390 HydrophobicContact CD1-CG 4.12Å; I284-M390 HydrophobicContact CD1-SD 3.86Å; Q325-M390 HydrophobicContact CB-CG 4.07Å; Q325-M390 HydrophobicContact CG-CB 4.23Å; Q325-M390 HydrophobicContact CG-CG 4.29Å; Q325-M390 WeakPolarHBondContact CG-O 3.32Å; Q325-M390 PolarHBondContact NE2-O 3.31Å; Y363-M390 PolarHBondContact OH-O 3.36Å; I386-M390 HydrophobicContact CG2-CG 4.17Å; I386-M390 HydrophobicContact CG2-SD 4.02Å; I386-M390 VanDerWaalsContact O-CB 3.3Å; I386-M390 WeakPolarHBondContact O-CB 3.45Å; I386-M390 WeakPolarHBondContact O-CG 3.35Å; I386-M390 PolarHBondContact O-N 2.91Å; M388-M390 VanDerWaalsContact C-N 3.31Å; M388-M390 PolarHBondContact O-N 2.85Å
391	N	96.2	Very high	96.4	Very high	84 Å²	84	43 Å²	43	45%	0.449	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	7.7	178	-62.6	-78.1	0	0	0	112.5	Q387 M388 L389 Q393	Q387-N391 PolarHBondContact O-ND2 2.87Å; M388-N391 CarbonylContact O-C 3.48Å; M388-N391 WeakPolarHBondContact O-CA 3.23Å; M388-N391 PolarHBondContact O-N 3.35Å; L389-N391 PolarHBondContact O-N 2.92Å; L389-N391 VanDerWaalsContact O-N 3.1Å; N391-Q393 VanDerWaalsContact C-N 3.3Å; N391-Q393 HydrophobicContact CB-CG 4.22Å; N391-Q393 PolarHBondContact O-N 2.96Å
392	R	97.3	Very high	96.2	Very high	61 Å²	61	43.5 Å²	43.5	23%	0.23	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	35.8	-175.6	-53.1	175.9	-61.2	-98.9	-0	113.5	E359 N362 Y363 F366 M388 L389	E359-R392 VanDerWaalsContact CD-NH2 3.31Å; E359-R392 IonicContact OE1-CZ 3.4Å; E359-R392 IonicContact OE1-NH1 2.66Å; E359-R392 IonicContact OE1-NH2 2.78Å; E359-R392 PolarHBondContact OE1-NH2 2.94Å; E359-R392 IonicContact OE2-CZ 3.34Å; E359-R392 IonicContact OE2-NH1 2.79Å; E359-R392 PolarHBondContact OE2-NH1 2.94Å; E359-R392 IonicContact OE2-NH2 2.62Å; E359-R392 PolarHBondContact OE2-NH2 3.28Å; N362-R392 WeakPolarHBondContact O-CD 3.29Å; Y363-R392 HydrophobicContact CD1-CG 3.86Å; Y363-R392 HydrophobicContact CE1-CG 3.87Å; Y363-R392 VanDerWaalsContact CE1-NH1 3.34Å; F366-R392 HydrophobicContact CB-CG 4.35Å; F366-R392 HydrophobicContact CD2-CB 3.79Å; F366-R392 HydrophobicContact CD2-CG 4.14Å; F366-R392 HydrophobicContact CE2-CB 4.02Å; F366-R392 HydrophobicContact CG-CB 4.29Å; F366-R392 HydrophobicContact CG-CG 4.12Å; M388-R392 PolarHBondContact O-N 3.33Å; L389-R392 PolarHBondContact O-N 3.03Å
393	Q	97.3	Very high	95.9	Very high	116 Å²	116	44.6 Å²	44.6	54%	0.542	22%	0.219	S	C	.	.			trans	-107.6	156.7	-177	-70.8	174.9	-10.9	0	0	112.6	M388 N391	M388-Q393 HydrophobicContact CB-CB 4.26Å; M388-Q393 WeakPolarHBondContact CB-O 3.47Å; M388-Q393 PolarHBondContact O-N 2.91Å; N391-Q393 VanDerWaalsContact C-N 3.3Å; N391-Q393 HydrophobicContact CB-CG 4.22Å; N391-Q393 PolarHBondContact O-N 2.96Å
394	E	96.2	Very high	95.5	Very high	86 Å²	86	47 Å²	47	40%	0.402	25%	0.246	S	C	.	.			trans	-78.3	146.6	167	-71.7	-166.2	124.5	0	0	110.8	Y410 I411 S412	E394-Y410 HydrophobicContact CB-CD1 4.43Å; E394-Y410 WeakPolarHBondContact OE2-CB 3.25Å; E394-I411 CarbonylContact C-O 3.59Å; E394-I411 WeakPolarHBondContact CA-O 3.47Å; E394-I411 WeakPolarHBondContact CB-O 3.35Å; E394-S412 PolarHBondContact OE1-N 3.23Å
395	M	95.3	Very high	95.3	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	161.5	176.5	64.6	176.1	161	0	0	112.4	E385 M388 Y410 I411 A457	E385-M395 HydrophobicContact CB-CE 4.03Å; E385-M395 HydrophobicContact CB-SD 3.65Å; E385-M395 HydrophobicContact CG-CE 3.82Å; E385-M395 HydrophobicContact CG-SD 3.95Å; M388-M395 HydrophobicContact CB-CB 4.33Å; M388-M395 HydrophobicContact CG-CB 3.86Å; M395-Y410 CarbonylContact O-C 3.59Å; M395-Y410 WeakPolarHBondContact O-CA 3.45Å; M395-I411 HydrophobicContact CE-CD1 3.88Å; M395-I411 HydrophobicContact CE-CG1 4.21Å; M395-I411 HydrophobicContact CG-CD1 4.26Å; M395-I411 HydrophobicContact CG-CG1 3.73Å; M395-I411 PolarHBondContact N-O 3.32Å; M395-I411 PolarHBondContact O-N 3.44Å; M395-A457 HydrophobicContact CE-CB 3.53Å
396	L	95.6	Very high	95.2	Very high	60 Å²	60	46 Å²	46	31%	0.314	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	99.2	-169.9	-168.8	66.7	0	0	0	112.2	Q408 Y410	L396-Q408 HydrophobicContact CD1-CB 4.02Å; L396-Q408 HydrophobicContact CG-CB 4.39Å; L396-Q408 HydrophobicContact CG-CG 4.45Å; L396-Y410 HydrophobicContact CD1-CD1 4.08Å; L396-Y410 HydrophobicContact CD1-CE1 3.89Å; L396-Y410 HydrophobicContact CD1-CG 4.47Å
397	C	95.6	Very high	95.1	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.1	175.1	-172.6	0	0	0	0	111.2	Q408 L409 I411 L460	C397-Q408 CarbonylContact O-C 3.51Å; C397-Q408 WeakPolarHBondContact O-CA 3.34Å; C397-L409 PolarHBondContact N-O 2.99Å; C397-L409 PolarHBondContact O-N 3.47Å; C397-I411 HydrophobicContact CB-CD1 3.73Å; C397-I411 HydrophobicContact CB-CG1 3.94Å; C397-I411 HydrophobicContact CB-CG2 3.94Å; C397-L460 HydrophobicContact CB-CD1 4.47Å
398	T	96.1	Very high	95.1	Very high	52 Å²	52	48.4 Å²	48.4	32%	0.319	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118	167.8	-60.2	0	0	0	0	109.5
399	V	97.8	Very high	95	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.4	177.3	-173.4	0	0	0	0	108.4	S406 C407 L409 V420 M424 L439 L479 F481	V399-S406 CarbonylContact O-C 3.58Å; V399-S406 WeakPolarHBondContact O-CA 3.41Å; V399-C407 PolarHBondContact N-O 3.03Å; V399-C407 PolarHBondContact O-N 2.93Å; V399-L409 HydrophobicContact CG2-CD1 4.32Å; V399-V420 HydrophobicContact CG2-CG1 3.8Å; V399-M424 HydrophobicContact CB-CE 4.17Å; V399-M424 HydrophobicContact CB-SD 3.91Å; V399-M424 HydrophobicContact CG1-CE 3.84Å; V399-M424 HydrophobicContact CG1-CG 4.18Å; V399-M424 HydrophobicContact CG1-SD 3.97Å; V399-M424 HydrophobicContact CG2-SD 4.38Å; V399-L439 HydrophobicContact CG1-CD2 3.68Å; V399-L479 HydrophobicContact CG2-CD2 4.26Å; V399-F481 HydrophobicContact CG1-CB 3.73Å
400	H	96.6	Very high	95	Very high	57 Å²	57	53.4 Å²	53.4	26%	0.264	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	165.2	171.3	-68.4	-81.6	0	0	0	110.7	L479 C480 F481	H400-L479 PolarHBondContact N-O 2.59Å; H400-C480 CarbonylContact O-C 3.54Å; H400-C480 WeakPolarHBondContact O-CA 3.33Å; H400-F481 PolarHBondContact O-N 3.44Å
401	Y	95.5	Very high	95	Very high	48 Å²	48	53 Å²	53	19%	0.188	28%	0.28	C	S	.	.			trans	-151	163.3	170.7	50.8	-101.8	0	0	0	109.2	G405 S406 C407 M424 L428 F481 I497 F501	Y401-G405 PolarHBondContact N-O 3.31Å; Y401-S406 VanDerWaalsContact CE1-C 3.49Å; Y401-C407 HydrophobicContact CE1-CB 4.13Å; Y401-M424 HydrophobicContact CD1-CE 3.88Å; Y401-L428 HydrophobicContact CD1-CD1 4.33Å; Y401-L428 HydrophobicContact CE1-CD2 4.39Å; Y401-F481 WeakPolarHBondContact CB-O 3.28Å; Y401-I497 HydrophobicContact CE2-CD1 4.03Å; Y401-F501 AromaticContact CD2-CE1 3.45Å; Y401-F501 HydrophobicContact CD2-CE1 3.45Å; Y401-F501 VanDerWaalsContact CD2-CE1 3.45Å; Y401-F501 AromaticContact CD2-CZ 3.81Å; Y401-F501 HydrophobicContact CD2-CZ 3.81Å; Y401-F501 HydrophobicContact CE2-CE1 4.23Å; Y401-F501 AromaticContact CG-CE1 3.93Å; Y401-F501 HydrophobicContact CG-CE1 3.93Å; Y401-F501 AromaticContact CG-CZ 3.82Å; Y401-F501 HydrophobicContact CG-CZ 3.82Å
402	P	93.8	Very high	95.1	Very high	12 Å²	12	50.6 Å²	50.6	8%	0.078	27%	0.27	C	S	.	.	S	Bend	trans	-50.9	140.5	-172.2	-28.1	32.6	0	0	0	114	F481 K482 F501 E504 Q505	P402-F481 WeakPolarHBondContact CD-O 3.24Å; P402-K482 HydrophobicContact CG-CG 4.37Å; P402-F501 HydrophobicContact CB-CD1 4.15Å; P402-F501 HydrophobicContact CB-CG 4.44Å; P402-F501 HydrophobicContact CG-CB 4.21Å; P402-F501 HydrophobicContact CG-CD1 4.12Å; P402-F501 HydrophobicContact CG-CG 4.04Å; P402-E504 HydrophobicContact CB-CB 3.53Å; P402-E504 HydrophobicContact CB-CG 4.26Å; P402-Q505 HydrophobicContact CB-CG 4.31Å; P402-Q505 HydrophobicContact CG-CG 3.83Å
403	G	87.6	Confident	95.1	Very high	33 Å²	33	48 Å²	48	34%	0.34	26%	0.261	S	S	.	.	S	Bend	trans	85.6	-162.1	-166.2	0	0	0	0	0	112.8	G405	G403-G405 PolarHBondContact O-N 3.49Å
404	P	84.5	Confident	95	Very high	139 Å²	139	44.1 Å²	44.1	90%	0.903	24%	0.243	S	C	*	.	S	Bend	trans	-80.7	7.6	-176.8	33.5	-36.8	0	0	0	114.1
405	G	91.1	Very high	95.1	Very high	15 Å²	15	40.1 Å²	40.1	16%	0.155	22%	0.224	C	C	.	.			trans	-83.5	156.9	-167.9	0	0	0	0	0	115.1	Y401 G403	Y401-G405 PolarHBondContact N-O 3.31Å; G403-G405 PolarHBondContact O-N 3.49Å
406	S	95.8	Very high	95.2	Very high	61 Å²	61	41.1 Å²	41.1	43%	0.427	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	159.2	168.4	63.2	0	0	0	0	111.7	V399 Y401	V399-S406 CarbonylContact O-C 3.58Å; V399-S406 WeakPolarHBondContact O-CA 3.41Å; Y401-S406 VanDerWaalsContact CE1-C 3.49Å
407	C	95.3	Very high	95.3	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128	-179.6	167.7	0	0	0	0	109.5	V399 Y401 M424 K427	V399-C407 PolarHBondContact N-O 3.03Å; V399-C407 PolarHBondContact O-N 2.93Å; Y401-C407 HydrophobicContact CE1-CB 4.13Å; C407-M424 HydrophobicContact CB-CE 3.83Å; C407-M424 HydrophobicContact CB-SD 3.68Å; C407-K427 VanDerWaalsContact SG-CD 3.5Å; C407-K427 WeakPolarHBondContact SG-CE 3.27Å; C407-K427 PolarHBondContact SG-NZ 2.62Å
408	Q	96.2	Very high	95.3	Very high	110 Å²	110	42.7 Å²	42.7	51%	0.514	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	139	170.4	-72.1	177.3	-16.8	0	0	111.4	L396 C397 K427	L396-Q408 HydrophobicContact CD1-CB 4.02Å; L396-Q408 HydrophobicContact CG-CB 4.39Å; L396-Q408 HydrophobicContact CG-CG 4.45Å; C397-Q408 CarbonylContact O-C 3.51Å; C397-Q408 WeakPolarHBondContact O-CA 3.34Å; Q408-K427 PolarHBondContact O-NZ 2.79Å
409	L	97	Very high	95.4	Very high	19 Å²	19	42.5 Å²	42.5	10%	0.099	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.6	178	-66.8	173.9	0	0	0	109.3	C397 V399 V420 R423 M424 K427	C397-L409 PolarHBondContact N-O 2.99Å; C397-L409 PolarHBondContact O-N 3.47Å; V399-L409 HydrophobicContact CG2-CD1 4.32Å; L409-V420 HydrophobicContact CD1-CG1 3.95Å; L409-R423 HydrophobicContact CD1-CB 4.06Å; L409-R423 HydrophobicContact CD2-CB 4.3Å; L409-M424 HydrophobicContact CD1-CG 3.96Å; L409-M424 HydrophobicContact CD1-SD 3.8Å; L409-K427 HydrophobicContact CD2-CD 4.07Å
410	Y	97.3	Very high	95.4	Very high	146 Å²	146	42.5 Å²	42.5	57%	0.573	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	139.7	166.8	-66.5	-77.4	0	0	0	110	E394 M395 L396 R423	E394-Y410 HydrophobicContact CB-CD1 4.43Å; E394-Y410 WeakPolarHBondContact OE2-CB 3.25Å; M395-Y410 CarbonylContact O-C 3.59Å; M395-Y410 WeakPolarHBondContact O-CA 3.45Å; L396-Y410 HydrophobicContact CD1-CD1 4.08Å; L396-Y410 HydrophobicContact CD1-CE1 3.89Å; L396-Y410 HydrophobicContact CD1-CG 4.47Å; Y410-R423 PolarHBondContact O-NH1 3.15Å
411	I	97.6	Very high	95.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.7	178	63.9	166.4	0	0	0	111.7	E394 M395 C397 T415 V420 I456 L460	E394-I411 CarbonylContact C-O 3.59Å; E394-I411 WeakPolarHBondContact CA-O 3.47Å; E394-I411 WeakPolarHBondContact CB-O 3.35Å; M395-I411 HydrophobicContact CE-CD1 3.88Å; M395-I411 HydrophobicContact CE-CG1 4.21Å; M395-I411 HydrophobicContact CG-CD1 4.26Å; M395-I411 HydrophobicContact CG-CG1 3.73Å; M395-I411 PolarHBondContact N-O 3.32Å; M395-I411 PolarHBondContact O-N 3.44Å; C397-I411 HydrophobicContact CB-CD1 3.73Å; C397-I411 HydrophobicContact CB-CG1 3.94Å; C397-I411 HydrophobicContact CB-CG2 3.94Å; I411-T415 HydrophobicContact CB-CG2 4.13Å; I411-T415 HydrophobicContact CG2-CG2 3.93Å; I411-V420 HydrophobicContact CG2-CG2 4.03Å; I411-I456 HydrophobicContact CD1-CB 4Å; I411-I456 HydrophobicContact CD1-CG2 3.63Å; I411-L460 HydrophobicContact CD1-CD1 3.95Å
412	S	96.8	Very high	95.6	Very high	34 Å²	34	44 Å²	44	24%	0.238	24%	0.239	C	C	.	.			trans	-97.1	168.8	171.1	73.1	0	0	0	0	111.5	E394 H414 T415	E394-S412 PolarHBondContact OE1-N 3.23Å; S412-H414 PolarHBondContact O-N 3.36Å; S412-H414 PolarHBondContact OG-N 3.22Å; S412-T415 PolarHBondContact N-OG1 2.83Å; S412-T415 VanDerWaalsContact N-OG1 3.08Å; S412-T415 PolarHBondContact O-N 3.33Å; S412-T415 VanDerWaalsContact O-N 3.15Å; S412-T415 PolarHBondContact OG-N 2.94Å; S412-T415 PolarHBondContact OG-OG1 2.79Å
413	S	97.1	Very high	95.8	Very high	5 Å²	5	47 Å²	47	4%	0.035	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-21.4	168.3	-53.5	0	0	0	0	114.2	E385	E385-S413 WeakPolarHBondContact OE1-CA 3.47Å; E385-S413 WeakPolarHBondContact OE1-CB 3.42Å; E385-S413 PolarHBondContact OE1-OG 2.94Å
414	H	97	Very high	96.3	Very high	36 Å²	36	45.4 Å²	45.4	17%	0.167	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-7.5	-175.8	-53.5	106.2	0	0	0	113.9	K373 T374 S412 T416 L455	K373-H414 VanDerWaalsContact C-CD2 3.49Å; K373-H414 HydrophobicContact CB-CB 4.36Å; T374-H414 PolarHBondContact N-NE2 3.12Å; T374-H414 PolarHBondContact OG1-NE2 3.26Å; S412-H414 PolarHBondContact O-N 3.36Å; S412-H414 PolarHBondContact OG-N 3.22Å; H414-T416 PolarHBondContact O-N 3.02Å; H414-L455 VanDerWaalsContact O-CD2 3.3Å; H414-L455 WeakPolarHBondContact O-CD2 3.34Å
415	T	97.6	Very high	96.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.012	20%	0.2	C	C	.	.			trans	-73.1	118.5	-171.7	-63.1	0	0	0	0	111.6	I411 S412 E419 V420 I456	I411-T415 HydrophobicContact CB-CG2 4.13Å; I411-T415 HydrophobicContact CG2-CG2 3.93Å; S412-T415 PolarHBondContact N-OG1 2.83Å; S412-T415 VanDerWaalsContact N-OG1 3.08Å; S412-T415 PolarHBondContact O-N 3.33Å; S412-T415 VanDerWaalsContact O-N 3.15Å; S412-T415 PolarHBondContact OG-N 2.94Å; S412-T415 PolarHBondContact OG-OG1 2.79Å; T415-E419 HydrophobicContact CG2-CB 4.09Å; T415-V420 HydrophobicContact CG2-CG2 3.82Å; T415-I456 PolarHBondContact O-N 2.83Å; T415-I456 VanDerWaalsContact O-N 3.15Å
416	T	97.4	Very high	97.1	Very high	27 Å²	27	44.3 Å²	44.3	17%	0.166	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-82.6	159.2	-177.7	62.5	0	0	0	0	113.4	H414 N418 E419 V420 S454 L455	H414-T416 PolarHBondContact O-N 3.02Å; T416-N418 VanDerWaalsContact C-N 3.28Å; T416-N418 PolarHBondContact O-N 3.06Å; T416-E419 WeakPolarHBondContact CB-OE1 3.35Å; T416-E419 WeakPolarHBondContact CG2-OE1 3.39Å; T416-E419 PolarHBondContact N-OE1 3.03Å; T416-E419 WeakPolarHBondContact O-CB 3.43Å; T416-E419 PolarHBondContact O-N 3.2Å; T416-E419 WeakPolarHBondContact OG1-CG 3.43Å; T416-E419 PolarHBondContact OG1-N 3.28Å; T416-E419 PolarHBondContact OG1-OE1 3.11Å; T416-V420 PolarHBondContact O-N 3.21Å; T416-S454 CarbonylContact C-O 3.58Å; T416-S454 WeakPolarHBondContact CA-O 3.33Å; T416-L455 HydrophobicContact CG2-CD2 4.33Å
417	A	97.1	Very high	97.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-54.3	-41.5	172.3	0	0	0	0	0	112.7	E419 V420 V421 L439 V450 A451 S454 I456	A417-E419 VanDerWaalsContact C-N 3.31Å; A417-E419 PolarHBondContact O-N 3.49Å; A417-V420 PolarHBondContact O-N 2.79Å; A417-V421 WeakPolarHBondContact O-CG2 3.48Å; A417-V421 PolarHBondContact O-N 2.85Å; A417-L439 HydrophobicContact CB-CD1 4.09Å; A417-V450 HydrophobicContact CB-CB 4.38Å; A417-V450 HydrophobicContact CB-CG1 3.63Å; A417-A451 WeakPolarHBondContact CB-O 3.42Å; A417-S454 PolarHBondContact N-O 2.84Å; A417-I456 HydrophobicContact CB-CD1 3.87Å
418	N	96.3	Very high	97.2	Very high	93 Å²	93	48.4 Å²	48.4	50%	0.497	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-31	175.8	-82	-17.4	0	0	0	113.8	T416 R422 G452	T416-N418 VanDerWaalsContact C-N 3.28Å; T416-N418 PolarHBondContact O-N 3.06Å; N418-R422 WeakPolarHBondContact O-CB 3.16Å; N418-R422 PolarHBondContact O-N 2.72Å; N418-R422 VanDerWaalsContact O-N 3.17Å; N418-G452 VanDerWaalsContact CB-O 3.27Å; N418-G452 WeakPolarHBondContact CB-O 3.3Å; N418-G452 VanDerWaalsContact CG-CA 3.45Å; N418-G452 PolarHBondContact N-O 3.16Å; N418-G452 PolarHBondContact ND2-O 2.63Å; N418-G452 VanDerWaalsContact OD1-CA 3.23Å; N418-G452 WeakPolarHBondContact OD1-CA 3.21Å
419	E	98	Very high	97.2	Very high	48 Å²	48	46.1 Å²	46.1	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-71.2	-40.5	172.9	-71.6	157.1	-108.6	0	0	112	T415 T416 A417 R422 R423	T415-E419 HydrophobicContact CG2-CB 4.09Å; T416-E419 WeakPolarHBondContact CB-OE1 3.35Å; T416-E419 WeakPolarHBondContact CG2-OE1 3.39Å; T416-E419 PolarHBondContact N-OE1 3.03Å; T416-E419 WeakPolarHBondContact O-CB 3.43Å; T416-E419 PolarHBondContact O-N 3.2Å; T416-E419 WeakPolarHBondContact OG1-CG 3.43Å; T416-E419 PolarHBondContact OG1-N 3.28Å; T416-E419 PolarHBondContact OG1-OE1 3.11Å; A417-E419 VanDerWaalsContact C-N 3.31Å; A417-E419 PolarHBondContact O-N 3.49Å; E419-R422 PolarHBondContact O-N 2.78Å; E419-R423 WeakPolarHBondContact O-CB 3.42Å; E419-R423 WeakPolarHBondContact O-CG 3.36Å; E419-R423 PolarHBondContact O-N 3.19Å
420	V	98.4	Very high	97.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.8	-40.6	177.4	174.4	0	0	0	0	110.9	V399 L409 I411 T415 T416 A417 R422 R423 M424 L439 I456	V399-V420 HydrophobicContact CG2-CG1 3.8Å; L409-V420 HydrophobicContact CD1-CG1 3.95Å; I411-V420 HydrophobicContact CG2-CG2 4.03Å; T415-V420 HydrophobicContact CG2-CG2 3.82Å; T416-V420 PolarHBondContact O-N 3.21Å; A417-V420 PolarHBondContact O-N 2.79Å; V420-R422 VanDerWaalsContact C-N 3.31Å; V420-R422 PolarHBondContact O-N 2.74Å; V420-R423 PolarHBondContact O-N 2.99Å; V420-M424 HydrophobicContact CG1-CG 4.34Å; V420-M424 WeakPolarHBondContact O-CB 3.48Å; V420-M424 WeakPolarHBondContact O-CG 3.38Å; V420-M424 PolarHBondContact O-N 2.82Å; V420-L439 HydrophobicContact CB-CD1 3.8Å; V420-L439 HydrophobicContact CG1-CD1 3.69Å; V420-L439 HydrophobicContact CG1-CD2 4.24Å; V420-I456 HydrophobicContact CG2-CG1 4Å
421	V	98	Very high	96.9	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.097	23%	0.227	C	C	.	.	H	α-helix	trans	-52.6	-49.4	169.5	165.6	0	0	0	0	110.7	A417 M424 Q425 L439 F481	A417-V421 WeakPolarHBondContact O-CG2 3.48Å; A417-V421 PolarHBondContact O-N 2.85Å; V421-M424 WeakPolarHBondContact O-CB 3.44Å; V421-M424 PolarHBondContact O-N 2.81Å; V421-Q425 WeakPolarHBondContact O-CG 3.38Å; V421-Q425 PolarHBondContact O-N 3.01Å; V421-L439 HydrophobicContact CG2-CD1 4.22Å; V421-L439 HydrophobicContact CG2-CG 3.85Å; V421-F481 HydrophobicContact CB-CE2 4.38Å; V421-F481 HydrophobicContact CG1-CE2 4.14Å; V421-F481 HydrophobicContact CG2-CE2 4.49Å
422	R	97.5	Very high	96.6	Very high	119 Å²	119	52.4 Å²	52.4	45%	0.449	27%	0.268	S	S	.	.	H	α-helix	trans	-63.9	-48.6	179.7	-159	-161.7	-48.7	102.7	9.4	112.5	N418 E419 V420 M424 Q425 E426	N418-R422 WeakPolarHBondContact O-CB 3.16Å; N418-R422 PolarHBondContact O-N 2.72Å; N418-R422 VanDerWaalsContact O-N 3.17Å; E419-R422 PolarHBondContact O-N 2.78Å; V420-R422 VanDerWaalsContact C-N 3.31Å; V420-R422 PolarHBondContact O-N 2.74Å; R422-M424 PolarHBondContact O-N 3.38Å; R422-Q425 PolarHBondContact O-N 2.91Å; R422-Q425 VanDerWaalsContact O-N 3.1Å; R422-E426 VanDerWaalsContact CD-OE1 3.24Å; R422-E426 WeakPolarHBondContact CD-OE1 3.39Å; R422-E426 VanDerWaalsContact CG-OE1 3.28Å; R422-E426 WeakPolarHBondContact CG-OE1 3.46Å; R422-E426 WeakPolarHBondContact O-CB 3.36Å; R422-E426 VanDerWaalsContact O-CG 3.29Å; R422-E426 WeakPolarHBondContact O-CG 3.33Å; R422-E426 PolarHBondContact O-N 3.22Å
423	R	97.9	Very high	96.5	Very high	75 Å²	75	52 Å²	52	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-34.2	176.6	-71.7	176.9	-175.1	-167.5	2.4	111.8	L409 Y410 E419 V420 K427	L409-R423 HydrophobicContact CD1-CB 4.06Å; L409-R423 HydrophobicContact CD2-CB 4.3Å; Y410-R423 PolarHBondContact O-NH1 3.15Å; E419-R423 WeakPolarHBondContact O-CB 3.42Å; E419-R423 WeakPolarHBondContact O-CG 3.36Å; E419-R423 PolarHBondContact O-N 3.19Å; V420-R423 PolarHBondContact O-N 2.99Å; R423-K427 WeakPolarHBondContact O-CB 3.27Å; R423-K427 PolarHBondContact O-N 3.09Å
424	M	97.9	Very high	96.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.7	-45.5	172.8	-72.2	-65.4	-67.5	0	0	111.8	V399 Y401 C407 L409 V420 V421 R422 E426 K427 L428 F481	V399-M424 HydrophobicContact CB-CE 4.17Å; V399-M424 HydrophobicContact CB-SD 3.91Å; V399-M424 HydrophobicContact CG1-CE 3.84Å; V399-M424 HydrophobicContact CG1-CG 4.18Å; V399-M424 HydrophobicContact CG1-SD 3.97Å; V399-M424 HydrophobicContact CG2-SD 4.38Å; Y401-M424 HydrophobicContact CD1-CE 3.88Å; C407-M424 HydrophobicContact CB-CE 3.83Å; C407-M424 HydrophobicContact CB-SD 3.68Å; L409-M424 HydrophobicContact CD1-CG 3.96Å; L409-M424 HydrophobicContact CD1-SD 3.8Å; V420-M424 HydrophobicContact CG1-CG 4.34Å; V420-M424 WeakPolarHBondContact O-CB 3.48Å; V420-M424 WeakPolarHBondContact O-CG 3.38Å; V420-M424 PolarHBondContact O-N 2.82Å; V421-M424 WeakPolarHBondContact O-CB 3.44Å; V421-M424 PolarHBondContact O-N 2.81Å; R422-M424 PolarHBondContact O-N 3.38Å; M424-E426 VanDerWaalsContact C-N 3.34Å; M424-E426 PolarHBondContact O-N 3.06Å; M424-K427 PolarHBondContact O-N 2.9Å; M424-L428 HydrophobicContact CE-CD1 3.87Å; M424-L428 HydrophobicContact CE-CG 4.49Å; M424-L428 VanDerWaalsContact O-CB 3.32Å; M424-L428 WeakPolarHBondContact O-CB 3.47Å; M424-L428 VanDerWaalsContact O-CG 3.32Å; M424-L428 WeakPolarHBondContact O-CG 3.48Å; M424-L428 PolarHBondContact O-N 3.47Å; M424-F481 HydrophobicContact CB-CD1 4.11Å; M424-F481 HydrophobicContact CB-CD2 3.62Å; M424-F481 HydrophobicContact CB-CE1 4.06Å; M424-F481 HydrophobicContact CB-CE2 3.56Å; M424-F481 HydrophobicContact CB-CG 3.9Å; M424-F481 HydrophobicContact CB-CZ 3.79Å; M424-F481 HydrophobicContact CE-CB 3.84Å; M424-F481 HydrophobicContact CE-CD1 3.97Å; M424-F481 HydrophobicContact CE-CG 3.97Å; M424-F481 HydrophobicContact CG-CB 4.42Å; M424-F481 HydrophobicContact CG-CD2 4.02Å; M424-F481 HydrophobicContact CG-CE2 4.44Å; M424-F481 HydrophobicContact CG-CG 4.15Å
425	Q	97.2	Very high	96.2	Very high	43 Å²	43	56.4 Å²	56.4	20%	0.201	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-43.5	174.8	-71.6	-177.4	-91.4	0	0	112.1	V421 R422 G429 L430 F437 F481	V421-Q425 WeakPolarHBondContact O-CG 3.38Å; V421-Q425 PolarHBondContact O-N 3.01Å; R422-Q425 PolarHBondContact O-N 2.91Å; R422-Q425 VanDerWaalsContact O-N 3.1Å; Q425-G429 PolarHBondContact O-N 2.94Å; Q425-G429 VanDerWaalsContact O-N 3.09Å; Q425-L430 HydrophobicContact CB-CB 4.24Å; Q425-L430 HydrophobicContact CG-CB 4.27Å; Q425-L430 PolarHBondContact NE2-O 3.48Å; Q425-L430 VanDerWaalsContact NE2-O 3.09Å; Q425-L430 PolarHBondContact O-N 2.71Å; Q425-F437 HydrophobicContact CG-CD2 4.07Å; Q425-F481 HydrophobicContact CG-CE2 4.34Å; Q425-F481 HydrophobicContact CG-CZ 3.81Å
426	E	96.7	Very high	96.1	Very high	89 Å²	89	57.5 Å²	57.5	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-58.6	-50.9	175.5	-71.4	160.5	-164.1	0	0	111.3	R422 M424 L428 G429 Q431	R422-E426 VanDerWaalsContact CD-OE1 3.24Å; R422-E426 WeakPolarHBondContact CD-OE1 3.39Å; R422-E426 VanDerWaalsContact CG-OE1 3.28Å; R422-E426 WeakPolarHBondContact CG-OE1 3.46Å; R422-E426 WeakPolarHBondContact O-CB 3.36Å; R422-E426 VanDerWaalsContact O-CG 3.29Å; R422-E426 WeakPolarHBondContact O-CG 3.33Å; R422-E426 PolarHBondContact O-N 3.22Å; M424-E426 VanDerWaalsContact C-N 3.34Å; M424-E426 PolarHBondContact O-N 3.06Å; E426-L428 PolarHBondContact O-N 2.77Å; E426-G429 PolarHBondContact O-N 2.89Å; E426-Q431 HydrophobicContact CG-CG 4.47Å
427	K	96.3	Very high	96.1	Very high	123 Å²	123	56.8 Å²	56.8	54%	0.535	29%	0.285	S	S	.	.	H	α-helix	trans	-75.1	-20.7	-174.7	-174.7	163.2	169.4	-178.4	0	114.6	C407 Q408 L409 R423 M424	C407-K427 VanDerWaalsContact SG-CD 3.5Å; C407-K427 WeakPolarHBondContact SG-CE 3.27Å; C407-K427 PolarHBondContact SG-NZ 2.62Å; Q408-K427 PolarHBondContact O-NZ 2.79Å; L409-K427 HydrophobicContact CD2-CD 4.07Å; R423-K427 WeakPolarHBondContact O-CB 3.27Å; R423-K427 PolarHBondContact O-N 3.09Å; M424-K427 PolarHBondContact O-N 2.9Å
428	L	95.9	Very high	96.1	Very high	31 Å²	31	57.2 Å²	57.2	16%	0.162	29%	0.288	C	S	.	.	H	α-helix	trans	-102.9	0.1	177	-60	-175	0	0	0	113.9	Y401 M424 E426 L430 F481 I497 F501	Y401-L428 HydrophobicContact CD1-CD1 4.33Å; Y401-L428 HydrophobicContact CE1-CD2 4.39Å; M424-L428 HydrophobicContact CE-CD1 3.87Å; M424-L428 HydrophobicContact CE-CG 4.49Å; M424-L428 VanDerWaalsContact O-CB 3.32Å; M424-L428 WeakPolarHBondContact O-CB 3.47Å; M424-L428 VanDerWaalsContact O-CG 3.32Å; M424-L428 WeakPolarHBondContact O-CG 3.48Å; M424-L428 PolarHBondContact O-N 3.47Å; E426-L428 PolarHBondContact O-N 2.77Å; L428-L430 HydrophobicContact CB-CD1 3.84Å; L428-L430 HydrophobicContact CB-CG 4.04Å; L428-L430 HydrophobicContact CD1-CD1 4.25Å; L428-F481 HydrophobicContact CD1-CD1 4.15Å; L428-F481 HydrophobicContact CD1-CE1 4.08Å; L428-I497 HydrophobicContact CB-CG2 4.32Å; L428-I497 HydrophobicContact CD1-CD1 4.19Å; L428-I497 HydrophobicContact CD2-CD1 4Å; L428-I497 HydrophobicContact CG-CD1 4.48Å; L428-I497 WeakPolarHBondContact O-CG2 3.48Å; L428-F501 HydrophobicContact CD1-CE2 4.38Å; L428-F501 HydrophobicContact CD1-CZ 3.79Å
429	G	95.7	Very high	96.1	Very high	62 Å²	62	52.8 Å²	52.8	64%	0.639	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	24.4	178.9	0	0	0	0	0	114.8	Q425 E426	Q425-G429 PolarHBondContact O-N 2.94Å; Q425-G429 VanDerWaalsContact O-N 3.09Å; E426-G429 PolarHBondContact O-N 2.89Å
430	L	96	Very high	96	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.031	26%	0.258	C	S	.	.			trans	-100.6	25.2	-173.9	-58.6	169.7	0	0	0	113.1	Q425 L428 F437 F481 I497 E498 F501	Q425-L430 HydrophobicContact CB-CB 4.24Å; Q425-L430 HydrophobicContact CG-CB 4.27Å; Q425-L430 PolarHBondContact NE2-O 3.48Å; Q425-L430 VanDerWaalsContact NE2-O 3.09Å; Q425-L430 PolarHBondContact O-N 2.71Å; L428-L430 HydrophobicContact CB-CD1 3.84Å; L428-L430 HydrophobicContact CB-CG 4.04Å; L428-L430 HydrophobicContact CD1-CD1 4.25Å; L430-F437 HydrophobicContact CB-CE2 4.11Å; L430-F437 HydrophobicContact CB-CZ 4.15Å; L430-F437 HydrophobicContact CD1-CD1 4.35Å; L430-F437 HydrophobicContact CD1-CE1 3.83Å; L430-F437 HydrophobicContact CD1-CE2 4.47Å; L430-F437 HydrophobicContact CD1-CZ 3.91Å; L430-F437 HydrophobicContact CD2-CZ 4.09Å; L430-F437 HydrophobicContact CG-CZ 4.28Å; L430-F481 HydrophobicContact CD1-CE1 3.81Å; L430-F481 HydrophobicContact CD1-CZ 4.33Å; L430-I497 HydrophobicContact CD1-CG2 4.37Å; L430-I497 HydrophobicContact CD2-CG2 3.84Å; L430-I497 HydrophobicContact CG-CG2 4.19Å; L430-E498 HydrophobicContact CD2-CB 3.72Å; L430-E498 HydrophobicContact CD2-CG 4.41Å; L430-F501 HydrophobicContact CD1-CE2 4.11Å
431	Q	93.3	Very high	95.8	Very high	129 Å²	129	52.1 Å²	52.1	60%	0.603	26%	0.261	S	S	*	.	S	Bend	trans	-73.9	-37.7	-177.7	-61.6	-174.2	49.6	0	0	112.4	E426	E426-Q431 HydrophobicContact CG-CG 4.47Å
432	D	91.1	Very high	95.4	Very high	162 Å²	162	53.1 Å²	53.1	87%	0.866	26%	0.264	S	S	*	.	S	Bend	trans	-90.1	2.8	-178.6	-62.6	-61.6	0	0	0	113.8
433	S	93.9	Very high	94.9	Very high	25 Å²	25	48.7 Å²	48.7	18%	0.175	25%	0.25	C	C	.	.			trans	-60.8	139.4	175	171.8	0	0	0	0	110.9	N435 E498	S433-N435 VanDerWaalsContact C-N 3.3Å; S433-N435 WeakPolarHBondContact OG-CB 3.47Å; S433-N435 PolarHBondContact OG-N 3.13Å; S433-E498 WeakPolarHBondContact CB-OE2 3.41Å; S433-E498 VanDerWaalsContact OG-CD 3.25Å; S433-E498 PolarHBondContact OG-OE1 3.06Å; S433-E498 PolarHBondContact OG-OE2 3.29Å
434	K	93	Very high	94	Very high	124 Å²	124	49 Å²	49	54%	0.539	27%	0.269	S	S	.	.	S	Bend	trans	-77.8	-17.7	171.7	-65.1	-179.5	-168.5	169.9	0	112.8	L487 D488 Q750	K434-L487 VanDerWaalsContact O-CD1 3.31Å; K434-L487 WeakPolarHBondContact O-CD1 3.47Å; K434-D488 HydrophobicContact CB-CB 4.19Å; K434-D488 HydrophobicContact CD-CB 3.82Å; K434-D488 VanDerWaalsContact CD-OD2 3.27Å; K434-D488 WeakPolarHBondContact CD-OD2 3.29Å; K434-D488 WeakPolarHBondContact CE-OD2 3.18Å; K434-D488 IonicContact NZ-OD2 3.79Å; K434-D488 PolarHBondContact NZ-OD2 3.24Å; K434-Q750 PolarHBondContact O-NE2 2.92Å
435	N	95.5	Very high	93	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.048	30%	0.303	C	S	.	.	S	Bend	trans	-86.3	174.9	-177.1	-60.4	-51.1	0	0	0	110.8	S433 L483 C485 L487 D488 E498	S433-N435 VanDerWaalsContact C-N 3.3Å; S433-N435 WeakPolarHBondContact OG-CB 3.47Å; S433-N435 PolarHBondContact OG-N 3.13Å; N435-L483 HydrophobicContact CB-CD1 3.79Å; N435-C485 WeakPolarHBondContact CB-O 3.32Å; N435-L487 WeakPolarHBondContact OD1-CA 3.49Å; N435-L487 PolarHBondContact OD1-N 2.62Å; N435-D488 PolarHBondContact ND2-O 3.47Å; N435-D488 PolarHBondContact OD1-N 3.2Å; N435-D488 PolarHBondContact OD1-O 3.15Å; N435-E498 WeakPolarHBondContact CB-OE1 3.15Å; N435-E498 PolarHBondContact ND2-OE1 3.32Å
436	T	95.6	Very high	92.2	Very high	25 Å²	25	58.2 Å²	58.2	15%	0.153	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	156.5	174.5	80.4	0	0	0	0	111.8	Y484 C485 L487 A746	T436-Y484 PolarHBondContact O-N 3.44Å; T436-C485 HydrophobicContact CG2-CB 4.04Å; T436-C485 PolarHBondContact N-O 3.28Å; T436-C485 VanDerWaalsContact N-O 3.08Å; T436-C485 PolarHBondContact O-N 3.05Å; T436-C485 WeakPolarHBondContact OG1-CB 3.42Å; T436-C485 PolarHBondContact OG1-N 3.06Å; T436-C485 PolarHBondContact OG1-SG 2.73Å; T436-L487 HydrophobicContact CG2-CD1 4.06Å; T436-A746 HydrophobicContact CG2-CB 3.77Å
437	F	96.7	Very high	91.8	Very high	12 Å²	12	56.1 Å²	56.1	5%	0.053	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.1	-178.5	-55.1	-94.5	0	0	0	109.5	Q425 L430 F481 K482 L483 E498 F501	Q425-F437 HydrophobicContact CG-CD2 4.07Å; L430-F437 HydrophobicContact CB-CE2 4.11Å; L430-F437 HydrophobicContact CB-CZ 4.15Å; L430-F437 HydrophobicContact CD1-CD1 4.35Å; L430-F437 HydrophobicContact CD1-CE1 3.83Å; L430-F437 HydrophobicContact CD1-CE2 4.47Å; L430-F437 HydrophobicContact CD1-CZ 3.91Å; L430-F437 HydrophobicContact CD2-CZ 4.09Å; L430-F437 HydrophobicContact CG-CZ 4.28Å; F437-F481 HydrophobicContact CB-CD2 4.34Å; F437-F481 HydrophobicContact CB-CE1 4.17Å; F437-F481 HydrophobicContact CB-CE2 3.51Å; F437-F481 HydrophobicContact CB-CZ 3.41Å; F437-F481 VanDerWaalsContact CB-CZ 3.41Å; F437-F481 AromaticContact CD1-CE1 3.85Å; F437-F481 HydrophobicContact CD1-CE1 3.85Å; F437-F481 AromaticContact CD1-CZ 3.86Å; F437-F481 HydrophobicContact CD1-CZ 3.86Å; F437-F481 HydrophobicContact CD2-CZ 4.34Å; F437-F481 HydrophobicContact CG-CE1 4.1Å; F437-F481 HydrophobicContact CG-CE2 4.24Å; F437-F481 AromaticContact CG-CZ 3.61Å; F437-F481 HydrophobicContact CG-CZ 3.61Å; F437-K482 WeakPolarHBondContact CA-O 3.23Å; F437-L483 HydrophobicContact CD1-CB 4.5Å; F437-L483 HydrophobicContact CD1-CD1 3.85Å; F437-L483 HydrophobicContact CE1-CD1 3.34Å; F437-L483 HydrophobicContact CE2-CD1 4.4Å; F437-L483 HydrophobicContact CZ-CD1 3.65Å; F437-E498 HydrophobicContact CE1-CG 4.48Å; F437-E498 HydrophobicContact CZ-CG 4.1Å; F437-F501 HydrophobicContact CD1-CD2 4.34Å; F437-F501 HydrophobicContact CD1-CE2 4.48Å; F437-F501 HydrophobicContact CE1-CD2 4.05Å; F437-F501 HydrophobicContact CE1-CE2 4.39Å
438	A	96.7	Very high	91.5	Very high	10 Å²	10	53.2 Å²	53.2	8%	0.083	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	163.2	176.3	0	0	0	0	0	110.8	Y440 F481 K482 Y484	A438-Y440 HydrophobicContact CB-CE2 4.1Å; A438-F481 WeakPolarHBondContact O-CA 3.18Å; A438-K482 PolarHBondContact N-O 3.15Å; A438-K482 PolarHBondContact O-N 2.96Å; A438-Y484 HydrophobicContact CB-CD1 3.81Å; A438-Y484 HydrophobicContact CB-CD2 4.09Å; A438-Y484 HydrophobicContact CB-CE1 4.4Å; A438-Y484 HydrophobicContact CB-CG 3.63Å
439	L	97.8	Very high	91.3	Very high	1 Å²	1	52 Å²	52	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	146.3	166	-67.9	168.7	0	0	0	109.6	V399 A417 V420 V421 P449 V450 I456 L479 C480 F481	V399-L439 HydrophobicContact CG1-CD2 3.68Å; A417-L439 HydrophobicContact CB-CD1 4.09Å; V420-L439 HydrophobicContact CB-CD1 3.8Å; V420-L439 HydrophobicContact CG1-CD1 3.69Å; V420-L439 HydrophobicContact CG1-CD2 4.24Å; V421-L439 HydrophobicContact CG2-CD1 4.22Å; V421-L439 HydrophobicContact CG2-CG 3.85Å; L439-P449 CarbonylContact O-C 3.6Å; L439-P449 WeakPolarHBondContact O-CA 3.38Å; L439-V450 HydrophobicContact CB-CB 4.08Å; L439-V450 HydrophobicContact CB-CG2 4.02Å; L439-V450 PolarHBondContact O-N 2.86Å; L439-I456 HydrophobicContact CD1-CD1 3.93Å; L439-L479 HydrophobicContact CB-CD1 4.03Å; L439-L479 HydrophobicContact CD1-CD1 4.48Å; L439-L479 HydrophobicContact CD2-CD1 4.43Å; L439-L479 HydrophobicContact CD2-CG 4.22Å; L439-C480 CarbonylContact C-O 3.56Å; L439-C480 WeakPolarHBondContact CA-O 3.32Å; L439-F481 HydrophobicContact CD2-CB 3.94Å; L439-F481 HydrophobicContact CD2-CD2 4.24Å
440	Y	95.3	Very high	91.3	Very high	20 Å²	20	49.7 Å²	49.7	8%	0.078	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.3	177.6	-78.5	-105.7	0	0	0	109.7	A438 E447 Q448 P449 L479 C480 K482 Y484	A438-Y440 HydrophobicContact CB-CE2 4.1Å; Y440-E447 HydrophobicContact CD1-CB 4.43Å; Y440-E447 HydrophobicContact CD1-CG 4.48Å; Y440-Q448 CarbonylContact C-O 3.6Å; Y440-Q448 VanDerWaalsContact CA-O 3.29Å; Y440-Q448 WeakPolarHBondContact CA-O 3.43Å; Y440-P449 HydrophobicContact CD1-CB 4.41Å; Y440-P449 HydrophobicContact CE1-CB 4.13Å; Y440-P449 HydrophobicContact CE1-CG 4.47Å; Y440-L479 WeakPolarHBondContact O-CA 3.36Å; Y440-C480 PolarHBondContact N-O 3.08Å; Y440-C480 PolarHBondContact O-N 2.86Å; Y440-K482 HydrophobicContact CD1-CD 4.49Å; Y440-K482 HydrophobicContact CD2-CB 3.81Å; Y440-K482 HydrophobicContact CD2-CD 3.9Å; Y440-K482 HydrophobicContact CD2-CG 4Å; Y440-K482 HydrophobicContact CE2-CB 3.89Å; Y440-K482 HydrophobicContact CE2-CD 4.43Å; Y440-K482 HydrophobicContact CG-CD 3.94Å; Y440-K482 HydrophobicContact CG-CG 4.48Å; Y440-Y484 HydrophobicContact CE2-CD2 4.41Å; Y440-Y484 WeakPolarHBondContact OH-CD2 3.39Å
441	E	93.4	Very high	91.1	Very high	14 Å²	14	50.8 Å²	50.8	7%	0.065	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124	162.4	-49.8	-171.6	-161.6	0	0	107.1	W446 E447 Q448 V450 V459 R462 Y463 W477	E441-W446 HydrophobicContact CB-CZ3 4.07Å; E441-E447 VanDerWaalsContact O-CA 3.23Å; E441-E447 WeakPolarHBondContact O-CA 3.45Å; E441-Q448 PolarHBondContact N-O 3.24Å; E441-Q448 PolarHBondContact O-N 3.16Å; E441-V450 HydrophobicContact CG-CG2 3.52Å; E441-V459 HydrophobicContact CG-CG1 3.93Å; E441-R462 IonicContact OE1-CZ 3.76Å; E441-R462 IonicContact OE1-NH1 3.25Å; E441-R462 PolarHBondContact OE1-NH1 2.93Å; E441-R462 IonicContact OE1-NH2 3.42Å; E441-R462 PolarHBondContact OE1-NH2 2.8Å; E441-R462 IonicContact OE2-CZ 3.11Å; E441-R462 IonicContact OE2-NH1 2.71Å; E441-R462 PolarHBondContact OE2-NH1 3.24Å; E441-R462 IonicContact OE2-NH2 3.6Å; E441-Y463 WeakPolarHBondContact CA-OH 3.12Å; E441-Y463 HydrophobicContact CB-CE1 4.21Å; E441-Y463 WeakPolarHBondContact CB-OH 3.29Å; E441-Y463 HydrophobicContact CG-CE1 4.33Å; E441-Y463 WeakPolarHBondContact CG-OH 3.35Å; E441-W477 HydrophobicContact CB-CZ3 4.44Å
442	Q	90.1	Very high	91	Very high	36 Å²	36	45.7 Å²	45.7	17%	0.168	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.6	-172.7	-175.2	171	4.2	0	0	111.4	W446 E447 W477 K478 C480 E508	Q442-W446 WeakPolarHBondContact CA-O 3.48Å; Q442-E447 HydrophobicContact CB-CB 4.25Å; Q442-E447 HydrophobicContact CG-CB 4.14Å; Q442-W477 CarbonylContact O-C 3.57Å; Q442-W477 WeakPolarHBondContact O-CA 3.39Å; Q442-K478 PolarHBondContact N-O 3.02Å; Q442-K478 PolarHBondContact O-N 3.24Å; Q442-C480 PolarHBondContact OE1-SG 2.83Å; Q442-E508 PolarHBondContact NE2-OE1 2.78Å
443	N	86.4	Confident	91.1	Very high	26 Å²	26	44.1 Å²	44.1	14%	0.139	24%	0.241	C	C	.	.			trans	-126.2	-166.5	163.4	74.4	30.9	0	0	0	109.7	L445 W446 W477	N443-L445 VanDerWaalsContact C-N 3.28Å; N443-L445 PolarHBondContact O-N 3.01Å; N443-L445 PolarHBondContact OD1-N 3.34Å; N443-W446 PolarHBondContact N-O 3.04Å; N443-W446 PolarHBondContact OD1-N 2.98Å; N443-W477 HydrophobicContact CB-CD2 4.07Å; N443-W477 HydrophobicContact CB-CE3 4.25Å; N443-W477 HydrophobicContact CB-CG 4.46Å; N443-W477 WeakPolarHBondContact ND2-CH2 3.32Å; N443-W477 WeakPolarHBondContact ND2-CZ2 3.38Å
444	A	78.9	Confident	91.1	Very high	83 Å²	83	44.5 Å²	44.5	69%	0.686	24%	0.243	S	C	*	.	S	Bend	trans	-69.9	-16.7	-176.9	0	0	0	0	0	115.3
445	L	77.4	Confident	91.3	Very high	137 Å²	137	39.9 Å²	39.9	72%	0.717	22%	0.224	S	C	*	.	S	Bend	trans	-126.4	-11.2	-173	-62	176.7	0	0	0	113.8	N443	N443-L445 VanDerWaalsContact C-N 3.28Å; N443-L445 PolarHBondContact O-N 3.01Å; N443-L445 PolarHBondContact OD1-N 3.34Å
446	W	81.4	Confident	91.4	Very high	99 Å²	99	39.4 Å²	39.4	38%	0.375	22%	0.222	S	C	.	.			trans	-147.9	141	-166.2	-173	95.5	0	0	0	111.5	E441 Q442 N443 Q448 W477	E441-W446 HydrophobicContact CB-CZ3 4.07Å; Q442-W446 WeakPolarHBondContact CA-O 3.48Å; N443-W446 PolarHBondContact N-O 3.04Å; N443-W446 PolarHBondContact OD1-N 2.98Å; W446-Q448 HydrophobicContact CE3-CB 4.42Å; W446-Q448 HydrophobicContact CH2-CB 3.27Å; W446-Q448 HydrophobicContact CH2-CG 4.18Å; W446-Q448 VanDerWaalsContact CH2-OE1 3.25Å; W446-Q448 HydrophobicContact CZ2-CB 3.67Å; W446-Q448 HydrophobicContact CZ2-CG 4.46Å; W446-Q448 HydrophobicContact CZ3-CB 3.67Å; W446-W477 HydrophobicContact CD2-CH2 4.36Å; W446-W477 AromaticContact CE3-CH2 3.69Å; W446-W477 HydrophobicContact CE3-CH2 3.69Å; W446-W477 AromaticContact CE3-CZ3 3.58Å; W446-W477 HydrophobicContact CE3-CZ3 3.58Å; W446-W477 AromaticContact CZ3-CH2 3.87Å; W446-W477 HydrophobicContact CZ3-CH2 3.87Å; W446-W477 AromaticContact CZ3-CZ3 3.56Å; W446-W477 HydrophobicContact CZ3-CZ3 3.56Å
447	E	88.1	Confident	91.4	Very high	44 Å²	44	38.2 Å²	38.2	21%	0.206	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.7	167	69.6	-173	-173.8	0	0	111.4	Y440 E441 Q442 K482 R512 K732	Y440-E447 HydrophobicContact CD1-CB 4.43Å; Y440-E447 HydrophobicContact CD1-CG 4.48Å; E441-E447 VanDerWaalsContact O-CA 3.23Å; E441-E447 WeakPolarHBondContact O-CA 3.45Å; Q442-E447 HydrophobicContact CB-CB 4.25Å; Q442-E447 HydrophobicContact CG-CB 4.14Å; E447-K482 IonicContact OE2-NZ 2.71Å; E447-K482 PolarHBondContact OE2-NZ 2.86Å; E447-R512 VanDerWaalsContact CD-NH2 3.29Å; E447-R512 IonicContact OE1-CZ 2.77Å; E447-R512 IonicContact OE1-NH1 3.63Å; E447-R512 PolarHBondContact OE1-NH1 3.11Å; E447-R512 IonicContact OE1-NH2 2.73Å; E447-R512 PolarHBondContact OE1-NH2 3.39Å; E447-R512 IonicContact OE2-CZ 2.66Å; E447-R512 IonicContact OE2-NH1 3.82Å; E447-R512 IonicContact OE2-NH2 2.96Å; E447-R512 PolarHBondContact OE2-NH2 2.97Å; E447-K732 PolarHBondContact O-NZ 3.42Å
448	Q	89.6	Confident	91.3	Very high	63 Å²	63	38.1 Å²	38.1	29%	0.294	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	141	173.5	179.3	178.6	-21	0	0	110.2	Y440 E441 W446 E735	Y440-Q448 CarbonylContact C-O 3.6Å; Y440-Q448 VanDerWaalsContact CA-O 3.29Å; Y440-Q448 WeakPolarHBondContact CA-O 3.43Å; E441-Q448 PolarHBondContact N-O 3.24Å; E441-Q448 PolarHBondContact O-N 3.16Å; W446-Q448 HydrophobicContact CE3-CB 4.42Å; W446-Q448 HydrophobicContact CH2-CB 3.27Å; W446-Q448 HydrophobicContact CH2-CG 4.18Å; W446-Q448 VanDerWaalsContact CH2-OE1 3.25Å; W446-Q448 HydrophobicContact CZ2-CB 3.67Å; W446-Q448 HydrophobicContact CZ2-CG 4.46Å; W446-Q448 HydrophobicContact CZ3-CB 3.67Å; Q448-E735 HydrophobicContact CG-CG 4.08Å; Q448-E735 WeakPolarHBondContact CG-OE1 3.41Å
449	P	92.4	Very high	91.2	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.039	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	137.4	171.2	27.3	-35.7	0	0	0	112.6	L439 Y440 Y484 E735	L439-P449 CarbonylContact O-C 3.6Å; L439-P449 WeakPolarHBondContact O-CA 3.38Å; Y440-P449 HydrophobicContact CD1-CB 4.41Å; Y440-P449 HydrophobicContact CE1-CB 4.13Å; Y440-P449 HydrophobicContact CE1-CG 4.47Å; P449-Y484 HydrophobicContact CB-CE2 4.38Å; P449-E735 HydrophobicContact CG-CG 4.12Å
450	V	94.1	Very high	91	Very high	12 Å²	12	39.6 Å²	39.6	7%	0.073	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-76.5	129	171.7	-176.8	0	0	0	0	109	A417 L439 E441 G452 I456 V459 L479	A417-V450 HydrophobicContact CB-CB 4.38Å; A417-V450 HydrophobicContact CB-CG1 3.63Å; L439-V450 HydrophobicContact CB-CB 4.08Å; L439-V450 HydrophobicContact CB-CG2 4.02Å; L439-V450 PolarHBondContact O-N 2.86Å; E441-V450 HydrophobicContact CG-CG2 3.52Å; V450-G452 PolarHBondContact O-N 3.38Å; V450-I456 HydrophobicContact CG1-CD1 4.37Å; V450-V459 HydrophobicContact CG1-CG2 4.18Å; V450-L479 HydrophobicContact CG2-CD1 3.93Å
451	A	91.7	Very high	90.9	Very high	29 Å²	29	38.7 Å²	38.7	24%	0.24	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-64.2	134.9	175.1	0	0	0	0	0	110.9	A417 N453 S454	A417-A451 WeakPolarHBondContact CB-O 3.42Å; A451-N453 PolarHBondContact O-N 2.81Å; A451-S454 VanDerWaalsContact O-CB 3.29Å; A451-S454 WeakPolarHBondContact O-CB 3.47Å; A451-S454 PolarHBondContact O-N 3.48Å; A451-S454 PolarHBondContact O-OG 2.77Å
452	G	92.2	Very high	90.7	Very high	22 Å²	22	40.8 Å²	40.8	23%	0.227	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.6	-169.9	0	0	0	0	0	116	N418 V450	N418-G452 VanDerWaalsContact CB-O 3.27Å; N418-G452 WeakPolarHBondContact CB-O 3.3Å; N418-G452 VanDerWaalsContact CG-CA 3.45Å; N418-G452 PolarHBondContact N-O 3.16Å; N418-G452 PolarHBondContact ND2-O 2.63Å; N418-G452 VanDerWaalsContact OD1-CA 3.23Å; N418-G452 WeakPolarHBondContact OD1-CA 3.21Å; V450-G452 PolarHBondContact O-N 3.38Å
453	N	92.8	Very high	90.6	Very high	130 Å²	130	40 Å²	40	70%	0.695	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.1	176.6	64.1	-35.8	0	0	0	114.4	A451	A451-N453 PolarHBondContact O-N 2.81Å
454	S	94.8	Very high	90.4	Very high	32 Å²	32	41.8 Å²	41.8	22%	0.224	23%	0.228	C	C	.	.	S	Bend	trans	-64.7	142.5	177	-64.6	0	0	0	0	111.3	T416 A417 A451	T416-S454 CarbonylContact C-O 3.58Å; T416-S454 WeakPolarHBondContact CA-O 3.33Å; A417-S454 PolarHBondContact N-O 2.84Å; A451-S454 VanDerWaalsContact O-CB 3.29Å; A451-S454 WeakPolarHBondContact O-CB 3.47Å; A451-S454 PolarHBondContact O-N 3.48Å; A451-S454 PolarHBondContact O-OG 2.77Å
455	L	96.6	Very high	90.5	Very high	27 Å²	27	40.6 Å²	40.6	14%	0.141	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-80.3	126	174.6	-63.3	173.7	0	0	0	109.5	R377 H414 T416 A457 D458 V459	R377-L455 HydrophobicContact CG-CD1 3.83Å; H414-L455 VanDerWaalsContact O-CD2 3.3Å; H414-L455 WeakPolarHBondContact O-CD2 3.34Å; T416-L455 HydrophobicContact CG2-CD2 4.33Å; L455-A457 PolarHBondContact O-N 2.78Å; L455-D458 PolarHBondContact O-N 3.28Å; L455-V459 PolarHBondContact O-N 2.9Å
456	I	97	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-25.9	-180	-61.6	-55.2	0	0	0	111.5	I411 T415 A417 V420 L439 V450 D458 V459 L460 L479	I411-I456 HydrophobicContact CD1-CB 4Å; I411-I456 HydrophobicContact CD1-CG2 3.63Å; T415-I456 PolarHBondContact O-N 2.83Å; T415-I456 VanDerWaalsContact O-N 3.15Å; A417-I456 HydrophobicContact CB-CD1 3.87Å; V420-I456 HydrophobicContact CG2-CG1 4Å; L439-I456 HydrophobicContact CD1-CD1 3.93Å; V450-I456 HydrophobicContact CG1-CD1 4.37Å; I456-D458 VanDerWaalsContact C-N 3.34Å; I456-D458 PolarHBondContact O-N 3.37Å; I456-V459 HydrophobicContact CD1-CG2 4.38Å; I456-V459 PolarHBondContact O-N 3.02Å; I456-L460 HydrophobicContact CG2-CD1 4.15Å; I456-L460 HydrophobicContact CG2-CG 4.15Å; I456-L460 WeakPolarHBondContact O-CG 3.49Å; I456-L460 PolarHBondContact O-N 3.35Å; I456-L479 HydrophobicContact CD1-CD2 4.19Å; I456-L479 HydrophobicContact CG2-CD2 3.79Å
457	A	95.9	Very high	90	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-39.8	170.1	0	0	0	0	0	113.7	R377 M395 L455 T461	R377-A457 VanDerWaalsContact NH2-C 3.33Å; R377-A457 PolarHBondContact NH2-O 2.81Å; M395-A457 HydrophobicContact CE-CB 3.53Å; L455-A457 PolarHBondContact O-N 2.78Å; A457-T461 WeakPolarHBondContact O-CB 3.34Å; A457-T461 PolarHBondContact O-N 2.81Å; A457-T461 VanDerWaalsContact O-N 3.14Å; A457-T461 PolarHBondContact O-OG1 3.14Å
458	D	95.6	Very high	88.8	Confident	9 Å²	9	38.2 Å²	38.2	5%	0.048	21%	0.21	C	C	.	.	H	α-helix	trans	-72.1	-38.4	175.5	-81.7	-26.4	0	0	0	111.4	R377 E378 C379 L455 I456 T461 R462	R377-D458 IonicContact CZ-OD1 3.57Å; R377-D458 IonicContact NE-OD1 3.57Å; R377-D458 PolarHBondContact NE-OD1 3.03Å; R377-D458 IonicContact NE-OD2 3.62Å; R377-D458 IonicContact NH2-OD1 3.42Å; R377-D458 PolarHBondContact NH2-OD1 3.41Å; E378-D458 PolarHBondContact N-OD2 3.17Å; C379-D458 WeakPolarHBondContact CB-OD1 3.31Å; C379-D458 PolarHBondContact N-OD1 2.86Å; L455-D458 PolarHBondContact O-N 3.28Å; I456-D458 VanDerWaalsContact C-N 3.34Å; I456-D458 PolarHBondContact O-N 3.37Å; D458-T461 PolarHBondContact O-N 3.2Å; D458-R462 PolarHBondContact O-N 2.86Å
459	V	94.4	Very high	87.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-51.9	175.4	178.6	0	0	0	0	111.2	E441 V450 L455 I456 T461 R462 Y463 L479	E441-V459 HydrophobicContact CG-CG1 3.93Å; V450-V459 HydrophobicContact CG1-CG2 4.18Å; L455-V459 PolarHBondContact O-N 2.9Å; I456-V459 HydrophobicContact CD1-CG2 4.38Å; I456-V459 PolarHBondContact O-N 3.02Å; V459-T461 VanDerWaalsContact C-N 3.29Å; V459-T461 PolarHBondContact O-N 3.06Å; V459-R462 WeakPolarHBondContact O-CB 3.31Å; V459-R462 PolarHBondContact O-N 2.79Å; V459-R462 VanDerWaalsContact O-N 3.12Å; V459-Y463 HydrophobicContact CG1-CE1 3.81Å; V459-Y463 HydrophobicContact CG1-CE2 4.27Å; V459-Y463 WeakPolarHBondContact O-CD1 3.08Å; V459-Y463 PolarHBondContact O-N 3.34Å; V459-L479 HydrophobicContact CG1-CD1 4.38Å
460	L	92.6	Very high	85.8	Confident	42 Å²	42	45.9 Å²	45.9	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-36.3	178.8	-65.9	176.9	0	0	0	112	C397 I411 I456 R462 Y463 E464	C397-L460 HydrophobicContact CB-CD1 4.47Å; I411-L460 HydrophobicContact CD1-CD1 3.95Å; I456-L460 HydrophobicContact CG2-CD1 4.15Å; I456-L460 HydrophobicContact CG2-CG 4.15Å; I456-L460 WeakPolarHBondContact O-CG 3.49Å; I456-L460 PolarHBondContact O-N 3.35Å; L460-R462 VanDerWaalsContact C-N 3.35Å; L460-Y463 HydrophobicContact CD2-CD2 4.18Å; L460-Y463 HydrophobicContact CD2-CE2 4.29Å; L460-Y463 WeakPolarHBondContact O-CB 3.41Å; L460-Y463 PolarHBondContact O-N 2.83Å; L460-E464 PolarHBondContact O-N 3.24Å
461	T	92.7	Very high	83.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-71.1	-29.7	176.4	-46.7	0	0	0	0	112.3	C379 V380 S382 A457 D458 V459 Y463 E464 N465	C379-T461 HydrophobicContact CB-CG2 4.15Å; V380-T461 VanDerWaalsContact O-CG2 3.27Å; V380-T461 WeakPolarHBondContact O-CG2 3.38Å; S382-T461 WeakPolarHBondContact CB-OG1 3.49Å; S382-T461 PolarHBondContact N-OG1 3.44Å; A457-T461 WeakPolarHBondContact O-CB 3.34Å; A457-T461 PolarHBondContact O-N 2.81Å; A457-T461 VanDerWaalsContact O-N 3.14Å; A457-T461 PolarHBondContact O-OG1 3.14Å; D458-T461 PolarHBondContact O-N 3.2Å; V459-T461 VanDerWaalsContact C-N 3.29Å; V459-T461 PolarHBondContact O-N 3.06Å; T461-Y463 VanDerWaalsContact C-N 3.31Å; T461-Y463 PolarHBondContact O-N 3.14Å; T461-E464 PolarHBondContact O-N 2.72Å; T461-N465 PolarHBondContact O-N 3.24Å; T461-N465 VanDerWaalsContact O-N 3.14Å; T461-N465 PolarHBondContact O-ND2 3.34Å
462	R	90.2	Very high	82.1	Confident	58 Å²	58	56.8 Å²	56.8	22%	0.219	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-35.7	169.7	-75	-164.9	-77.7	94.3	-1.6	111.9	E441 D458 V459 L460 N465 F466	E441-R462 IonicContact OE1-CZ 3.76Å; E441-R462 IonicContact OE1-NH1 3.25Å; E441-R462 PolarHBondContact OE1-NH1 2.93Å; E441-R462 IonicContact OE1-NH2 3.42Å; E441-R462 PolarHBondContact OE1-NH2 2.8Å; E441-R462 IonicContact OE2-CZ 3.11Å; E441-R462 IonicContact OE2-NH1 2.71Å; E441-R462 PolarHBondContact OE2-NH1 3.24Å; E441-R462 IonicContact OE2-NH2 3.6Å; D458-R462 PolarHBondContact O-N 2.86Å; V459-R462 WeakPolarHBondContact O-CB 3.31Å; V459-R462 PolarHBondContact O-N 2.79Å; V459-R462 VanDerWaalsContact O-N 3.12Å; L460-R462 VanDerWaalsContact C-N 3.35Å; R462-N465 CarbonylContact O-C 3.58Å; R462-N465 WeakPolarHBondContact O-CA 3.36Å; R462-N465 WeakPolarHBondContact O-CB 3.47Å; R462-N465 PolarHBondContact O-N 2.92Å; R462-N465 VanDerWaalsContact O-N 3.11Å; R462-F466 HydrophobicContact CB-CE2 4.04Å; R462-F466 HydrophobicContact CB-CZ 4.45Å; R462-F466 WeakPolarHBondContact O-CD2 3.4Å; R462-F466 WeakPolarHBondContact O-CG 3.44Å; R462-F466 PolarHBondContact O-N 2.93Å
463	Y	87.9	Confident	80.2	Confident	19 Å²	19	60.9 Å²	60.9	8%	0.075	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-40.4	176	-59	-8.3	0	0	0	112.9	E441 V459 L460 T461 N465 F466 T467 W477 K478 L479	E441-Y463 WeakPolarHBondContact CA-OH 3.12Å; E441-Y463 HydrophobicContact CB-CE1 4.21Å; E441-Y463 WeakPolarHBondContact CB-OH 3.29Å; E441-Y463 HydrophobicContact CG-CE1 4.33Å; E441-Y463 WeakPolarHBondContact CG-OH 3.35Å; V459-Y463 HydrophobicContact CG1-CE1 3.81Å; V459-Y463 HydrophobicContact CG1-CE2 4.27Å; V459-Y463 WeakPolarHBondContact O-CD1 3.08Å; V459-Y463 PolarHBondContact O-N 3.34Å; L460-Y463 HydrophobicContact CD2-CD2 4.18Å; L460-Y463 HydrophobicContact CD2-CE2 4.29Å; L460-Y463 WeakPolarHBondContact O-CB 3.41Å; L460-Y463 PolarHBondContact O-N 2.83Å; T461-Y463 VanDerWaalsContact C-N 3.31Å; T461-Y463 PolarHBondContact O-N 3.14Å; Y463-N465 PolarHBondContact O-N 2.83Å; Y463-F466 PolarHBondContact O-N 3.37Å; Y463-F466 VanDerWaalsContact O-N 3.15Å; Y463-T467 WeakPolarHBondContact O-CG2 3.31Å; Y463-T467 PolarHBondContact O-N 2.93Å; Y463-T467 PolarHBondContact O-OG1 2.83Å; Y463-W477 HydrophobicContact CD1-CB 3.68Å; Y463-W477 HydrophobicContact CD1-CD2 4.23Å; Y463-W477 HydrophobicContact CD1-CE3 4.15Å; Y463-W477 HydrophobicContact CD1-CG 4.06Å; Y463-W477 HydrophobicContact CD2-CB 3.9Å; Y463-W477 HydrophobicContact CE1-CB 4.1Å; Y463-W477 HydrophobicContact CE1-CD2 4.41Å; Y463-W477 AromaticContact CE1-CE3 3.88Å; Y463-W477 HydrophobicContact CE1-CE3 3.88Å; Y463-W477 HydrophobicContact CE2-CB 4.28Å; Y463-W477 HydrophobicContact CG-CB 3.58Å; Y463-W477 HydrophobicContact CG-CG 4.34Å; Y463-K478 PolarHBondContact OH-O 3.44Å; Y463-L479 HydrophobicContact CE2-CB 4.41Å
464	E	83.1	Confident	78.2	Confident	63 Å²	63	59.1 Å²	59.1	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-58.9	-37.5	170.4	-173.8	176.2	-162.2	0	0	111.3	S382 W383 L460 T461 F466 T467 T468	S382-E464 VanDerWaalsContact CA-OE2 3.23Å; S382-E464 WeakPolarHBondContact CA-OE2 3.45Å; S382-E464 WeakPolarHBondContact CB-OE2 3.32Å; W383-E464 WeakPolarHBondContact CB-OE1 3.31Å; W383-E464 PolarHBondContact N-OE2 2.83Å; L460-E464 PolarHBondContact O-N 3.24Å; T461-E464 PolarHBondContact O-N 2.72Å; E464-F466 PolarHBondContact O-N 2.82Å; E464-T467 PolarHBondContact O-OG1 2.91Å; E464-T468 WeakPolarHBondContact O-CG2 3.16Å; E464-T468 PolarHBondContact O-OG1 3.28Å
465	N	80.6	Confident	76.5	Confident	59 Å²	59	58 Å²	58	32%	0.316	30%	0.302	S	S	.	.	H	α-helix	trans	-77.7	-9.7	177.1	-81.6	-80.7	0	0	0	115.1	T461 R462 Y463 K469	T461-N465 PolarHBondContact O-N 3.24Å; T461-N465 VanDerWaalsContact O-N 3.14Å; T461-N465 PolarHBondContact O-ND2 3.34Å; R462-N465 CarbonylContact O-C 3.58Å; R462-N465 WeakPolarHBondContact O-CA 3.36Å; R462-N465 WeakPolarHBondContact O-CB 3.47Å; R462-N465 PolarHBondContact O-N 2.92Å; R462-N465 VanDerWaalsContact O-N 3.11Å; Y463-N465 PolarHBondContact O-N 2.83Å; N465-K469 VanDerWaalsContact O-CD 3.29Å; N465-K469 WeakPolarHBondContact O-CD 3.4Å; N465-K469 VanDerWaalsContact O-CE 3.23Å; N465-K469 WeakPolarHBondContact O-CE 3.2Å; N465-K469 PolarHBondContact O-NZ 3.26Å
466	F	78.6	Confident	75.7	Confident	62 Å²	62	63.2 Å²	63.2	27%	0.272	33%	0.326	S	S	.	.	H	α-helix	trans	-100.1	-44.6	173.5	-63.2	-45	0	0	0	112	R462 Y463 E464 T468 K469 E470 W477	R462-F466 HydrophobicContact CB-CE2 4.04Å; R462-F466 HydrophobicContact CB-CZ 4.45Å; R462-F466 WeakPolarHBondContact O-CD2 3.4Å; R462-F466 WeakPolarHBondContact O-CG 3.44Å; R462-F466 PolarHBondContact O-N 2.93Å; Y463-F466 PolarHBondContact O-N 3.37Å; Y463-F466 VanDerWaalsContact O-N 3.15Å; E464-F466 PolarHBondContact O-N 2.82Å; F466-T468 PolarHBondContact O-N 3.4Å; F466-T468 VanDerWaalsContact O-N 3.09Å; F466-K469 PolarHBondContact O-N 3.09Å; F466-E470 PolarHBondContact O-N 3.11Å; F466-E470 VanDerWaalsContact O-N 3.1Å; F466-W477 AromaticContact CD2-CD2 3.98Å; F466-W477 HydrophobicContact CD2-CD2 3.98Å; F466-W477 AromaticContact CD2-CE2 3.58Å; F466-W477 HydrophobicContact CD2-CG 4.36Å; F466-W477 HydrophobicContact CD2-CH2 4.43Å; F466-W477 AromaticContact CD2-CZ2 3.83Å; F466-W477 HydrophobicContact CD2-CZ2 3.83Å; F466-W477 AromaticContact CD2-NE1 3.76Å; F466-W477 HydrophobicContact CE2-CH2 4.31Å; F466-W477 HydrophobicContact CE2-CZ2 4.1Å; F466-W477 HydrophobicContact CG-CZ2 4.32Å; F466-W477 AromaticContact CG-NE1 3.87Å
467	T	69.3	Low	75.2	Confident	71 Å²	71	64.8 Å²	64.8	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-56.5	-26.3	176	48	0	0	0	0	113.9	Y463 E464 K469 S475	Y463-T467 WeakPolarHBondContact O-CG2 3.31Å; Y463-T467 PolarHBondContact O-N 2.93Å; Y463-T467 PolarHBondContact O-OG1 2.83Å; E464-T467 PolarHBondContact O-OG1 2.91Å; T467-K469 VanDerWaalsContact C-N 3.33Å; T467-S475 VanDerWaalsContact CG2-O 3.25Å; T467-S475 WeakPolarHBondContact CG2-O 3.21Å
468	T	62.6	Low	75	Confident	97 Å²	97	68.2 Å²	68.2	60%	0.595	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.1	175.4	44.4	0	0	0	0	114.9	E464 F466	E464-T468 WeakPolarHBondContact O-CG2 3.16Å; E464-T468 PolarHBondContact O-OG1 3.28Å; F466-T468 PolarHBondContact O-N 3.4Å; F466-T468 VanDerWaalsContact O-N 3.09Å
469	K	60.7	Low	75.1	Confident	152 Å²	152	68 Å²	68	66%	0.661	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	-28.8	-175.1	-62.5	175.6	-171.9	134.7	0	114	N465 F466 T467	N465-K469 VanDerWaalsContact O-CD 3.29Å; N465-K469 WeakPolarHBondContact O-CD 3.4Å; N465-K469 VanDerWaalsContact O-CE 3.23Å; N465-K469 WeakPolarHBondContact O-CE 3.2Å; N465-K469 PolarHBondContact O-NZ 3.26Å; F466-K469 PolarHBondContact O-N 3.09Å; T467-K469 VanDerWaalsContact C-N 3.33Å
470	E	57.9	Low	75.2	Confident	78 Å²	78	68.4 Å²	68.4	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-102.2	148.7	-174.4	-63.2	179.4	143.1	0	0	112.1	F466 S475 W477	F466-E470 PolarHBondContact O-N 3.11Å; F466-E470 VanDerWaalsContact O-N 3.1Å; E470-S475 VanDerWaalsContact C-OG 3.24Å; E470-S475 WeakPolarHBondContact CB-OG 3.47Å; E470-S475 PolarHBondContact O-OG 3.2Å; E470-W477 PolarHBondContact OE2-NE1 2.77Å
471	S	53.1	Low	75.4	Confident	75 Å²	75	66.4 Å²	66.4	52%	0.524	34%	0.337	S	S	.	.			trans	-69.5	135.4	-179.7	52.9	0	0	0	0	112.4	S473 Q474 S475	S471-S473 PolarHBondContact O-N 3.11Å; S471-Q474 PolarHBondContact O-N 3.36Å; S471-S475 PolarHBondContact O-OG 3.16Å
472	E	55.7	Low	75.6	Confident	194 Å²	194	66.6 Å²	66.6	91%	0.907	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.1	-32.9	-165.6	-60.2	179.6	145.4	0	0	117	Q474	E472-Q474 PolarHBondContact O-N 3.04Å
473	S	51.6	Low	75.9	Confident	109 Å²	109	64.3 Å²	64.3	76%	0.762	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.5	-178.9	53.7	0	0	0	0	115.7	S471	S471-S473 PolarHBondContact O-N 3.11Å
474	Q	52.5	Low	76.2	Confident	93 Å²	93	64.8 Å²	64.8	44%	0.435	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-16.6	177.1	-69.5	-179	-29.7	0	0	112.9	S471 E472 Q476	S471-Q474 PolarHBondContact O-N 3.36Å; E472-Q474 PolarHBondContact O-N 3.04Å; Q474-Q476 PolarHBondContact O-N 3.35Å
475	S	57.5	Low	76.8	Confident	9 Å²	9	61.8 Å²	61.8	6%	0.063	32%	0.318	C	S	.	.			trans	-85.3	0.7	-158	-42.3	0	0	0	0	116.7	T467 E470 S471 W477	T467-S475 VanDerWaalsContact CG2-O 3.25Å; T467-S475 WeakPolarHBondContact CG2-O 3.21Å; E470-S475 VanDerWaalsContact C-OG 3.24Å; E470-S475 WeakPolarHBondContact CB-OG 3.47Å; E470-S475 PolarHBondContact O-OG 3.2Å; S471-S475 PolarHBondContact O-OG 3.16Å; S475-W477 VanDerWaalsContact C-N 3.3Å; S475-W477 PolarHBondContact O-N 3.04Å
476	Q	79.7	Confident	77.5	Confident	136 Å²	136	59.9 Å²	59.9	64%	0.636	31%	0.308	S	S	*	.			trans	-81	74.9	-177	-160.9	-174.6	46.5	0	0	112.7	Q474 K478	Q474-Q476 PolarHBondContact O-N 3.35Å; Q476-K478 VanDerWaalsContact CD-CE 3.41Å
477	W	88.1	Confident	78.3	Confident	33 Å²	33	58.4 Å²	58.4	13%	0.125	30%	0.303	C	S	.	.			trans	-60.7	137.6	168.8	-71.8	89.2	0	0	0	112.1	E441 Q442 N443 W446 Y463 F466 E470 S475	E441-W477 HydrophobicContact CB-CZ3 4.44Å; Q442-W477 CarbonylContact O-C 3.57Å; Q442-W477 WeakPolarHBondContact O-CA 3.39Å; N443-W477 HydrophobicContact CB-CD2 4.07Å; N443-W477 HydrophobicContact CB-CE3 4.25Å; N443-W477 HydrophobicContact CB-CG 4.46Å; N443-W477 WeakPolarHBondContact ND2-CH2 3.32Å; N443-W477 WeakPolarHBondContact ND2-CZ2 3.38Å; W446-W477 HydrophobicContact CD2-CH2 4.36Å; W446-W477 AromaticContact CE3-CH2 3.69Å; W446-W477 HydrophobicContact CE3-CH2 3.69Å; W446-W477 AromaticContact CE3-CZ3 3.58Å; W446-W477 HydrophobicContact CE3-CZ3 3.58Å; W446-W477 AromaticContact CZ3-CH2 3.87Å; W446-W477 HydrophobicContact CZ3-CH2 3.87Å; W446-W477 AromaticContact CZ3-CZ3 3.56Å; W446-W477 HydrophobicContact CZ3-CZ3 3.56Å; Y463-W477 HydrophobicContact CD1-CB 3.68Å; Y463-W477 HydrophobicContact CD1-CD2 4.23Å; Y463-W477 HydrophobicContact CD1-CE3 4.15Å; Y463-W477 HydrophobicContact CD1-CG 4.06Å; Y463-W477 HydrophobicContact CD2-CB 3.9Å; Y463-W477 HydrophobicContact CE1-CB 4.1Å; Y463-W477 HydrophobicContact CE1-CD2 4.41Å; Y463-W477 AromaticContact CE1-CE3 3.88Å; Y463-W477 HydrophobicContact CE1-CE3 3.88Å; Y463-W477 HydrophobicContact CE2-CB 4.28Å; Y463-W477 HydrophobicContact CG-CB 3.58Å; Y463-W477 HydrophobicContact CG-CG 4.34Å; F466-W477 AromaticContact CD2-CD2 3.98Å; F466-W477 HydrophobicContact CD2-CD2 3.98Å; F466-W477 AromaticContact CD2-CE2 3.58Å; F466-W477 HydrophobicContact CD2-CG 4.36Å; F466-W477 HydrophobicContact CD2-CH2 4.43Å; F466-W477 AromaticContact CD2-CZ2 3.83Å; F466-W477 HydrophobicContact CD2-CZ2 3.83Å; F466-W477 AromaticContact CD2-NE1 3.76Å; F466-W477 HydrophobicContact CE2-CH2 4.31Å; F466-W477 HydrophobicContact CE2-CZ2 4.1Å; F466-W477 HydrophobicContact CG-CZ2 4.32Å; F466-W477 AromaticContact CG-NE1 3.87Å; E470-W477 PolarHBondContact OE2-NE1 2.77Å; S475-W477 VanDerWaalsContact C-N 3.3Å; S475-W477 PolarHBondContact O-N 3.04Å
478	K	91.8	Very high	79.3	Confident	72 Å²	72	56.7 Å²	56.7	31%	0.313	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.7	-176.8	-70.3	172	-173.1	164.5	0	111	Q442 Y463 Q476	Q442-K478 PolarHBondContact N-O 3.02Å; Q442-K478 PolarHBondContact O-N 3.24Å; Y463-K478 PolarHBondContact OH-O 3.44Å; Q476-K478 VanDerWaalsContact CD-CE 3.41Å
479	L	96.2	Very high	80.7	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	116.8	168.9	-175.1	65.5	0	0	0	108.5	V399 H400 L439 Y440 V450 I456 V459 Y463	V399-L479 HydrophobicContact CG2-CD2 4.26Å; H400-L479 PolarHBondContact N-O 2.59Å; L439-L479 HydrophobicContact CB-CD1 4.03Å; L439-L479 HydrophobicContact CD1-CD1 4.48Å; L439-L479 HydrophobicContact CD2-CD1 4.43Å; L439-L479 HydrophobicContact CD2-CG 4.22Å; Y440-L479 WeakPolarHBondContact O-CA 3.36Å; V450-L479 HydrophobicContact CG2-CD1 3.93Å; I456-L479 HydrophobicContact CD1-CD2 4.19Å; I456-L479 HydrophobicContact CG2-CD2 3.79Å; V459-L479 HydrophobicContact CG1-CD1 4.38Å; Y463-L479 HydrophobicContact CE2-CB 4.41Å
480	C	96.6	Very high	82.1	Confident	10 Å²	10	51.9 Å²	51.9	7%	0.068	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.5	-171.4	-64.7	0	0	0	0	111.6	H400 L439 Y440 Q442 K482	H400-C480 CarbonylContact O-C 3.54Å; H400-C480 WeakPolarHBondContact O-CA 3.33Å; L439-C480 CarbonylContact C-O 3.56Å; L439-C480 WeakPolarHBondContact CA-O 3.32Å; Y440-C480 PolarHBondContact N-O 3.08Å; Y440-C480 PolarHBondContact O-N 2.86Å; Q442-C480 PolarHBondContact OE1-SG 2.83Å; C480-K482 HydrophobicContact CB-CD 4.17Å; C480-K482 HydrophobicContact CB-CG 4.09Å
481	F	98	Very high	83.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	109.1	171.7	177.4	-100.8	0	0	0	109.4	V399 H400 Y401 P402 V421 M424 Q425 L428 L430 F437 A438 L439 F501	V399-F481 HydrophobicContact CG1-CB 3.73Å; H400-F481 PolarHBondContact O-N 3.44Å; Y401-F481 WeakPolarHBondContact CB-O 3.28Å; P402-F481 WeakPolarHBondContact CD-O 3.24Å; V421-F481 HydrophobicContact CB-CE2 4.38Å; V421-F481 HydrophobicContact CG1-CE2 4.14Å; V421-F481 HydrophobicContact CG2-CE2 4.49Å; M424-F481 HydrophobicContact CB-CD1 4.11Å; M424-F481 HydrophobicContact CB-CD2 3.62Å; M424-F481 HydrophobicContact CB-CE1 4.06Å; M424-F481 HydrophobicContact CB-CE2 3.56Å; M424-F481 HydrophobicContact CB-CG 3.9Å; M424-F481 HydrophobicContact CB-CZ 3.79Å; M424-F481 HydrophobicContact CE-CB 3.84Å; M424-F481 HydrophobicContact CE-CD1 3.97Å; M424-F481 HydrophobicContact CE-CG 3.97Å; M424-F481 HydrophobicContact CG-CB 4.42Å; M424-F481 HydrophobicContact CG-CD2 4.02Å; M424-F481 HydrophobicContact CG-CE2 4.44Å; M424-F481 HydrophobicContact CG-CG 4.15Å; Q425-F481 HydrophobicContact CG-CE2 4.34Å; Q425-F481 HydrophobicContact CG-CZ 3.81Å; L428-F481 HydrophobicContact CD1-CD1 4.15Å; L428-F481 HydrophobicContact CD1-CE1 4.08Å; L430-F481 HydrophobicContact CD1-CE1 3.81Å; L430-F481 HydrophobicContact CD1-CZ 4.33Å; F437-F481 HydrophobicContact CB-CD2 4.34Å; F437-F481 HydrophobicContact CB-CE1 4.17Å; F437-F481 HydrophobicContact CB-CE2 3.51Å; F437-F481 HydrophobicContact CB-CZ 3.41Å; F437-F481 VanDerWaalsContact CB-CZ 3.41Å; F437-F481 AromaticContact CD1-CE1 3.85Å; F437-F481 HydrophobicContact CD1-CE1 3.85Å; F437-F481 AromaticContact CD1-CZ 3.86Å; F437-F481 HydrophobicContact CD1-CZ 3.86Å; F437-F481 HydrophobicContact CD2-CZ 4.34Å; F437-F481 HydrophobicContact CG-CE1 4.1Å; F437-F481 HydrophobicContact CG-CE2 4.24Å; F437-F481 AromaticContact CG-CZ 3.61Å; F437-F481 HydrophobicContact CG-CZ 3.61Å; A438-F481 WeakPolarHBondContact O-CA 3.18Å; L439-F481 HydrophobicContact CD2-CB 3.94Å; L439-F481 HydrophobicContact CD2-CD2 4.24Å; F481-F501 AromaticContact CD1-CE2 3.72Å; F481-F501 HydrophobicContact CD1-CE2 3.72Å; F481-F501 HydrophobicContact CD1-CZ 4.22Å; F481-F501 AromaticContact CE1-CE2 3.79Å; F481-F501 HydrophobicContact CE1-CE2 3.79Å; F481-F501 HydrophobicContact CE1-CZ 4.49Å
482	K	96.2	Very high	85.6	Confident	5 Å²	5	47.8 Å²	47.8	2%	0.022	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.2	-173.1	-55.5	179.8	81.4	156.3	0	110.5	P402 F437 A438 Y440 E447 C480 E508	P402-K482 HydrophobicContact CG-CG 4.37Å; F437-K482 WeakPolarHBondContact CA-O 3.23Å; A438-K482 PolarHBondContact N-O 3.15Å; A438-K482 PolarHBondContact O-N 2.96Å; Y440-K482 HydrophobicContact CD1-CD 4.49Å; Y440-K482 HydrophobicContact CD2-CB 3.81Å; Y440-K482 HydrophobicContact CD2-CD 3.9Å; Y440-K482 HydrophobicContact CD2-CG 4Å; Y440-K482 HydrophobicContact CE2-CB 3.89Å; Y440-K482 HydrophobicContact CE2-CD 4.43Å; Y440-K482 HydrophobicContact CG-CD 3.94Å; Y440-K482 HydrophobicContact CG-CG 4.48Å; E447-K482 IonicContact OE2-NZ 2.71Å; E447-K482 PolarHBondContact OE2-NZ 2.86Å; C480-K482 HydrophobicContact CB-CD 4.17Å; C480-K482 HydrophobicContact CB-CG 4.09Å; K482-E508 VanDerWaalsContact CE-OE2 3.27Å; K482-E508 WeakPolarHBondContact CE-OE2 3.35Å; K482-E508 IonicContact NZ-OE1 2.72Å; K482-E508 PolarHBondContact NZ-OE1 3.19Å; K482-E508 IonicContact NZ-OE2 2.74Å; K482-E508 PolarHBondContact NZ-OE2 3.09Å
483	L	96.1	Very high	87.4	Confident	11 Å²	11	41.9 Å²	41.9	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.4	167.9	-164.8	71.5	0	0	0	109	N435 F437 L486 E498 L502 Q505	N435-L483 HydrophobicContact CB-CD1 3.79Å; F437-L483 HydrophobicContact CD1-CB 4.5Å; F437-L483 HydrophobicContact CD1-CD1 3.85Å; F437-L483 HydrophobicContact CE1-CD1 3.34Å; F437-L483 HydrophobicContact CE2-CD1 4.4Å; F437-L483 HydrophobicContact CZ-CD1 3.65Å; L483-L486 HydrophobicContact CD2-CD1 3.83Å; L483-E498 HydrophobicContact CD1-CG 4.48Å; L483-L502 HydrophobicContact CD2-CD1 4.25Å; L483-Q505 VanDerWaalsContact CB-OE1 3.3Å; L483-Q505 PolarHBondContact O-NE2 3.05Å
484	Y	95.4	Very high	89.4	Confident	28 Å²	28	38.7 Å²	38.7	11%	0.11	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-51.7	-167.9	-175.9	-135.9	0	0	0	113.4	T436 A438 Y440 P449 L739 A742	T436-Y484 PolarHBondContact O-N 3.44Å; A438-Y484 HydrophobicContact CB-CD1 3.81Å; A438-Y484 HydrophobicContact CB-CD2 4.09Å; A438-Y484 HydrophobicContact CB-CE1 4.4Å; A438-Y484 HydrophobicContact CB-CG 3.63Å; Y440-Y484 HydrophobicContact CE2-CD2 4.41Å; Y440-Y484 WeakPolarHBondContact OH-CD2 3.39Å; P449-Y484 HydrophobicContact CB-CE2 4.38Å; Y484-L739 HydrophobicContact CD2-CD1 3.9Å; Y484-L739 HydrophobicContact CE1-CD1 4.44Å; Y484-L739 HydrophobicContact CE2-CB 4.43Å; Y484-L739 HydrophobicContact CE2-CD1 3.56Å; Y484-L739 HydrophobicContact CG-CD1 4.48Å; Y484-L739 WeakPolarHBondContact OH-CA 3.48Å; Y484-L739 PolarHBondContact OH-N 3.17Å; Y484-A742 HydrophobicContact CD1-CB 4.18Å; Y484-A742 HydrophobicContact CE1-CB 3.48Å; Y484-A742 VanDerWaalsContact CE1-CB 3.48Å
485	C	95.4	Very high	91.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	112.3	170.4	-56.5	0	0	0	0	109.7	N435 T436 L487 Y743	N435-C485 WeakPolarHBondContact CB-O 3.32Å; T436-C485 HydrophobicContact CG2-CB 4.04Å; T436-C485 PolarHBondContact N-O 3.28Å; T436-C485 VanDerWaalsContact N-O 3.08Å; T436-C485 PolarHBondContact O-N 3.05Å; T436-C485 WeakPolarHBondContact OG1-CB 3.42Å; T436-C485 PolarHBondContact OG1-N 3.06Å; T436-C485 PolarHBondContact OG1-SG 2.73Å; C485-L487 HydrophobicContact CB-CD1 4.17Å; C485-L487 HydrophobicContact CB-CG 4.17Å; C485-L487 PolarHBondContact O-N 3.31Å; C485-Y743 HydrophobicContact CB-CD1 3.7Å; C485-Y743 HydrophobicContact CB-CE1 3.45Å; C485-Y743 VanDerWaalsContact CB-CE1 3.45Å; C485-Y743 HydrophobicContact CB-CG 4.33Å
486	L	95.4	Very high	92.9	Very high	19 Å²	19	40.9 Å²	40.9	10%	0.099	23%	0.231	C	C	.	.			trans	-87.1	102.9	172.5	-173.9	68.5	0	0	0	109	L483 A489 I492 L502 F657 A684 Y743	L483-L486 HydrophobicContact CD2-CD1 3.83Å; L486-A489 HydrophobicContact CD1-CB 4Å; L486-A489 HydrophobicContact CD2-CB 3.8Å; L486-A489 HydrophobicContact CG-CB 4.02Å; L486-I492 HydrophobicContact CD1-CD1 3.92Å; L486-L502 HydrophobicContact CD1-CD1 4.24Å; L486-L502 HydrophobicContact CD2-CD1 3.87Å; L486-F657 HydrophobicContact CD2-CD1 4.3Å; L486-F657 HydrophobicContact CD2-CE1 3.85Å; L486-A684 VanDerWaalsContact O-CB 3.29Å; L486-A684 WeakPolarHBondContact O-CB 3.43Å; L486-Y743 PolarHBondContact N-OH 3.15Å
487	L	93.8	Very high	93.7	Very high	32 Å²	32	36.5 Å²	36.5	17%	0.168	21%	0.212	C	C	.	.	S	Bend	trans	-106.6	-31.1	-173.8	-64.4	157.7	0	0	0	112.3	K434 N435 T436 C485 A684 Y743 A746 I747	K434-L487 VanDerWaalsContact O-CD1 3.31Å; K434-L487 WeakPolarHBondContact O-CD1 3.47Å; N435-L487 WeakPolarHBondContact OD1-CA 3.49Å; N435-L487 PolarHBondContact OD1-N 2.62Å; T436-L487 HydrophobicContact CG2-CD1 4.06Å; C485-L487 HydrophobicContact CB-CD1 4.17Å; C485-L487 HydrophobicContact CB-CG 4.17Å; C485-L487 PolarHBondContact O-N 3.31Å; L487-A684 HydrophobicContact CD2-CB 3.86Å; L487-Y743 HydrophobicContact CD2-CD1 3.87Å; L487-Y743 HydrophobicContact CD2-CE1 4.2Å; L487-A746 HydrophobicContact CD1-CB 3.45Å; L487-A746 VanDerWaalsContact CD1-CB 3.45Å; L487-A746 HydrophobicContact CD2-CB 4.3Å; L487-I747 HydrophobicContact CD2-CG1 3.96Å
488	D	91.8	Very high	94.1	Very high	35 Å²	35	35.8 Å²	35.8	19%	0.187	21%	0.21	C	C	.	.			trans	-140.1	107.4	170.6	-175.4	-5.3	0	0	0	108.7	K434 N435 D490 G491 I492	K434-D488 HydrophobicContact CB-CB 4.19Å; K434-D488 HydrophobicContact CD-CB 3.82Å; K434-D488 VanDerWaalsContact CD-OD2 3.27Å; K434-D488 WeakPolarHBondContact CD-OD2 3.29Å; K434-D488 WeakPolarHBondContact CE-OD2 3.18Å; K434-D488 IonicContact NZ-OD2 3.79Å; K434-D488 PolarHBondContact NZ-OD2 3.24Å; N435-D488 PolarHBondContact ND2-O 3.47Å; N435-D488 PolarHBondContact OD1-N 3.2Å; N435-D488 PolarHBondContact OD1-O 3.15Å; D488-D490 PolarHBondContact OD1-N 2.98Å; D488-G491 PolarHBondContact OD1-N 3.32Å; D488-I492 WeakPolarHBondContact O-CG1 3.44Å
489	A	90.6	Very high	94.3	Very high	17 Å²	17	33 Å²	33	14%	0.14	20%	0.198	C	C	.	.	S	Bend	trans	-91.4	-25.7	-179.9	0	0	0	0	0	113.1	L486 R652 F657	L486-A489 HydrophobicContact CD1-CB 4Å; L486-A489 HydrophobicContact CD2-CB 3.8Å; L486-A489 HydrophobicContact CG-CB 4.02Å; A489-R652 VanDerWaalsContact O-CZ 3.26Å; A489-R652 PolarHBondContact O-NH1 3.2Å; A489-R652 PolarHBondContact O-NH2 3.28Å; A489-F657 HydrophobicContact CB-CE1 4.42Å
490	D	89.9	Confident	94.3	Very high	131 Å²	131	35.5 Å²	35.5	70%	0.701	21%	0.211	S	C	*	.	S	Bend	trans	-91.5	-25.4	-173.7	-61.1	-49	0	0	0	111.9	D488 I492 R652	D488-D490 PolarHBondContact OD1-N 2.98Å; D490-I492 VanDerWaalsContact C-N 3.28Å; D490-I492 PolarHBondContact O-N 2.99Å; D490-R652 IonicContact OD1-CZ 3.51Å; D490-R652 IonicContact OD1-NH1 3.53Å; D490-R652 PolarHBondContact OD1-NH1 2.94Å
491	G	90.8	Very high	94.3	Very high	55 Å²	55	35 Å²	35	57%	0.567	21%	0.208	S	C	*	.	S	Bend	trans	-76.3	-4	171.4	0	0	0	0	0	115.5	D488 S493	D488-G491 PolarHBondContact OD1-N 3.32Å; G491-S493 PolarHBondContact O-N 3.4Å
492	I	95	Very high	94.3	Very high	12 Å²	12	35.6 Å²	35.6	6%	0.062	21%	0.21	C	C	.	.	S	Bend	trans	-76.5	118.6	179.2	-54.8	170.6	0	0	0	109.5	L486 D488 D490 V494 E498 Y499 L502	L486-I492 HydrophobicContact CD1-CD1 3.92Å; D488-I492 WeakPolarHBondContact O-CG1 3.44Å; D490-I492 VanDerWaalsContact C-N 3.28Å; D490-I492 PolarHBondContact O-N 2.99Å; I492-V494 PolarHBondContact O-N 3.3Å; I492-E498 HydrophobicContact CD1-CG 4.26Å; I492-E498 HydrophobicContact CG1-CG 4.4Å; I492-E498 HydrophobicContact CG2-CB 3.87Å; I492-E498 HydrophobicContact CG2-CG 3.85Å; I492-Y499 HydrophobicContact CB-CD2 4.26Å; I492-Y499 HydrophobicContact CG2-CD2 3.91Å; I492-Y499 HydrophobicContact CG2-CG 4.46Å; I492-L502 HydrophobicContact CD1-CD2 3.92Å
493	S	93.8	Very high	94.3	Very high	69 Å²	69	35.3 Å²	35.3	48%	0.483	21%	0.209	S	C	.	.			trans	-63.4	128.6	177.3	179.6	0	0	0	0	111.6	G491 D495 S496 Y499	G491-S493 PolarHBondContact O-N 3.4Å; S493-D495 PolarHBondContact O-N 3.2Å; S493-D495 VanDerWaalsContact O-N 3.11Å; S493-S496 VanDerWaalsContact O-CB 3.26Å; S493-S496 WeakPolarHBondContact O-CB 3.33Å; S493-S496 PolarHBondContact O-N 2.81Å; S493-S496 PolarHBondContact O-OG 2.87Å; S493-Y499 WeakPolarHBondContact O-CB 3.27Å
494	V	91.9	Very high	94.3	Very high	43 Å²	43	35.8 Å²	35.8	26%	0.261	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.9	-178	-174.1	0	0	0	0	113	I492 S496 Y499 R641 A645	I492-V494 PolarHBondContact O-N 3.3Å; V494-S496 VanDerWaalsContact C-N 3.35Å; V494-Y499 HydrophobicContact CB-CE1 4.41Å; V494-Y499 HydrophobicContact CG1-CD1 4.11Å; V494-Y499 HydrophobicContact CG1-CE1 3.81Å; V494-Y499 HydrophobicContact CG2-CE2 4.08Å; V494-R641 HydrophobicContact CG1-CG 3.73Å; V494-A645 HydrophobicContact CG1-CB 4.5Å
495	D	90.2	Very high	94.3	Very high	112 Å²	112	36 Å²	36	60%	0.599	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	2.9	178.1	-64.4	-63.2	0	0	0	114	S493 R641	S493-D495 PolarHBondContact O-N 3.2Å; S493-D495 VanDerWaalsContact O-N 3.11Å; D495-R641 VanDerWaalsContact CG-CZ 3.49Å; D495-R641 IonicContact OD1-CZ 2.65Å; D495-R641 VanDerWaalsContact OD1-CZ 3.22Å; D495-R641 IonicContact OD1-NE 2.79Å; D495-R641 IonicContact OD1-NH1 3.32Å; D495-R641 PolarHBondContact OD1-NH1 3.42Å; D495-R641 IonicContact OD1-NH2 2.83Å; D495-R641 IonicContact OD2-CZ 2.74Å; D495-R641 IonicContact OD2-NH1 3.47Å; D495-R641 PolarHBondContact OD2-NH1 3.13Å; D495-R641 IonicContact OD2-NH2 2.68Å; D495-R641 PolarHBondContact OD2-NH2 3.45Å
496	S	94.6	Very high	94.3	Very high	35 Å²	35	36.2 Å²	36.2	25%	0.245	22%	0.215	C	C	.	.	S	Bend	trans	-91.3	153.3	-176.8	72.1	0	0	0	0	113.3	S493 V494 E498 Y499 L500	S493-S496 VanDerWaalsContact O-CB 3.26Å; S493-S496 WeakPolarHBondContact O-CB 3.33Å; S493-S496 PolarHBondContact O-N 2.81Å; S493-S496 PolarHBondContact O-OG 2.87Å; V494-S496 VanDerWaalsContact C-N 3.35Å; S496-E498 PolarHBondContact O-N 3.32Å; S496-Y499 WeakPolarHBondContact O-CB 3.47Å; S496-Y499 PolarHBondContact O-N 2.78Å; S496-Y499 VanDerWaalsContact O-N 3.09Å; S496-Y499 PolarHBondContact OG-N 2.72Å; S496-L500 PolarHBondContact O-N 2.56Å
497	I	95.3	Very high	94.4	Very high	45 Å²	45	36 Å²	36	23%	0.231	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-23.7	170.8	-168.2	168.9	0	0	0	112.5	Y401 L428 L430 Y499 L500 F501	Y401-I497 HydrophobicContact CE2-CD1 4.03Å; L428-I497 HydrophobicContact CB-CG2 4.32Å; L428-I497 HydrophobicContact CD1-CD1 4.19Å; L428-I497 HydrophobicContact CD2-CD1 4Å; L428-I497 HydrophobicContact CG-CD1 4.48Å; L428-I497 WeakPolarHBondContact O-CG2 3.48Å; L430-I497 HydrophobicContact CD1-CG2 4.37Å; L430-I497 HydrophobicContact CD2-CG2 3.84Å; L430-I497 HydrophobicContact CG-CG2 4.19Å; I497-Y499 VanDerWaalsContact C-N 3.34Å; I497-L500 WeakPolarHBondContact O-CB 3.21Å; I497-L500 PolarHBondContact O-N 2.95Å; I497-F501 HydrophobicContact CD1-CE1 3.92Å; I497-F501 HydrophobicContact CD1-CZ 4.17Å; I497-F501 HydrophobicContact CG1-CD1 4.09Å; I497-F501 HydrophobicContact CG1-CE1 3.53Å; I497-F501 HydrophobicContact CG1-CZ 4.04Å; I497-F501 WeakPolarHBondContact O-CD1 3.34Å; I497-F501 WeakPolarHBondContact O-CG 3.41Å; I497-F501 PolarHBondContact O-N 2.93Å
498	E	96.9	Very high	94.3	Very high	18 Å²	18	36.9 Å²	36.9	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-36.4	172	-169.5	171.1	-174.8	0	0	112.3	L430 S433 N435 F437 L483 I492 S496 F501 L502	L430-E498 HydrophobicContact CD2-CB 3.72Å; L430-E498 HydrophobicContact CD2-CG 4.41Å; S433-E498 WeakPolarHBondContact CB-OE2 3.41Å; S433-E498 VanDerWaalsContact OG-CD 3.25Å; S433-E498 PolarHBondContact OG-OE1 3.06Å; S433-E498 PolarHBondContact OG-OE2 3.29Å; N435-E498 WeakPolarHBondContact CB-OE1 3.15Å; N435-E498 PolarHBondContact ND2-OE1 3.32Å; F437-E498 HydrophobicContact CE1-CG 4.48Å; F437-E498 HydrophobicContact CZ-CG 4.1Å; L483-E498 HydrophobicContact CD1-CG 4.48Å; I492-E498 HydrophobicContact CD1-CG 4.26Å; I492-E498 HydrophobicContact CG1-CG 4.4Å; I492-E498 HydrophobicContact CG2-CB 3.87Å; I492-E498 HydrophobicContact CG2-CG 3.85Å; S496-E498 PolarHBondContact O-N 3.32Å; E498-F501 PolarHBondContact O-N 2.88Å; E498-L502 PolarHBondContact O-N 3.11Å
499	Y	96.5	Very high	94.3	Very high	13 Å²	13	37.2 Å²	37.2	5%	0.051	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-39.7	174.8	-157.9	-97.6	0	0	0	111.7	I492 S493 V494 S496 I497 F501 L502 F503 M644 A645 L648	I492-Y499 HydrophobicContact CB-CD2 4.26Å; I492-Y499 HydrophobicContact CG2-CD2 3.91Å; I492-Y499 HydrophobicContact CG2-CG 4.46Å; S493-Y499 WeakPolarHBondContact O-CB 3.27Å; V494-Y499 HydrophobicContact CB-CE1 4.41Å; V494-Y499 HydrophobicContact CG1-CD1 4.11Å; V494-Y499 HydrophobicContact CG1-CE1 3.81Å; V494-Y499 HydrophobicContact CG2-CE2 4.08Å; S496-Y499 WeakPolarHBondContact O-CB 3.47Å; S496-Y499 PolarHBondContact O-N 2.78Å; S496-Y499 VanDerWaalsContact O-N 3.09Å; S496-Y499 PolarHBondContact OG-N 2.72Å; I497-Y499 VanDerWaalsContact C-N 3.34Å; Y499-F501 VanDerWaalsContact C-N 3.33Å; Y499-F501 PolarHBondContact O-N 2.79Å; Y499-L502 PolarHBondContact O-N 3.22Å; Y499-F503 WeakPolarHBondContact O-CB 3.43Å; Y499-F503 PolarHBondContact O-N 2.95Å; Y499-M644 HydrophobicContact CE1-CB 4.29Å; Y499-A645 WeakPolarHBondContact OH-CA 3.39Å; Y499-L648 HydrophobicContact CD1-CD1 4.17Å; Y499-L648 HydrophobicContact CD2-CD1 4.48Å; Y499-L648 HydrophobicContact CE1-CD1 3.67Å; Y499-L648 HydrophobicContact CE2-CD1 4.03Å
500	L	95.8	Very high	94.5	Very high	56 Å²	56	36.5 Å²	36.5	29%	0.293	21%	0.211	S	C	.	.	H	α-helix	trans	-60.1	-42.2	171.2	179.5	64.9	0	0	0	111.2	S496 I497 F503 E504 M644	S496-L500 PolarHBondContact O-N 2.56Å; I497-L500 WeakPolarHBondContact O-CB 3.21Å; I497-L500 PolarHBondContact O-N 2.95Å; L500-F503 HydrophobicContact CD1-CD1 4.26Å; L500-F503 PolarHBondContact O-N 2.89Å; L500-E504 HydrophobicContact CD1-CG 3.97Å; L500-E504 HydrophobicContact CG-CG 4.3Å; L500-E504 WeakPolarHBondContact O-CB 3.34Å; L500-E504 VanDerWaalsContact O-CG 3.31Å; L500-E504 WeakPolarHBondContact O-CG 3.49Å; L500-E504 PolarHBondContact O-N 2.83Å; L500-M644 HydrophobicContact CD1-SD 4.18Å
501	F	97	Very high	94.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-43.8	177	-71.6	8.8	0	0	0	112	Y401 P402 L428 L430 F437 F481 I497 E498 Y499 F503 Q505	Y401-F501 AromaticContact CD2-CE1 3.45Å; Y401-F501 HydrophobicContact CD2-CE1 3.45Å; Y401-F501 VanDerWaalsContact CD2-CE1 3.45Å; Y401-F501 AromaticContact CD2-CZ 3.81Å; Y401-F501 HydrophobicContact CD2-CZ 3.81Å; Y401-F501 HydrophobicContact CE2-CE1 4.23Å; Y401-F501 AromaticContact CG-CE1 3.93Å; Y401-F501 HydrophobicContact CG-CE1 3.93Å; Y401-F501 AromaticContact CG-CZ 3.82Å; Y401-F501 HydrophobicContact CG-CZ 3.82Å; P402-F501 HydrophobicContact CB-CD1 4.15Å; P402-F501 HydrophobicContact CB-CG 4.44Å; P402-F501 HydrophobicContact CG-CB 4.21Å; P402-F501 HydrophobicContact CG-CD1 4.12Å; P402-F501 HydrophobicContact CG-CG 4.04Å; L428-F501 HydrophobicContact CD1-CE2 4.38Å; L428-F501 HydrophobicContact CD1-CZ 3.79Å; L430-F501 HydrophobicContact CD1-CE2 4.11Å; F437-F501 HydrophobicContact CD1-CD2 4.34Å; F437-F501 HydrophobicContact CD1-CE2 4.48Å; F437-F501 HydrophobicContact CE1-CD2 4.05Å; F437-F501 HydrophobicContact CE1-CE2 4.39Å; F481-F501 AromaticContact CD1-CE2 3.72Å; F481-F501 HydrophobicContact CD1-CE2 3.72Å; F481-F501 HydrophobicContact CD1-CZ 4.22Å; F481-F501 AromaticContact CE1-CE2 3.79Å; F481-F501 HydrophobicContact CE1-CE2 3.79Å; F481-F501 HydrophobicContact CE1-CZ 4.49Å; I497-F501 HydrophobicContact CD1-CE1 3.92Å; I497-F501 HydrophobicContact CD1-CZ 4.17Å; I497-F501 HydrophobicContact CG1-CD1 4.09Å; I497-F501 HydrophobicContact CG1-CE1 3.53Å; I497-F501 HydrophobicContact CG1-CZ 4.04Å; I497-F501 WeakPolarHBondContact O-CD1 3.34Å; I497-F501 WeakPolarHBondContact O-CG 3.41Å; I497-F501 PolarHBondContact O-N 2.93Å; E498-F501 PolarHBondContact O-N 2.88Å; Y499-F501 VanDerWaalsContact C-N 3.33Å; Y499-F501 PolarHBondContact O-N 2.79Å; F501-F503 VanDerWaalsContact C-N 3.34Å; F501-F503 PolarHBondContact O-N 2.66Å; F501-Q505 VanDerWaalsContact O-CB 3.29Å; F501-Q505 WeakPolarHBondContact O-CB 3.21Å; F501-Q505 WeakPolarHBondContact O-CG 3.48Å; F501-Q505 PolarHBondContact O-N 2.66Å
502	L	96.9	Very high	94.5	Very high	11 Å²	11	34.7 Å²	34.7	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-40.8	176.5	-176.2	62.3	0	0	0	111.8	L483 L486 I492 E498 Y499 C506 L648 F657	L483-L502 HydrophobicContact CD2-CD1 4.25Å; L486-L502 HydrophobicContact CD1-CD1 4.24Å; L486-L502 HydrophobicContact CD2-CD1 3.87Å; I492-L502 HydrophobicContact CD1-CD2 3.92Å; E498-L502 PolarHBondContact O-N 3.11Å; Y499-L502 PolarHBondContact O-N 3.22Å; L502-C506 WeakPolarHBondContact O-CB 3.45Å; L502-C506 PolarHBondContact O-N 2.92Å; L502-L648 HydrophobicContact CB-CD1 4.47Å; L502-L648 HydrophobicContact CD2-CD1 4.21Å; L502-L648 HydrophobicContact CD2-CD2 4.48Å; L502-L648 HydrophobicContact CG-CD1 4.2Å; L502-L648 HydrophobicContact CG-CD2 4.07Å; L502-F657 HydrophobicContact CD1-CE1 4.18Å; L502-F657 HydrophobicContact CD1-CZ 3.84Å; L502-F657 HydrophobicContact CD2-CE1 4.3Å; L502-F657 HydrophobicContact CD2-CZ 4.18Å; L502-F657 HydrophobicContact CG-CZ 4.14Å
503	F	97.3	Very high	94.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-51.2	176.1	167.4	-109.6	0	0	0	112.4	Y499 L500 F501 C506 H507 T532 M644 Y647 L648	Y499-F503 WeakPolarHBondContact O-CB 3.43Å; Y499-F503 PolarHBondContact O-N 2.95Å; L500-F503 HydrophobicContact CD1-CD1 4.26Å; L500-F503 PolarHBondContact O-N 2.89Å; F501-F503 VanDerWaalsContact C-N 3.34Å; F501-F503 PolarHBondContact O-N 2.66Å; F503-C506 PolarHBondContact O-N 2.8Å; F503-H507 WeakPolarHBondContact O-CB 3.28Å; F503-H507 PolarHBondContact O-N 2.99Å; F503-T532 HydrophobicContact CE1-CG2 3.62Å; F503-T532 HydrophobicContact CZ-CG2 3.61Å; F503-M644 HydrophobicContact CD1-CG 3.77Å; F503-M644 HydrophobicContact CD1-SD 3.7Å; F503-M644 HydrophobicContact CD2-CB 4.19Å; F503-M644 HydrophobicContact CD2-CG 3.92Å; F503-M644 HydrophobicContact CE1-CG 3.78Å; F503-M644 HydrophobicContact CE1-SD 4.03Å; F503-M644 HydrophobicContact CE2-CB 4.46Å; F503-M644 HydrophobicContact CE2-CG 3.95Å; F503-M644 HydrophobicContact CG-CB 4.31Å; F503-M644 HydrophobicContact CG-CG 3.83Å; F503-M644 HydrophobicContact CG-SD 4.1Å; F503-M644 HydrophobicContact CZ-CG 3.88Å; F503-Y647 AromaticContact CD2-CD1 3.75Å; F503-Y647 HydrophobicContact CD2-CD1 3.75Å; F503-Y647 HydrophobicContact CD2-CE1 4.3Å; F503-Y647 AromaticContact CD2-CG 3.93Å; F503-Y647 HydrophobicContact CD2-CG 3.93Å; F503-Y647 AromaticContact CE2-CD1 3.8Å; F503-Y647 HydrophobicContact CE2-CD1 3.8Å; F503-Y647 AromaticContact CE2-CD2 3.81Å; F503-Y647 HydrophobicContact CE2-CD2 3.81Å; F503-Y647 HydrophobicContact CE2-CE1 4.27Å; F503-Y647 HydrophobicContact CE2-CE2 4.27Å; F503-Y647 AromaticContact CE2-CG 3.57Å; F503-Y647 HydrophobicContact CE2-CG 3.57Å; F503-L648 HydrophobicContact CB-CD1 4.04Å; F503-L648 HydrophobicContact CB-CG 4.41Å
504	E	96.3	Very high	94.1	Very high	21 Å²	21	33.5 Å²	33.5	10%	0.098	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-41.7	-179.5	-67.5	-69.9	154.4	0	0	112	P402 L500 H507 E508 R529	P402-E504 HydrophobicContact CB-CB 3.53Å; P402-E504 HydrophobicContact CB-CG 4.26Å; L500-E504 HydrophobicContact CD1-CG 3.97Å; L500-E504 HydrophobicContact CG-CG 4.3Å; L500-E504 WeakPolarHBondContact O-CB 3.34Å; L500-E504 VanDerWaalsContact O-CG 3.31Å; L500-E504 WeakPolarHBondContact O-CG 3.49Å; L500-E504 PolarHBondContact O-N 2.83Å; E504-H507 PolarHBondContact O-N 3.45Å; E504-E508 PolarHBondContact O-N 3.5Å; E504-R529 VanDerWaalsContact CD-NH1 3.26Å; E504-R529 IonicContact OE1-CZ 2.66Å; E504-R529 IonicContact OE1-NH1 2.73Å; E504-R529 PolarHBondContact OE1-NH1 2.7Å; E504-R529 IonicContact OE1-NH2 2.89Å; E504-R529 IonicContact OE2-CZ 2.65Å; E504-R529 IonicContact OE2-NH1 3.66Å; E504-R529 PolarHBondContact OE2-NH1 3.46Å; E504-R529 IonicContact OE2-NH2 3.79Å; E504-R529 PolarHBondContact OE2-NH2 3.33Å
505	Q	94.9	Very high	94.2	Very high	32 Å²	32	32 Å²	32	15%	0.15	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-36.7	175.8	-72.3	179.3	-121.7	0	0	112.4	P402 L483 F501 H507 E508 M509	P402-Q505 HydrophobicContact CB-CG 4.31Å; P402-Q505 HydrophobicContact CG-CG 3.83Å; L483-Q505 VanDerWaalsContact CB-OE1 3.3Å; L483-Q505 PolarHBondContact O-NE2 3.05Å; F501-Q505 VanDerWaalsContact O-CB 3.29Å; F501-Q505 WeakPolarHBondContact O-CB 3.21Å; F501-Q505 WeakPolarHBondContact O-CG 3.48Å; F501-Q505 PolarHBondContact O-N 2.66Å; Q505-H507 VanDerWaalsContact C-N 3.25Å; Q505-H507 PolarHBondContact O-N 3.34Å; Q505-E508 PolarHBondContact O-N 2.81Å; Q505-M509 WeakPolarHBondContact O-CG 3.42Å; Q505-M509 PolarHBondContact O-N 2.93Å; Q505-M509 VanDerWaalsContact O-N 3.07Å
506	C	96	Very high	94.1	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.034	14%	0.137	C	C	.	.	H	α-helix	trans	-62.1	-36.7	171.1	-177.2	0	0	0	0	111.3	L502 F503 M509 V510 Y647 L648 A651 F657	L502-C506 WeakPolarHBondContact O-CB 3.45Å; L502-C506 PolarHBondContact O-N 2.92Å; F503-C506 PolarHBondContact O-N 2.8Å; C506-M509 WeakPolarHBondContact O-CB 3.48Å; C506-M509 PolarHBondContact O-N 3.19Å; C506-V510 WeakPolarHBondContact O-CG2 3.2Å; C506-V510 PolarHBondContact O-N 3.16Å; C506-Y647 HydrophobicContact CB-CE1 4.5Å; C506-L648 HydrophobicContact CB-CD2 3.85Å; C506-A651 WeakPolarHBondContact SG-CB 3.45Å; C506-F657 HydrophobicContact CB-CE2 4.48Å
507	H	96.2	Very high	94	Very high	14 Å²	14	27.3 Å²	27.3	7%	0.065	14%	0.139	C	C	.	.	H	α-helix	trans	-71.7	-37.9	176.9	178.1	53.9	0	0	0	112.7	F503 E504 Q505 M509 V510 V511 R529 E548 Y647	F503-H507 WeakPolarHBondContact O-CB 3.28Å; F503-H507 PolarHBondContact O-N 2.99Å; E504-H507 PolarHBondContact O-N 3.45Å; Q505-H507 VanDerWaalsContact C-N 3.25Å; Q505-H507 PolarHBondContact O-N 3.34Å; H507-M509 VanDerWaalsContact C-N 3.27Å; H507-M509 PolarHBondContact O-N 2.87Å; H507-V510 PolarHBondContact O-N 2.85Å; H507-V511 PolarHBondContact O-N 3.39Å; H507-R529 PolarHBondContact CD2-NE 3.49Å; H507-R529 PolarHBondContact CD2-NH2 3.07Å; H507-R529 VanDerWaalsContact CD2-NH2 3.27Å; H507-R529 PolarHBondContact NE2-NE 3.13Å; H507-E548 PolarHBondContact CE1-O 3.29Å; H507-E548 VanDerWaalsContact CE1-O 3.27Å; H507-E548 PolarHBondContact NE2-O 2.91Å; H507-Y647 WeakPolarHBondContact CA-OH 3.32Å; H507-Y647 HydrophobicContact CB-CE1 4.41Å; H507-Y647 PolarHBondContact ND1-OH 3.07Å
508	E	92.3	Very high	93.8	Very high	50 Å²	50	28.5 Å²	28.5	23%	0.234	15%	0.15	C	C	.	.	H	α-helix	trans	-54.8	-44.1	167.4	-75.9	-170.1	112.7	0	0	111	Q442 K482 E504 Q505 V511 R512	Q442-E508 PolarHBondContact NE2-OE1 2.78Å; K482-E508 VanDerWaalsContact CE-OE2 3.27Å; K482-E508 WeakPolarHBondContact CE-OE2 3.35Å; K482-E508 IonicContact NZ-OE1 2.72Å; K482-E508 PolarHBondContact NZ-OE1 3.19Å; K482-E508 IonicContact NZ-OE2 2.74Å; K482-E508 PolarHBondContact NZ-OE2 3.09Å; E504-E508 PolarHBondContact O-N 3.5Å; Q505-E508 PolarHBondContact O-N 2.81Å; E508-V511 PolarHBondContact O-N 2.59Å; E508-R512 WeakPolarHBondContact O-CB 3.43Å; E508-R512 WeakPolarHBondContact O-CD 3.05Å; E508-R512 WeakPolarHBondContact O-CG 3.49Å; E508-R512 PolarHBondContact O-N 3.47Å; E508-R512 IonicContact OE1-NH2 2.62Å; E508-R512 PolarHBondContact OE1-NH2 2.89Å; E508-R512 VanDerWaalsContact OE1-NH2 3.11Å
509	M	91.8	Very high	93.5	Very high	43 Å²	43	30 Å²	30	21%	0.212	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-42.6	176.2	-68.5	177	70	0	0	112.4	Q505 C506 H507 R512 G513 Q514 W654	Q505-M509 WeakPolarHBondContact O-CG 3.42Å; Q505-M509 PolarHBondContact O-N 2.93Å; Q505-M509 VanDerWaalsContact O-N 3.07Å; C506-M509 WeakPolarHBondContact O-CB 3.48Å; C506-M509 PolarHBondContact O-N 3.19Å; H507-M509 VanDerWaalsContact C-N 3.27Å; H507-M509 PolarHBondContact O-N 2.87Å; M509-R512 PolarHBondContact O-N 2.93Å; M509-G513 PolarHBondContact O-N 2.83Å; M509-G513 VanDerWaalsContact O-N 3.15Å; M509-Q514 HydrophobicContact CB-CB 4.13Å; M509-Q514 HydrophobicContact CG-CB 4.48Å; M509-Q514 WeakPolarHBondContact O-CA 3.44Å; M509-Q514 PolarHBondContact O-N 3.02Å; M509-W654 HydrophobicContact CE-CZ3 4.18Å
510	V	94.4	Very high	93.4	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-49	176.9	167.2	0	0	0	0	111.3	C506 H507 G513 L515 L522 L525 P551	C506-V510 WeakPolarHBondContact O-CG2 3.2Å; C506-V510 PolarHBondContact O-N 3.16Å; H507-V510 PolarHBondContact O-N 2.85Å; V510-G513 PolarHBondContact O-N 3.08Å; V510-G513 VanDerWaalsContact O-N 3.07Å; V510-L515 HydrophobicContact CG2-CB 3.86Å; V510-L515 HydrophobicContact CG2-CD2 3.52Å; V510-L515 HydrophobicContact CG2-CG 4.3Å; V510-L522 HydrophobicContact CG1-CD2 4.01Å; V510-L525 HydrophobicContact CG2-CD1 4.04Å; V510-P551 WeakPolarHBondContact O-CB 3.42Å
511	V	92.4	Very high	93.4	Very high	41 Å²	41	34 Å²	34	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-41.6	-179.7	167.3	0	0	0	0	111.7	H507 E508 G513 D547	H507-V511 PolarHBondContact O-N 3.39Å; E508-V511 PolarHBondContact O-N 2.59Å; V511-G513 PolarHBondContact O-N 2.78Å; V511-D547 WeakPolarHBondContact CG1-O 3.39Å
512	R	89.3	Confident	93.4	Very high	106 Å²	106	34.3 Å²	34.3	40%	0.4	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-6.7	174.7	-67	171.6	-170.8	-172.1	6.6	113.6	E447 E508 M509 Q514	E447-R512 VanDerWaalsContact CD-NH2 3.29Å; E447-R512 IonicContact OE1-CZ 2.77Å; E447-R512 IonicContact OE1-NH1 3.63Å; E447-R512 PolarHBondContact OE1-NH1 3.11Å; E447-R512 IonicContact OE1-NH2 2.73Å; E447-R512 PolarHBondContact OE1-NH2 3.39Å; E447-R512 IonicContact OE2-CZ 2.66Å; E447-R512 IonicContact OE2-NH1 3.82Å; E447-R512 IonicContact OE2-NH2 2.96Å; E447-R512 PolarHBondContact OE2-NH2 2.97Å; E508-R512 WeakPolarHBondContact O-CB 3.43Å; E508-R512 WeakPolarHBondContact O-CD 3.05Å; E508-R512 WeakPolarHBondContact O-CG 3.49Å; E508-R512 PolarHBondContact O-N 3.47Å; E508-R512 IonicContact OE1-NH2 2.62Å; E508-R512 PolarHBondContact OE1-NH2 2.89Å; E508-R512 VanDerWaalsContact OE1-NH2 3.11Å; M509-R512 PolarHBondContact O-N 2.93Å; R512-Q514 VanDerWaalsContact C-N 3.33Å; R512-Q514 HydrophobicContact CB-CG 3.94Å
513	G	90	Very high	93.4	Very high	9 Å²	9	33.9 Å²	33.9	9%	0.093	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	23.3	-176.5	0	0	0	0	0	114.2	M509 V510 V511 W679	M509-G513 PolarHBondContact O-N 2.83Å; M509-G513 VanDerWaalsContact O-N 3.15Å; V510-G513 PolarHBondContact O-N 3.08Å; V510-G513 VanDerWaalsContact O-N 3.07Å; V511-G513 PolarHBondContact O-N 2.78Å; G513-W679 WeakPolarHBondContact O-CH2 3.46Å
514	Q	90.8	Very high	93.4	Very high	47 Å²	47	35 Å²	35	22%	0.22	19%	0.186	C	C	.	.			trans	-96.7	0.5	-178.1	-65.5	-180	-46.5	0	0	113.3	M509 R512 L661	M509-Q514 HydrophobicContact CB-CB 4.13Å; M509-Q514 HydrophobicContact CG-CB 4.48Å; M509-Q514 WeakPolarHBondContact O-CA 3.44Å; M509-Q514 PolarHBondContact O-N 3.02Å; R512-Q514 VanDerWaalsContact C-N 3.33Å; R512-Q514 HydrophobicContact CB-CG 3.94Å; Q514-L661 HydrophobicContact CB-CD1 4.22Å; Q514-L661 WeakPolarHBondContact O-CD1 3.44Å
515	L	92.5	Very high	93.5	Very high	13 Å²	13	34 Å²	34	7%	0.068	18%	0.181	C	C	.	.	S	Bend	trans	-100.6	113.4	166.5	-173.5	76.1	0	0	0	109.5	V510 A517 L525 A651 W654	V510-L515 HydrophobicContact CG2-CB 3.86Å; V510-L515 HydrophobicContact CG2-CD2 3.52Å; V510-L515 HydrophobicContact CG2-CG 4.3Å; L515-A517 HydrophobicContact CD2-CB 4.15Å; L515-A517 HydrophobicContact CG-CB 4.35Å; L515-A517 PolarHBondContact O-N 3.37Å; L515-A517 VanDerWaalsContact O-N 3.13Å; L515-L525 HydrophobicContact CD2-CD1 3.83Å; L515-A651 HydrophobicContact CD1-CB 4.42Å; L515-A651 HydrophobicContact CD2-CB 4.08Å; L515-W654 HydrophobicContact CD1-CE3 3.69Å; L515-W654 HydrophobicContact CD1-CZ3 4.28Å
516	P	90	Very high	93.7	Very high	13 Å²	13	32.6 Å²	32.6	8%	0.084	17%	0.174	C	C	.	.			trans	-74.5	101	172.3	-9.1	25.8	0	0	0	110	W654 W679	P516-W654 HydrophobicContact CG-CD2 4.18Å; P516-W654 HydrophobicContact CG-CH2 4.42Å; P516-W654 HydrophobicContact CG-CZ2 3.82Å; P516-W679 HydrophobicContact CG-CZ3 4.24Å
517	A	90.6	Very high	93.8	Very high	34 Å²	34	32.4 Å²	32.4	28%	0.281	17%	0.173	S	C	.	.			trans	-139.8	159.4	179.7	0	0	0	0	0	110.2	L515 D521 L522	L515-A517 HydrophobicContact CD2-CB 4.15Å; L515-A517 HydrophobicContact CG-CB 4.35Å; L515-A517 PolarHBondContact O-N 3.37Å; L515-A517 VanDerWaalsContact O-N 3.13Å; A517-D521 HydrophobicContact CB-CB 4.06Å; A517-L522 HydrophobicContact CB-CD2 4.18Å; A517-L522 HydrophobicContact CB-CG 4.2Å
518	C	91.6	Very high	93.9	Very high	70 Å²	70	32.2 Å²	32.2	47%	0.473	17%	0.172	S	C	.	.			trans	-77.5	164.1	177.7	87.5	0	0	0	0	111.4	E520 D521 L522	C518-E520 VanDerWaalsContact C-N 3.26Å; C518-E520 PolarHBondContact O-N 3.47Å; C518-D521 PolarHBondContact N-OD2 3.45Å; C518-D521 WeakPolarHBondContact O-CB 3.5Å; C518-D521 PolarHBondContact O-N 3.03Å; C518-D521 VanDerWaalsContact O-N 3.13Å; C518-D521 PolarHBondContact SG-OD2 3.42Å; C518-L522 WeakPolarHBondContact O-CG 3.39Å; C518-L522 PolarHBondContact O-N 2.82Å
519	E	91.7	Very high	94.1	Very high	49 Å²	49	30.9 Å²	30.9	23%	0.229	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-37.1	-176.3	-157.7	-164	94.3	0	0	112.3	D521 L522 L523 F550 M554 R558	E519-D521 PolarHBondContact O-N 3.48Å; E519-L522 PolarHBondContact O-N 2.78Å; E519-L523 HydrophobicContact CG-CD1 4.29Å; E519-L523 WeakPolarHBondContact O-CB 3.49Å; E519-L523 WeakPolarHBondContact O-CG 3.36Å; E519-L523 PolarHBondContact O-N 2.97Å; E519-F550 HydrophobicContact CG-CZ 4.04Å; E519-M554 HydrophobicContact CB-CE 4.08Å; E519-M554 HydrophobicContact CG-CE 4.1Å; E519-R558 IonicContact OE1-CZ 3.97Å; E519-R558 IonicContact OE1-NE 2.82Å; E519-R558 IonicContact OE1-NH2 3.6Å; E519-R558 PolarHBondContact OE1-NH2 3.34Å; E519-R558 IonicContact OE2-CZ 3Å; E519-R558 IonicContact OE2-NE 2.66Å; E519-R558 PolarHBondContact OE2-NE 3.37Å; E519-R558 IonicContact OE2-NH2 3.94Å
520	E	94.6	Very high	94.3	Very high	111 Å²	111	28.8 Å²	28.8	52%	0.519	16%	0.155	S	C	.	.	H	α-helix	trans	-63	-40	177.1	-73	-69.4	117.4	0	0	112.3	C518 L523 A524 R631	C518-E520 VanDerWaalsContact C-N 3.26Å; C518-E520 PolarHBondContact O-N 3.47Å; E520-L523 PolarHBondContact O-N 3.35Å; E520-A524 WeakPolarHBondContact O-CB 3.33Å; E520-A524 PolarHBondContact O-N 3.34Å; E520-R631 IonicContact OE1-CZ 2.71Å; E520-R631 IonicContact OE1-NH2 3.98Å; E520-R631 PolarHBondContact OE1-NH2 2.93Å; E520-R631 IonicContact OE2-CZ 2.73Å; E520-R631 IonicContact OE2-NH2 3.81Å; E520-R631 PolarHBondContact OE2-NH2 3.38Å
521	D	96	Very high	94.5	Very high	44 Å²	44	28.8 Å²	28.8	24%	0.235	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-45.9	174.8	-60.4	-46.9	0	0	0	110.7	A517 C518 E519 L523 A524 L525 I650	A517-D521 HydrophobicContact CB-CB 4.06Å; C518-D521 PolarHBondContact N-OD2 3.45Å; C518-D521 WeakPolarHBondContact O-CB 3.5Å; C518-D521 PolarHBondContact O-N 3.03Å; C518-D521 VanDerWaalsContact O-N 3.13Å; C518-D521 PolarHBondContact SG-OD2 3.42Å; E519-D521 PolarHBondContact O-N 3.48Å; D521-L523 VanDerWaalsContact C-N 3.29Å; D521-L523 PolarHBondContact O-N 2.81Å; D521-A524 CarbonylContact O-C 3.59Å; D521-A524 WeakPolarHBondContact O-CB 3.26Å; D521-A524 PolarHBondContact O-N 3.09Å; D521-A524 VanDerWaalsContact O-N 3.09Å; D521-L525 WeakPolarHBondContact O-CB 3.5Å; D521-L525 VanDerWaalsContact O-CG 3.23Å; D521-L525 WeakPolarHBondContact O-CG 3.21Å; D521-L525 PolarHBondContact O-N 3.25Å; D521-I650 HydrophobicContact CB-CG2 3.89Å
522	L	95.9	Very high	94.6	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-37.6	178	-67	170.3	0	0	0	111.9	V510 A517 C518 E519 L525 A526 F550 P551 M554	V510-L522 HydrophobicContact CG1-CD2 4.01Å; A517-L522 HydrophobicContact CB-CD2 4.18Å; A517-L522 HydrophobicContact CB-CG 4.2Å; C518-L522 WeakPolarHBondContact O-CG 3.39Å; C518-L522 PolarHBondContact O-N 2.82Å; E519-L522 PolarHBondContact O-N 2.78Å; L522-L525 HydrophobicContact CD2-CD1 4.49Å; L522-A526 WeakPolarHBondContact O-CB 3.45Å; L522-A526 PolarHBondContact O-N 2.65Å; L522-F550 HydrophobicContact CB-CD2 4.09Å; L522-F550 HydrophobicContact CB-CE2 3.55Å; L522-F550 HydrophobicContact CB-CZ 4.33Å; L522-P551 HydrophobicContact CD1-CG 4.02Å; L522-P551 HydrophobicContact CD2-CG 4.22Å; L522-M554 HydrophobicContact CD1-CE 4.17Å; L522-M554 HydrophobicContact CD1-CG 4.05Å; L522-M554 HydrophobicContact CD1-SD 4.49Å
523	L	97.3	Very high	94.8	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-68.6	-36.5	173.5	-69.3	167.4	0	0	0	112.4	E519 E520 D521 A527 F550 V624 A627 I628	E519-L523 HydrophobicContact CG-CD1 4.29Å; E519-L523 WeakPolarHBondContact O-CB 3.49Å; E519-L523 WeakPolarHBondContact O-CG 3.36Å; E519-L523 PolarHBondContact O-N 2.97Å; E520-L523 PolarHBondContact O-N 3.35Å; D521-L523 VanDerWaalsContact C-N 3.29Å; D521-L523 PolarHBondContact O-N 2.81Å; L523-A527 PolarHBondContact O-N 2.97Å; L523-F550 HydrophobicContact CD2-CD2 4.35Å; L523-F550 HydrophobicContact CD2-CE2 3.86Å; L523-F550 HydrophobicContact CD2-CZ 4.46Å; L523-F550 HydrophobicContact CG-CE2 3.98Å; L523-V624 HydrophobicContact CD2-CG1 3.91Å; L523-A627 HydrophobicContact CD1-CB 4.29Å; L523-A627 HydrophobicContact CD2-CB 4.09Å; L523-I628 HydrophobicContact CD2-CD1 4.33Å; L523-I628 HydrophobicContact CD2-CG1 3.7Å
524	A	97.9	Very high	95	Very high	25 Å²	25	30.2 Å²	30.2	21%	0.207	17%	0.166	C	C	.	.	H	α-helix	trans	-69.3	-43.4	174.4	0	0	0	0	0	112.1	E520 D521 A527 L528 I650	E520-A524 WeakPolarHBondContact O-CB 3.33Å; E520-A524 PolarHBondContact O-N 3.34Å; D521-A524 CarbonylContact O-C 3.59Å; D521-A524 WeakPolarHBondContact O-CB 3.26Å; D521-A524 PolarHBondContact O-N 3.09Å; D521-A524 VanDerWaalsContact O-N 3.09Å; A524-A527 PolarHBondContact O-N 3.27Å; A524-L528 WeakPolarHBondContact O-CB 3.38Å; A524-L528 WeakPolarHBondContact O-CG 3.47Å; A524-L528 PolarHBondContact O-N 3.39Å; A524-I650 HydrophobicContact CB-CD1 4.11Å
525	L	98.3	Very high	95.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-47.9	174.1	-70	171.1	0	0	0	110.9	V510 L515 D521 L522 A527 L528 R529 Y647 I650	V510-L525 HydrophobicContact CG2-CD1 4.04Å; L515-L525 HydrophobicContact CD2-CD1 3.83Å; D521-L525 WeakPolarHBondContact O-CB 3.5Å; D521-L525 VanDerWaalsContact O-CG 3.23Å; D521-L525 WeakPolarHBondContact O-CG 3.21Å; D521-L525 PolarHBondContact O-N 3.25Å; L522-L525 HydrophobicContact CD2-CD1 4.49Å; L525-A527 VanDerWaalsContact C-N 3.32Å; L525-A527 PolarHBondContact O-N 2.72Å; L525-L528 PolarHBondContact O-N 3.35Å; L525-R529 PolarHBondContact O-N 3.39Å; L525-Y647 HydrophobicContact CB-CD2 4.12Å; L525-Y647 HydrophobicContact CB-CE2 3.65Å; L525-Y647 HydrophobicContact CD2-CD1 3.71Å; L525-Y647 HydrophobicContact CD2-CD2 3.61Å; L525-Y647 HydrophobicContact CD2-CE1 3.84Å; L525-Y647 HydrophobicContact CD2-CE2 3.74Å; L525-Y647 HydrophobicContact CD2-CG 3.57Å; L525-Y647 WeakPolarHBondContact CD2-O 3.42Å; L525-Y647 HydrophobicContact CG-CD2 4.49Å; L525-Y647 HydrophobicContact CG-CE2 4.29Å; L525-Y647 WeakPolarHBondContact O-CD2 3.38Å; L525-Y647 WeakPolarHBondContact O-CE2 3.44Å; L525-I650 HydrophobicContact CD1-CG2 4.23Å; L525-I650 HydrophobicContact CD2-CB 3.95Å; L525-I650 HydrophobicContact CD2-CD1 4.49Å; L525-I650 HydrophobicContact CD2-CG2 3.97Å; L525-I650 HydrophobicContact CG-CG2 4.01Å
526	A	97.8	Very high	95.2	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-39.4	176.6	0	0	0	0	0	112.9	L522 R529 L530 L549 I628	L522-A526 WeakPolarHBondContact O-CB 3.45Å; L522-A526 PolarHBondContact O-N 2.65Å; A526-R529 PolarHBondContact O-N 2.96Å; A526-L530 PolarHBondContact O-N 3.26Å; A526-L549 HydrophobicContact CB-CB 4.25Å; A526-I628 HydrophobicContact CB-CD1 3.74Å; A526-I628 HydrophobicContact CB-CG1 3.87Å; A526-I628 HydrophobicContact CB-CG2 4.1Å
527	A	98	Very high	95.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-68.8	-40.7	175	0	0	0	0	0	112.9	L523 A524 L525 R529 L530 Q531 I628 R631 W632 L635	L523-A527 PolarHBondContact O-N 2.97Å; A524-A527 PolarHBondContact O-N 3.27Å; L525-A527 VanDerWaalsContact C-N 3.32Å; L525-A527 PolarHBondContact O-N 2.72Å; A527-R529 VanDerWaalsContact C-N 3.32Å; A527-R529 PolarHBondContact O-N 2.86Å; A527-L530 PolarHBondContact O-N 3.4Å; A527-Q531 PolarHBondContact O-N 3.48Å; A527-I628 HydrophobicContact CB-CG2 4.46Å; A527-R631 HydrophobicContact CB-CB 3.56Å; A527-W632 HydrophobicContact CB-CB 4.21Å; A527-L635 HydrophobicContact CB-CD1 4.12Å
528	L	98.3	Very high	95.4	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.052	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-33.2	175.4	-74.4	163.8	0	0	0	112.2	A524 L525 Q531 T532 L635 A646 Y647 I650	A524-L528 WeakPolarHBondContact O-CB 3.38Å; A524-L528 WeakPolarHBondContact O-CG 3.47Å; A524-L528 PolarHBondContact O-N 3.39Å; L525-L528 PolarHBondContact O-N 3.35Å; L528-Q531 PolarHBondContact O-N 3.38Å; L528-T532 WeakPolarHBondContact O-CB 3.41Å; L528-T532 PolarHBondContact O-N 2.8Å; L528-T532 PolarHBondContact O-OG1 3.1Å; L528-L635 HydrophobicContact CD2-CD1 3.84Å; L528-L635 HydrophobicContact CD2-CD2 3.96Å; L528-L635 HydrophobicContact CG-CD1 4.08Å; L528-A646 HydrophobicContact CD1-CB 4.05Å; L528-A646 HydrophobicContact CD2-CB 3.93Å; L528-Y647 HydrophobicContact CB-CD2 3.94Å; L528-I650 HydrophobicContact CD1-CD1 3.73Å
529	R	97.3	Very high	95.3	Very high	22 Å²	22	38.5 Å²	38.5	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-45.3	172.4	-179.4	59.4	167	170.3	-3.8	111.2	E504 H507 L525 A526 A527 T532 L533 L549 Y647	E504-R529 VanDerWaalsContact CD-NH1 3.26Å; E504-R529 IonicContact OE1-CZ 2.66Å; E504-R529 IonicContact OE1-NH1 2.73Å; E504-R529 PolarHBondContact OE1-NH1 2.7Å; E504-R529 IonicContact OE1-NH2 2.89Å; E504-R529 IonicContact OE2-CZ 2.65Å; E504-R529 IonicContact OE2-NH1 3.66Å; E504-R529 PolarHBondContact OE2-NH1 3.46Å; E504-R529 IonicContact OE2-NH2 3.79Å; E504-R529 PolarHBondContact OE2-NH2 3.33Å; H507-R529 PolarHBondContact CD2-NE 3.49Å; H507-R529 PolarHBondContact CD2-NH2 3.07Å; H507-R529 VanDerWaalsContact CD2-NH2 3.27Å; H507-R529 PolarHBondContact NE2-NE 3.13Å; L525-R529 PolarHBondContact O-N 3.39Å; A526-R529 PolarHBondContact O-N 2.96Å; A527-R529 VanDerWaalsContact C-N 3.32Å; A527-R529 PolarHBondContact O-N 2.86Å; R529-T532 PolarHBondContact O-N 3.03Å; R529-L533 HydrophobicContact CG-CD1 4.07Å; R529-L533 WeakPolarHBondContact O-CB 3.35Å; R529-L533 WeakPolarHBondContact O-CG 3.4Å; R529-L533 PolarHBondContact O-N 3.34Å; R529-L549 HydrophobicContact CB-CD2 4.34Å; R529-L549 HydrophobicContact CG-CD2 3.89Å; R529-Y647 HydrophobicContact CB-CE2 4.21Å
530	L	96.6	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-47.7	175.3	-69.9	168.1	0	0	0	111.8	A526 A527 T532 L533 M534 F543 P544 L549 I628 W632	A526-L530 PolarHBondContact O-N 3.26Å; A527-L530 PolarHBondContact O-N 3.4Å; L530-T532 VanDerWaalsContact C-N 3.28Å; L530-T532 PolarHBondContact O-N 3.13Å; L530-L533 PolarHBondContact O-N 3.03Å; L530-M534 HydrophobicContact CD2-SD 3.8Å; L530-M534 VanDerWaalsContact O-CB 3.3Å; L530-M534 WeakPolarHBondContact O-CB 3.45Å; L530-M534 WeakPolarHBondContact O-CG 3.5Å; L530-M534 PolarHBondContact O-N 3.19Å; L530-F543 HydrophobicContact CD1-CD2 4.18Å; L530-F543 HydrophobicContact CD1-CE2 3.66Å; L530-P544 HydrophobicContact CD2-CG 4.05Å; L530-L549 HydrophobicContact CD1-CD1 4.01Å; L530-L549 HydrophobicContact CD2-CD1 4.04Å; L530-L549 HydrophobicContact CD2-CD2 4.16Å; L530-L549 HydrophobicContact CG-CD1 4.11Å; L530-L549 HydrophobicContact CG-CD2 4.2Å; L530-I628 HydrophobicContact CD1-CG2 3.6Å; L530-W632 HydrophobicContact CB-CD2 3.7Å; L530-W632 HydrophobicContact CB-CE3 3.94Å; L530-W632 HydrophobicContact CB-CG 4.05Å; L530-W632 HydrophobicContact CB-CZ2 4.36Å; L530-W632 HydrophobicContact CB-CZ3 4.35Å; L530-W632 HydrophobicContact CD1-CD2 4.16Å; L530-W632 HydrophobicContact CD1-CE3 3.68Å; L530-W632 HydrophobicContact CD1-CZ3 4.2Å; L530-W632 HydrophobicContact CD2-CZ3 4.42Å; L530-W632 HydrophobicContact CG-CE3 4.29Å
531	Q	97.3	Very high	94.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-38.9	176.1	-171.4	69.2	20.4	0	0	112.1	A527 L528 G535 D536 L635 H638 S643	A527-Q531 PolarHBondContact O-N 3.48Å; L528-Q531 PolarHBondContact O-N 3.38Å; Q531-G535 VanDerWaalsContact O-CA 3.32Å; Q531-G535 WeakPolarHBondContact O-CA 3.36Å; Q531-G535 PolarHBondContact O-N 2.83Å; Q531-G535 PolarHBondContact OE1-O 3.01Å; Q531-G535 VanDerWaalsContact OE1-O 3.05Å; Q531-D536 PolarHBondContact NE2-OD1 3.27Å; Q531-L635 HydrophobicContact CB-CB 4.3Å; Q531-L635 HydrophobicContact CB-CD1 3.86Å; Q531-L635 HydrophobicContact CG-CB 4Å; Q531-L635 HydrophobicContact CG-CD1 4.39Å; Q531-L635 PolarHBondContact NE2-O 2.82Å; Q531-H638 HydrophobicContact CG-CB 4.06Å; Q531-H638 PolarHBondContact NE2-O 3.46Å; Q531-S643 VanDerWaalsContact CG-OG 3.22Å; Q531-S643 WeakPolarHBondContact CG-OG 3.24Å
532	T	95.3	Very high	94	Very high	17 Å²	17	43.1 Å²	43.1	10%	0.104	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-43.8	176.8	-59.6	0	0	0	0	112.8	F503 L528 R529 L530 S640 S643 M644	F503-T532 HydrophobicContact CE1-CG2 3.62Å; F503-T532 HydrophobicContact CZ-CG2 3.61Å; L528-T532 WeakPolarHBondContact O-CB 3.41Å; L528-T532 PolarHBondContact O-N 2.8Å; L528-T532 PolarHBondContact O-OG1 3.1Å; R529-T532 PolarHBondContact O-N 3.03Å; L530-T532 VanDerWaalsContact C-N 3.28Å; L530-T532 PolarHBondContact O-N 3.13Å; T532-S640 WeakPolarHBondContact CG2-OG 3.5Å; T532-S640 PolarHBondContact O-OG 3.46Å; T532-S643 VanDerWaalsContact OG1-CB 3.25Å; T532-S643 WeakPolarHBondContact OG1-CB 3.29Å; T532-M644 HydrophobicContact CG2-CG 3.52Å; T532-M644 HydrophobicContact CG2-SD 4.08Å
533	L	92.9	Very high	93.7	Very high	101 Å²	101	46.1 Å²	46.1	53%	0.529	26%	0.261	S	S	.	.	H	α-helix	trans	-82.9	-32.2	-175.1	-71.5	177.5	0	0	0	113.9	R529 L530	R529-L533 HydrophobicContact CG-CD1 4.07Å; R529-L533 WeakPolarHBondContact O-CB 3.35Å; R529-L533 WeakPolarHBondContact O-CG 3.4Å; R529-L533 PolarHBondContact O-N 3.34Å; L530-L533 PolarHBondContact O-N 3.03Å
534	M	93.4	Very high	93.4	Very high	67 Å²	67	47.5 Å²	47.5	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-121.9	-14.6	-165.3	-50.3	-168.1	81.3	0	0	113.8	L530 A541 P542 W632	L530-M534 HydrophobicContact CD2-SD 3.8Å; L530-M534 VanDerWaalsContact O-CB 3.3Å; L530-M534 WeakPolarHBondContact O-CB 3.45Å; L530-M534 WeakPolarHBondContact O-CG 3.5Å; L530-M534 PolarHBondContact O-N 3.19Å; M534-A541 HydrophobicContact CE-CB 3.82Å; M534-P542 HydrophobicContact CE-CG 3.86Å; M534-P542 VanDerWaalsContact CE-O 3.22Å; M534-P542 WeakPolarHBondContact CE-O 3.47Å; M534-W632 HydrophobicContact CB-CH2 4.14Å; M534-W632 HydrophobicContact CB-CZ2 3.77Å; M534-W632 HydrophobicContact CE-CH2 4.5Å; M534-W632 HydrophobicContact CG-CH2 4.47Å; M534-W632 HydrophobicContact CG-CZ2 4.47Å; M534-W632 HydrophobicContact SD-CH2 3.64Å; M534-W632 HydrophobicContact SD-CZ2 4.2Å; M534-W632 HydrophobicContact SD-CZ3 4.35Å
535	G	94.4	Very high	93.1	Very high	29 Å²	29	49.3 Å²	49.3	30%	0.299	28%	0.28	S	S	.	.			trans	71.6	-153.6	-167.7	0	0	0	0	0	112.2	Q531 W632	Q531-G535 VanDerWaalsContact O-CA 3.32Å; Q531-G535 WeakPolarHBondContact O-CA 3.36Å; Q531-G535 PolarHBondContact O-N 2.83Å; Q531-G535 PolarHBondContact OE1-O 3.01Å; Q531-G535 VanDerWaalsContact OE1-O 3.05Å; G535-W632 WeakPolarHBondContact O-CZ2 3.49Å; G535-W632 PolarHBondContact O-NE1 3.5Å
536	D	94.8	Very high	92.9	Very high	85 Å²	85	50.4 Å²	50.4	46%	0.455	29%	0.285	S	S	.	.	S	Bend	trans	-60	143.9	-175.7	-67	-18.7	0	0	0	113.3	Q531 S538 A636 G637	Q531-D536 PolarHBondContact NE2-OD1 3.27Å; D536-S538 PolarHBondContact O-N 3.43Å; D536-A636 WeakPolarHBondContact OD1-CA 3.06Å; D536-G637 PolarHBondContact OD1-N 3.26Å; D536-G637 PolarHBondContact OD2-N 3.3Å
537	F	93.8	Very high	92.5	Very high	68 Å²	68	55.9 Å²	55.9	30%	0.298	32%	0.315	S	S	.	.			trans	-53.9	130.5	178.3	172.2	-94.7	0	0	0	112.8	T539 L629 W632 K633	F537-T539 HydrophobicContact CE1-CG2 4.21Å; F537-T539 HydrophobicContact CZ-CG2 4.4Å; F537-L629 HydrophobicContact CD2-CD2 4.46Å; F537-L629 HydrophobicContact CE2-CD2 4.08Å; F537-W632 HydrophobicContact CB-CD2 4.09Å; F537-W632 HydrophobicContact CB-CG 4.32Å; F537-W632 HydrophobicContact CB-CZ2 4.48Å; F537-W632 HydrophobicContact CD2-CD2 4.11Å; F537-W632 AromaticContact CD2-CE3 3.69Å; F537-W632 HydrophobicContact CD2-CE3 3.69Å; F537-W632 HydrophobicContact CD2-CH2 4.38Å; F537-W632 AromaticContact CD2-CZ3 3.85Å; F537-W632 HydrophobicContact CD2-CZ3 3.85Å; F537-W632 HydrophobicContact CE2-CZ3 4.48Å; F537-K633 HydrophobicContact CB-CG 4.08Å; F537-K633 HydrophobicContact CD1-CD 4.37Å; F537-K633 HydrophobicContact CD1-CG 3.58Å; F537-K633 HydrophobicContact CD2-CG 4.22Å; F537-K633 HydrophobicContact CE1-CD 4.43Å; F537-K633 HydrophobicContact CE1-CG 4.09Å; F537-K633 HydrophobicContact CG-CG 3.65Å
538	S	91.1	Very high	92.3	Very high	55 Å²	55	61 Å²	61	39%	0.385	34%	0.338	S	S	.	.			trans	-133.5	141.7	173.8	172.5	0	0	0	0	110.9	D536 H540 A541	D536-S538 PolarHBondContact O-N 3.43Å; S538-H540 PolarHBondContact O-N 2.89Å; S538-H540 PolarHBondContact OG-N 3.07Å; S538-A541 WeakPolarHBondContact O-CB 3.45Å; S538-A541 PolarHBondContact O-N 3.34Å
539	T	88.3	Confident	92.1	Very high	115 Å²	115	60.6 Å²	60.6	71%	0.706	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-8	176.6	53.1	0	0	0	0	114.2	F537	F537-T539 HydrophobicContact CE1-CG2 4.21Å; F537-T539 HydrophobicContact CZ-CG2 4.4Å
540	H	84.6	Confident	91.9	Very high	166 Å²	166	59.6 Å²	59.6	77%	0.769	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	3.7	176.2	-60.6	-64	0	0	0	113.4	S538	S538-H540 PolarHBondContact O-N 2.89Å; S538-H540 PolarHBondContact OG-N 3.07Å
541	A	84.9	Confident	91.7	Very high	31 Å²	31	59.7 Å²	59.7	26%	0.256	33%	0.333	S	S	.	.	S	Bend	trans	-71.3	128.5	176.7	0	0	0	0	0	110.6	M534 S538 F543 W632	M534-A541 HydrophobicContact CE-CB 3.82Å; S538-A541 WeakPolarHBondContact O-CB 3.45Å; S538-A541 PolarHBondContact O-N 3.34Å; A541-F543 PolarHBondContact O-N 3.33Å; A541-W632 HydrophobicContact CB-CH2 3.72Å; A541-W632 HydrophobicContact CB-CZ3 4.47Å
542	P	86	Confident	91.3	Very high	104 Å²	104	61.4 Å²	61.4	68%	0.675	35%	0.352	S	S	*	.			trans	-71.2	109.7	177.9	27.9	-34.2	0	0	0	110.9	M534	M534-P542 HydrophobicContact CE-CG 3.86Å; M534-P542 VanDerWaalsContact CE-O 3.22Å; M534-P542 WeakPolarHBondContact CE-O 3.47Å
543	F	88.8	Confident	90.8	Very high	67 Å²	67	64.6 Å²	64.6	29%	0.294	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-69.9	124.4	174	-167.4	-92.6	0	0	0	109.9	L530 A541 L549 T625 I628 L629	L530-F543 HydrophobicContact CD1-CD2 4.18Å; L530-F543 HydrophobicContact CD1-CE2 3.66Å; A541-F543 PolarHBondContact O-N 3.33Å; F543-L549 HydrophobicContact CE1-CD1 4.04Å; F543-L549 HydrophobicContact CE2-CD1 3.99Å; F543-L549 HydrophobicContact CZ-CD1 3.55Å; F543-T625 HydrophobicContact CD1-CG2 4.31Å; F543-T625 HydrophobicContact CE1-CG2 3.78Å; F543-T625 HydrophobicContact CE2-CG2 4.28Å; F543-T625 HydrophobicContact CZ-CG2 3.77Å; F543-I628 HydrophobicContact CE2-CG2 4.35Å; F543-L629 HydrophobicContact CD2-CD2 3.7Å; F543-L629 HydrophobicContact CD2-CG 4.39Å; F543-L629 HydrophobicContact CE2-CD2 3.81Å; F543-L629 HydrophobicContact CE2-CG 4.16Å
544	P	91.4	Very high	90.5	Very high	31 Å²	31	61.7 Å²	61.7	20%	0.201	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-72.3	169	179	31.8	-35.7	0	0	0	111.6	L530 L546 L549	L530-P544 HydrophobicContact CD2-CG 4.05Å; P544-L546 PolarHBondContact O-N 2.64Å; P544-L549 HydrophobicContact CG-CD1 3.88Å; P544-L549 HydrophobicContact CG-CD2 4.06Å; P544-L549 HydrophobicContact CG-CG 3.96Å
545	P	92.3	Very high	90.1	Very high	64 Å²	64	59.5 Å²	59.5	42%	0.416	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-50.7	139.4	171	-25.6	34.9	0	0	0	112.2	D547 E548	P545-D547 WeakPolarHBondContact CB-OD1 3.32Å; P545-D547 PolarHBondContact O-N 3.27Å; P545-E548 HydrophobicContact CB-CG 4.2Å; P545-E548 WeakPolarHBondContact CD-OE1 3.39Å; P545-E548 HydrophobicContact CG-CG 4.38Å; P545-E548 WeakPolarHBondContact CG-OE1 3.49Å; P545-E548 WeakPolarHBondContact O-CB 3.39Å; P545-E548 PolarHBondContact O-N 3.13Å
546	L	92.9	Very high	89.6	Confident	22 Å²	22	63.7 Å²	63.7	12%	0.115	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65	-29.6	-176.1	-179.3	60.7	0	0	0	112	P544 E548 L549 F550 L555 A621 V624 I628	P544-L546 PolarHBondContact O-N 2.64Å; L546-E548 PolarHBondContact O-N 3.41Å; L546-L549 PolarHBondContact O-N 3.06Å; L546-F550 HydrophobicContact CD1-CB 3.85Å; L546-F550 HydrophobicContact CG-CB 4.33Å; L546-F550 PolarHBondContact O-N 2.7Å; L546-L555 HydrophobicContact CD2-CD1 3.97Å; L546-L555 HydrophobicContact CD2-CD2 4.5Å; L546-A621 HydrophobicContact CD2-CB 3.78Å; L546-V624 HydrophobicContact CD1-CG1 4.02Å; L546-V624 HydrophobicContact CD2-CB 4.41Å; L546-V624 HydrophobicContact CD2-CG1 4.09Å; L546-I628 HydrophobicContact CD1-CD1 3.61Å
547	D	90.6	Very high	89.1	Confident	117 Å²	117	62.8 Å²	62.8	63%	0.626	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-69.5	-9.4	172.3	49.1	-47.3	0	0	0	114.2	V511 P545	V511-D547 WeakPolarHBondContact CG1-O 3.39Å; P545-D547 WeakPolarHBondContact CB-OD1 3.32Å; P545-D547 PolarHBondContact O-N 3.27Å
548	E	92.7	Very high	88.6	Confident	107 Å²	107	62.4 Å²	62.4	50%	0.5	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-89.6	-6.7	165.1	-66	177.5	-157.6	0	0	112.7	H507 P545 L546	H507-E548 PolarHBondContact CE1-O 3.29Å; H507-E548 VanDerWaalsContact CE1-O 3.27Å; H507-E548 PolarHBondContact NE2-O 2.91Å; P545-E548 HydrophobicContact CB-CG 4.2Å; P545-E548 WeakPolarHBondContact CD-OE1 3.39Å; P545-E548 HydrophobicContact CG-CG 4.38Å; P545-E548 WeakPolarHBondContact CG-OE1 3.49Å; P545-E548 WeakPolarHBondContact O-CB 3.39Å; P545-E548 PolarHBondContact O-N 3.13Å; L546-E548 PolarHBondContact O-N 3.41Å
549	L	94.8	Very high	88.3	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-33.7	-175.3	-65.1	178.4	0	0	0	114.4	A526 R529 L530 F543 P544 L546	A526-L549 HydrophobicContact CB-CB 4.25Å; R529-L549 HydrophobicContact CB-CD2 4.34Å; R529-L549 HydrophobicContact CG-CD2 3.89Å; L530-L549 HydrophobicContact CD1-CD1 4.01Å; L530-L549 HydrophobicContact CD2-CD1 4.04Å; L530-L549 HydrophobicContact CD2-CD2 4.16Å; L530-L549 HydrophobicContact CG-CD1 4.11Å; L530-L549 HydrophobicContact CG-CD2 4.2Å; F543-L549 HydrophobicContact CE1-CD1 4.04Å; F543-L549 HydrophobicContact CE2-CD1 3.99Å; F543-L549 HydrophobicContact CZ-CD1 3.55Å; P544-L549 HydrophobicContact CG-CD1 3.88Å; P544-L549 HydrophobicContact CG-CD2 4.06Å; P544-L549 HydrophobicContact CG-CG 3.96Å; L546-L549 PolarHBondContact O-N 3.06Å
550	F	94.1	Very high	87.9	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	32%	0.322	C	S	.	.	S	Bend	trans	-143.8	133.7	-163.9	-169.5	-92	0	0	0	111.3	E519 L522 L523 L546 G552 M554 V624 I628	E519-F550 HydrophobicContact CG-CZ 4.04Å; L522-F550 HydrophobicContact CB-CD2 4.09Å; L522-F550 HydrophobicContact CB-CE2 3.55Å; L522-F550 HydrophobicContact CB-CZ 4.33Å; L523-F550 HydrophobicContact CD2-CD2 4.35Å; L523-F550 HydrophobicContact CD2-CE2 3.86Å; L523-F550 HydrophobicContact CD2-CZ 4.46Å; L523-F550 HydrophobicContact CG-CE2 3.98Å; L546-F550 HydrophobicContact CD1-CB 3.85Å; L546-F550 HydrophobicContact CG-CB 4.33Å; L546-F550 PolarHBondContact O-N 2.7Å; F550-G552 PolarHBondContact O-N 3.44Å; F550-M554 HydrophobicContact CE1-CB 3.69Å; F550-M554 HydrophobicContact CE1-CG 4.48Å; F550-M554 HydrophobicContact CZ-CB 4.17Å; F550-V624 HydrophobicContact CD1-CG1 3.92Å; F550-V624 HydrophobicContact CD2-CG1 4.23Å; F550-V624 HydrophobicContact CE1-CG1 4.01Å; F550-V624 HydrophobicContact CE1-CG2 4.43Å; F550-V624 HydrophobicContact CE2-CG1 4.33Å; F550-V624 HydrophobicContact CG-CG1 4.02Å; F550-V624 HydrophobicContact CZ-CG1 4.22Å; F550-I628 HydrophobicContact CB-CD1 4.44Å
551	P	92.6	Very high	87.6	Confident	2 Å²	2	58 Å²	58	1%	0.013	32%	0.316	C	S	.	.			trans	-65	122.5	-172.8	22	-31.8	0	0	0	113.2	V510 L522 H553 M554	V510-P551 WeakPolarHBondContact O-CB 3.42Å; L522-P551 HydrophobicContact CD1-CG 4.02Å; L522-P551 HydrophobicContact CD2-CG 4.22Å; P551-H553 VanDerWaalsContact C-N 3.29Å; P551-H553 PolarHBondContact O-N 3.49Å; P551-M554 HydrophobicContact CG-CG 4.02Å; P551-M554 WeakPolarHBondContact O-CB 3.33Å; P551-M554 PolarHBondContact O-N 3.43Å; P551-M554 VanDerWaalsContact O-N 3.15Å
552	G	87.3	Confident	86.9	Confident	39 Å²	39	58.5 Å²	58.5	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-58.8	-32.8	-173.9	0	0	0	0	0	115.1	F550 M554 L555 E556	F550-G552 PolarHBondContact O-N 3.44Å; G552-M554 PolarHBondContact O-N 3.35Å; G552-L555 WeakPolarHBondContact O-CB 3.23Å; G552-L555 PolarHBondContact O-N 2.92Å; G552-E556 PolarHBondContact O-N 3.47Å
553	H	85.1	Confident	86.1	Confident	84 Å²	84	57.7 Å²	57.7	39%	0.389	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-27.3	-179.7	76.3	-101	0	0	0	112.9	P551 L555 E556 T557	P551-H553 VanDerWaalsContact C-N 3.29Å; P551-H553 PolarHBondContact O-N 3.49Å; H553-L555 VanDerWaalsContact C-N 3.31Å; H553-L555 PolarHBondContact O-N 3.43Å; H553-E556 PolarHBondContact O-N 3.01Å; H553-T557 PolarHBondContact O-N 3.29Å; H553-T557 PolarHBondContact O-OG1 3.14Å
554	M	86.4	Confident	84.7	Confident	39 Å²	39	58.9 Å²	58.9	19%	0.192	32%	0.323	C	S	.	.	H	α-helix	trans	-67.1	-33.8	176.1	-70	-64.9	-73.2	0	0	111.8	E519 L522 F550 P551 G552 T557 R558	E519-M554 HydrophobicContact CB-CE 4.08Å; E519-M554 HydrophobicContact CG-CE 4.1Å; L522-M554 HydrophobicContact CD1-CE 4.17Å; L522-M554 HydrophobicContact CD1-CG 4.05Å; L522-M554 HydrophobicContact CD1-SD 4.49Å; F550-M554 HydrophobicContact CE1-CB 3.69Å; F550-M554 HydrophobicContact CE1-CG 4.48Å; F550-M554 HydrophobicContact CZ-CB 4.17Å; P551-M554 HydrophobicContact CG-CG 4.02Å; P551-M554 WeakPolarHBondContact O-CB 3.33Å; P551-M554 PolarHBondContact O-N 3.43Å; P551-M554 VanDerWaalsContact O-N 3.15Å; G552-M554 PolarHBondContact O-N 3.35Å; M554-T557 PolarHBondContact O-N 2.97Å; M554-R558 PolarHBondContact O-N 2.88Å
555	L	85.2	Confident	82.5	Confident	22 Å²	22	60 Å²	60	12%	0.115	34%	0.335	C	S	.	.	H	α-helix	trans	-67.5	-38.3	173.1	-60.9	170.1	0	0	0	111.1	L546 G552 H553 R558 V559 L617 E620 A621 V624	L546-L555 HydrophobicContact CD2-CD1 3.97Å; L546-L555 HydrophobicContact CD2-CD2 4.5Å; G552-L555 WeakPolarHBondContact O-CB 3.23Å; G552-L555 PolarHBondContact O-N 2.92Å; H553-L555 VanDerWaalsContact C-N 3.31Å; H553-L555 PolarHBondContact O-N 3.43Å; L555-R558 PolarHBondContact O-N 3.1Å; L555-V559 WeakPolarHBondContact O-CG2 3.3Å; L555-V559 PolarHBondContact O-N 3.39Å; L555-L617 HydrophobicContact CB-CD2 4.33Å; L555-E620 HydrophobicContact CD2-CB 4.36Å; L555-A621 HydrophobicContact CD1-CB 4.33Å; L555-V624 HydrophobicContact CD2-CB 4.13Å; L555-V624 HydrophobicContact CD2-CG2 3.71Å
556	E	84.9	Confident	80.1	Confident	116 Å²	116	63.2 Å²	63.2	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-44.8	175.3	-57.8	-168.8	148.6	0	0	111.4	G552 H553 R558 V559 L560 L617	G552-E556 PolarHBondContact O-N 3.47Å; H553-E556 PolarHBondContact O-N 3.01Å; E556-R558 PolarHBondContact O-N 3.23Å; E556-V559 PolarHBondContact O-N 3.18Å; E556-L560 WeakPolarHBondContact O-CG 3.45Å; E556-L560 PolarHBondContact O-N 3.06Å; E556-L617 HydrophobicContact CG-CD2 4.29Å
557	T	83.7	Confident	77.6	Confident	66 Å²	66	69.6 Å²	69.6	41%	0.405	39%	0.385	S	S	.	.	H	α-helix	trans	-59.6	-43.9	174.4	-67.5	0	0	0	0	111.6	H553 M554 V559 L560 M561	H553-T557 PolarHBondContact O-N 3.29Å; H553-T557 PolarHBondContact O-OG1 3.14Å; M554-T557 PolarHBondContact O-N 2.97Å; T557-V559 PolarHBondContact O-N 3.48Å; T557-L560 PolarHBondContact O-N 3.21Å; T557-M561 HydrophobicContact CG2-CG 4.46Å; T557-M561 HydrophobicContact CG2-SD 4.16Å; T557-M561 WeakPolarHBondContact O-CG 2.93Å; T557-M561 PolarHBondContact O-N 3.33Å
558	R	83.2	Confident	75	Confident	60 Å²	60	68.8 Å²	68.8	23%	0.226	40%	0.395	C	S	.	.	H	α-helix	trans	-56.4	-47.4	172.4	-82.6	-164.5	169.1	-152.6	4.4	112.7	E519 M554 L555 E556 L560 M561 S562 E620	E519-R558 IonicContact OE1-CZ 3.97Å; E519-R558 IonicContact OE1-NE 2.82Å; E519-R558 IonicContact OE1-NH2 3.6Å; E519-R558 PolarHBondContact OE1-NH2 3.34Å; E519-R558 IonicContact OE2-CZ 3Å; E519-R558 IonicContact OE2-NE 2.66Å; E519-R558 PolarHBondContact OE2-NE 3.37Å; E519-R558 IonicContact OE2-NH2 3.94Å; M554-R558 PolarHBondContact O-N 2.88Å; L555-R558 PolarHBondContact O-N 3.1Å; E556-R558 PolarHBondContact O-N 3.23Å; R558-L560 VanDerWaalsContact C-N 3.32Å; R558-L560 PolarHBondContact O-N 3.18Å; R558-M561 PolarHBondContact O-N 3.28Å; R558-S562 PolarHBondContact O-N 3.2Å; R558-S562 PolarHBondContact O-OG 2.83Å; R558-E620 HydrophobicContact CB-CG 4.18Å; R558-E620 VanDerWaalsContact CD-OE2 3.27Å; R558-E620 WeakPolarHBondContact CD-OE2 3.35Å; R558-E620 IonicContact CZ-OE2 3.54Å; R558-E620 IonicContact NE-OE2 2.75Å; R558-E620 IonicContact NH1-OE2 3.69Å; R558-E620 PolarHBondContact NH1-OE2 3.43Å
559	V	84.2	Confident	72.1	Confident	2 Å²	2	68 Å²	68	1%	0.012	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-35.4	179.5	173	0	0	0	0	111.9	L555 E556 T557 S562 L563 L613 R616 L617 E620	L555-V559 WeakPolarHBondContact O-CG2 3.3Å; L555-V559 PolarHBondContact O-N 3.39Å; E556-V559 PolarHBondContact O-N 3.18Å; T557-V559 PolarHBondContact O-N 3.48Å; V559-S562 PolarHBondContact O-OG 3.17Å; V559-L563 HydrophobicContact CG1-CD1 4.23Å; V559-L563 WeakPolarHBondContact O-CB 3.12Å; V559-L563 WeakPolarHBondContact O-CD1 3.34Å; V559-L563 WeakPolarHBondContact O-CG 3.49Å; V559-L563 PolarHBondContact O-N 3.35Å; V559-L563 VanDerWaalsContact O-N 3.09Å; V559-L613 HydrophobicContact CG1-CD1 3.56Å; V559-R616 HydrophobicContact CG1-CB 3.94Å; V559-R616 HydrophobicContact CG2-CB 3.98Å; V559-L617 HydrophobicContact CB-CD2 4.41Å; V559-L617 HydrophobicContact CG2-CD2 3.77Å; V559-L617 HydrophobicContact CG2-CG 4.04Å; V559-E620 HydrophobicContact CG2-CB 4.4Å; V559-E620 HydrophobicContact CG2-CG 3.7Å
560	L	80.4	Confident	69.4	Low	113 Å²	113	73.1 Å²	73.1	59%	0.592	44%	0.44	S	S	*	.	H	α-helix	trans	-66	-44.7	172.3	-71.9	166.4	0	0	0	111.7	E556 T557 R558 L563 S564	E556-L560 WeakPolarHBondContact O-CG 3.45Å; E556-L560 PolarHBondContact O-N 3.06Å; T557-L560 PolarHBondContact O-N 3.21Å; R558-L560 VanDerWaalsContact C-N 3.32Å; R558-L560 PolarHBondContact O-N 3.18Å; L560-L563 WeakPolarHBondContact O-CB 3.17Å; L560-L563 PolarHBondContact O-N 3.39Å; L560-L563 VanDerWaalsContact O-N 3.16Å; L560-S564 PolarHBondContact O-N 2.86Å
561	M	77.4	Confident	66.6	Low	130 Å²	130	78.9 Å²	78.9	64%	0.64	48%	0.477	S	S	*	.	H	α-helix	trans	-62.5	-44.2	176.3	-69.5	-178.7	79.1	0	0	111.6	T557 R558 L563 S564 A565	T557-M561 HydrophobicContact CG2-CG 4.46Å; T557-M561 HydrophobicContact CG2-SD 4.16Å; T557-M561 WeakPolarHBondContact O-CG 2.93Å; T557-M561 PolarHBondContact O-N 3.33Å; R558-M561 PolarHBondContact O-N 3.28Å; M561-L563 PolarHBondContact O-N 3.1Å; M561-S564 PolarHBondContact O-N 3.5Å; M561-S564 PolarHBondContact O-OG 3.04Å; M561-A565 PolarHBondContact O-N 3.15Å
562	S	71.1	Confident	63.6	Low	41 Å²	41	84.7 Å²	84.7	29%	0.287	52%	0.517	S	S	.	.	H	α-helix	trans	-71.5	-11.7	176.7	74.1	0	0	0	0	113.9	R558 V559 R616	R558-S562 PolarHBondContact O-N 3.2Å; R558-S562 PolarHBondContact O-OG 2.83Å; V559-S562 PolarHBondContact O-OG 3.17Å; S562-R616 PolarHBondContact O-NH1 2.87Å; S562-R616 PolarHBondContact OG-NH1 3.07Å; S562-R616 VanDerWaalsContact OG-NH1 3.09Å
563	L	69.7	Low	60.9	Low	87 Å²	87	92 Å²	92	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-85.6	-28.4	166.5	-75.7	166.9	0	0	0	112.3	V559 L560 M561 L613	V559-L563 HydrophobicContact CG1-CD1 4.23Å; V559-L563 WeakPolarHBondContact O-CB 3.12Å; V559-L563 WeakPolarHBondContact O-CD1 3.34Å; V559-L563 WeakPolarHBondContact O-CG 3.49Å; V559-L563 PolarHBondContact O-N 3.35Å; V559-L563 VanDerWaalsContact O-N 3.09Å; L560-L563 WeakPolarHBondContact O-CB 3.17Å; L560-L563 PolarHBondContact O-N 3.39Å; L560-L563 VanDerWaalsContact O-N 3.16Å; M561-L563 PolarHBondContact O-N 3.1Å; L563-L613 HydrophobicContact CD1-CD1 4.28Å
564	S	58.5	Low	58.3	Low	92 Å²	92	94.8 Å²	94.8	64%	0.643	56%	0.563	S	S	*	*	H	α-helix	trans	-81.2	-17.5	-179.5	74.9	0	0	0	0	114.8	L560 M561	L560-S564 PolarHBondContact O-N 2.86Å; M561-S564 PolarHBondContact O-N 3.5Å; M561-S564 PolarHBondContact O-OG 3.04Å
565	A	45.4	Very low	55.6	Low	55 Å²	55	97.9 Å²	97.9	46%	0.455	60%	0.595	S	S	.	*	S	Bend	trans	-62.6	129.2	178.9	0	0	0	0	0	111.8	M561 Q567	M561-A565 PolarHBondContact O-N 3.15Å; A565-Q567 PolarHBondContact O-N 2.69Å; A565-Q567 VanDerWaalsContact O-N 3.1Å
566	P	41.5	Very low	52.8	Low	131 Å²	131	100 Å²	100	85%	0.851	62%	0.621	S	S	*	*			trans	-68.1	111.4	-175.5	26.7	-34.1	0	0	0	111.2	A568	P566-A568 PolarHBondContact O-N 2.58Å
567	Q	41.5	Very low	50.2	Low	155 Å²	155	102.9 Å²	102.9	72%	0.724	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-70.4	121	175	-60.3	-157.9	-34.7	0	0	110.2	A565 A569	A565-Q567 PolarHBondContact O-N 2.69Å; A565-Q567 VanDerWaalsContact O-N 3.1Å; Q567-A569 PolarHBondContact O-N 3.08Å
568	A	36.1	Very low	47.3	Very low	101 Å²	101	105.9 Å²	105.9	84%	0.835	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-60.9	120.5	172.3	0	0	0	0	0	109.8	P566	P566-A568 PolarHBondContact O-N 2.58Å
569	A	32	Very low	44.9	Very low	90 Å²	90	109 Å²	109	74%	0.744	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-66	139.4	179.9	0	0	0	0	0	110.9	Q567	Q567-A569 PolarHBondContact O-N 3.08Å
570	P	36.8	Very low	42.7	Very low	109 Å²	109	114.9 Å²	114.9	71%	0.708	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.5	152.9	174.7	29.1	-34.8	0	0	0	111	C572	P570-C572 PolarHBondContact O-N 3.2Å
571	P	35.1	Very low	40.2	Very low	122 Å²	122	113.1 Å²	113.1	79%	0.792	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-69.2	120.7	-171.4	-18.6	32.1	0	0	0	113	Q573	P571-Q573 PolarHBondContact O-N 3.43Å
572	C	29.4	Very low	37.9	Very low	124 Å²	124	113.1 Å²	113.1	84%	0.838	73%	0.726	S	S	*	*			trans	-71.1	111.3	164.8	-66.6	0	0	0	0	110	P570	P570-C572 PolarHBondContact O-N 3.2Å
573	Q	30.9	Very low	35.9	Very low	194 Å²	194	119.3 Å²	119.3	91%	0.907	75%	0.75	S	S	*	*			trans	-81.4	145.3	164.6	-67.9	-173.5	-10	0	0	110.2	P571	P571-Q573 PolarHBondContact O-N 3.43Å
574	V	31.2	Very low	34	Very low	142 Å²	142	124.7 Å²	124.7	86%	0.861	76%	0.764	S	S	*	*			trans	-123.4	107.7	-170.9	-178.5	0	0	0	0	111.2
575	A	28.6	Very low	32.7	Very low	104 Å²	104	128.6 Å²	128.6	86%	0.86	77%	0.77	S	S	*	*			trans	179.4	144.9	154.8	0	0	0	0	0	107.7
576	G	27	Very low	32.4	Very low	65 Å²	65	131.3 Å²	131.3	67%	0.67	78%	0.783	S	S	*	*			cis	158.6	147.9	-4.3	0	0	0	0	0	109.6
577	Q	29.7	Very low	32.4	Very low	178 Å²	178	131.9 Å²	131.9	83%	0.832	78%	0.784	S	S	*	*			trans	65.8	147.3	176.1	-64.1	-177.4	-102	0	0	115.8
578	D	24.2	Very low	31.9	Very low	129 Å²	129	128 Å²	128	69%	0.69	79%	0.786	S	S	*	*			cis	-146.2	166.3	-8.9	-103.1	-30.3	0	0	0	110.5
579	C	32.6	Very low	32.2	Very low	125 Å²	125	131.2 Å²	131.2	85%	0.845	79%	0.788	S	S	*	*			trans	-136.3	127.7	173.6	-78.5	0	0	0	0	110.9
580	P	38.7	Very low	32.5	Very low	126 Å²	126	134.3 Å²	134.3	82%	0.818	79%	0.791	S	S	*	*				-146.2	162.6	122.6	35.3	-20.2	0	0	0	113.6
581	A	27.7	Very low	32.9	Very low	76 Å²	76	134.5 Å²	134.5	63%	0.628	80%	0.802	S	S	*	*			cis	-172.9	160.6	-21.7	0	0	0	0	0	108.9
582	T	28.8	Very low	33.2	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	80%	0.795	S	S	*	*			trans	53.8	126.2	149.2	52.7	0	0	0	0	119.6
583	Q	28.8	Very low	33.9	Very low	171 Å²	171	130.8 Å²	130.8	80%	0.799	79%	0.786	S	S	*	*			cis	-159.8	166.4	40.9	-67.7	-168.3	26	0	0	114.4
584	R	29.6	Very low	34.6	Very low	200 Å²	200	128.4 Å²	128.4	76%	0.755	78%	0.779	S	S	*	*			trans	-9.5	149.7	140.7	-80.5	165.3	165.6	154.6	-2.4	116.8
585	F	30.2	Very low	35.2	Very low	173 Å²	173	132.1 Å²	132.1	76%	0.759	78%	0.777	S	S	*	*			cis	-172.9	-173.2	31.9	-107.5	-42.3	0	0	0	107.8
586	P	40.8	Very low	36	Very low	113 Å²	113	130.7 Å²	130.7	73%	0.734	76%	0.761	S	S	*	*			cis	-129.3	-158.1	-28.2	38	-18.1	0	0	0	112.4
587	T	41.7	Very low	37	Very low	143 Å²	143	134 Å²	134	88%	0.877	76%	0.759	S	S	*	*			trans	-66.6	143.8	177.9	48.6	0	0	0	0	116.1
588	G	30.5	Very low	38.1	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	74%	0.74	S	S	*	*			trans	-175.1	121.9	163	0	0	0	0	0	115.4
589	L	41.8	Very low	39.6	Very low	168 Å²	168	125.2 Å²	125.2	88%	0.88	73%	0.731	S	S	*	*			trans	28.5	108	153.7	-70.9	155.1	0	0	0	119.9
590	L	39.6	Very low	40.9	Very low	154 Å²	154	123.2 Å²	123.2	81%	0.806	72%	0.715	S	S	*	*				172.5	90.2	113.7	-92.2	174.4	0	0	0	111.6
591	A	43.3	Very low	42.1	Very low	113 Å²	113	121.6 Å²	121.6	93%	0.934	70%	0.703	S	S	*	*			trans	-81.9	113	162	0	0	0	0	0	108.8
592	G	42.8	Very low	43.7	Very low	62 Å²	62	120.6 Å²	120.6	64%	0.639	69%	0.694	S	S	*	*	S	Bend	trans	178.5	-38.8	176.9	0	0	0	0	0	117.6
593	T	44	Very low	45.5	Very low	106 Å²	106	120 Å²	120	65%	0.65	68%	0.682	S	S	*	*	S	Bend	trans	-110.3	-10.1	-163.2	44.7	0	0	0	0	116.6	W595	T593-W595 VanDerWaalsContact C-N 3.26Å; T593-W595 PolarHBondContact O-N 2.98Å
594	L	44.4	Very low	47.6	Very low	144 Å²	144	118.8 Å²	118.8	75%	0.754	67%	0.674	S	S	*	*	H	α-helix	trans	-69.5	-14.7	-173.1	-94.2	161.5	0	0	0	115.6	S596 S598	L594-S596 PolarHBondContact O-N 3.09Å; L594-S598 PolarHBondContact O-OG 2.82Å
595	W	45.1	Very low	49.4	Very low	220 Å²	220	114.8 Å²	114.8	83%	0.833	66%	0.664	S	S	*	*	H	α-helix	trans	-78.6	-14.7	-177.3	-60.5	92.8	0	0	0	114.7	T593 S598	T593-W595 VanDerWaalsContact C-N 3.26Å; T593-W595 PolarHBondContact O-N 2.98Å; W595-S598 WeakPolarHBondContact CA-OG 3.23Å; W595-S598 PolarHBondContact O-OG 3.44Å; W595-S598 VanDerWaalsContact O-OG 3.07Å
596	S	45.4	Very low	51.4	Low	75 Å²	75	113 Å²	113	52%	0.524	66%	0.656	S	S	.	*	H	α-helix	trans	-84.5	-45	-179.2	179.1	0	0	0	0	112.9	L594 S598 A599 T600	L594-S596 PolarHBondContact O-N 3.09Å; S596-S598 PolarHBondContact O-N 2.86Å; S596-A599 PolarHBondContact O-N 3.21Å; S596-T600 PolarHBondContact O-N 3.3Å; S596-T600 VanDerWaalsContact O-N 3.14Å; S596-T600 PolarHBondContact O-OG1 3.49Å; S596-T600 VanDerWaalsContact O-OG1 3.06Å
597	H	47.6	Very low	53	Low	134 Å²	134	113.3 Å²	113.3	62%	0.62	65%	0.649	S	S	*	*	H	α-helix	trans	-69.8	-33	179.6	-69.3	-72.9	0	0	0	112.3	T600 V601	H597-T600 WeakPolarHBondContact CA-OG1 3.4Å; H597-T600 PolarHBondContact O-OG1 2.98Å; H597-V601 WeakPolarHBondContact O-CB 3.34Å; H597-V601 VanDerWaalsContact O-CG2 3.28Å; H597-V601 WeakPolarHBondContact O-CG2 3.29Å; H597-V601 PolarHBondContact O-N 3.44Å
598	S	53.4	Low	54.5	Low	63 Å²	63	112.3 Å²	112.3	44%	0.441	64%	0.635	S	S	.	*	H	α-helix	trans	-63.7	-42.4	172	49	0	0	0	0	112.4	L594 W595 S596 A602	L594-S598 PolarHBondContact O-OG 2.82Å; W595-S598 WeakPolarHBondContact CA-OG 3.23Å; W595-S598 PolarHBondContact O-OG 3.44Å; W595-S598 VanDerWaalsContact O-OG 3.07Å; S596-S598 PolarHBondContact O-N 2.86Å; S598-A602 VanDerWaalsContact O-CB 3.22Å; S598-A602 WeakPolarHBondContact O-CB 3.38Å; S598-A602 PolarHBondContact O-N 3.14Å
599	A	54.5	Low	56.5	Low	59 Å²	59	113 Å²	113	49%	0.488	62%	0.62	S	S	.	*	H	α-helix	trans	-66.1	-41.6	178.9	0	0	0	0	0	112.5	S596 A602 H603	S596-A599 PolarHBondContact O-N 3.21Å; A599-A602 PolarHBondContact O-N 2.93Å; A599-H603 WeakPolarHBondContact O-CB 3.16Å; A599-H603 PolarHBondContact O-N 2.97Å
600	T	60.4	Low	58.3	Low	83 Å²	83	108 Å²	108	51%	0.509	60%	0.595	S	S	.	*	H	α-helix	trans	-71	-37.1	178.2	45.4	0	0	0	0	112.9	S596 H597 H603 K604	S596-T600 PolarHBondContact O-N 3.3Å; S596-T600 VanDerWaalsContact O-N 3.14Å; S596-T600 PolarHBondContact O-OG1 3.49Å; S596-T600 VanDerWaalsContact O-OG1 3.06Å; H597-T600 WeakPolarHBondContact CA-OG1 3.4Å; H597-T600 PolarHBondContact O-OG1 2.98Å; T600-H603 PolarHBondContact O-N 2.84Å; T600-K604 PolarHBondContact O-N 3.3Å
601	V	63.6	Low	60.4	Low	93 Å²	93	108.4 Å²	108.4	56%	0.564	59%	0.59	S	S	*	*	H	α-helix	trans	-65.5	-45.5	171	170.5	0	0	0	0	111.1	H597 H603 K604 Q605	H597-V601 WeakPolarHBondContact O-CB 3.34Å; H597-V601 VanDerWaalsContact O-CG2 3.28Å; H597-V601 WeakPolarHBondContact O-CG2 3.29Å; H597-V601 PolarHBondContact O-N 3.44Å; V601-H603 VanDerWaalsContact C-N 3.32Å; V601-H603 PolarHBondContact O-N 2.93Å; V601-K604 PolarHBondContact O-N 2.92Å; V601-Q605 WeakPolarHBondContact O-CB 3.34Å; V601-Q605 PolarHBondContact O-N 3.28Å
602	A	60.9	Low	62.1	Low	55 Å²	55	109.4 Å²	109.4	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-61.6	-38.3	176.8	0	0	0	0	0	112.3	S598 A599 Q605 K606	S598-A602 VanDerWaalsContact O-CB 3.22Å; S598-A602 WeakPolarHBondContact O-CB 3.38Å; S598-A602 PolarHBondContact O-N 3.14Å; A599-A602 PolarHBondContact O-N 2.93Å; A602-Q605 PolarHBondContact O-N 3.43Å; A602-K606 WeakPolarHBondContact O-CB 3.4Å; A602-K606 PolarHBondContact O-N 3.32Å
603	H	66.5	Low	64	Low	117 Å²	117	110 Å²	110	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-66.4	-41.3	175.1	-167.2	-67.3	0	0	0	112.2	A599 T600 V601 K606 M607	A599-H603 WeakPolarHBondContact O-CB 3.16Å; A599-H603 PolarHBondContact O-N 2.97Å; T600-H603 PolarHBondContact O-N 2.84Å; V601-H603 VanDerWaalsContact C-N 3.32Å; V601-H603 PolarHBondContact O-N 2.93Å; H603-K606 PolarHBondContact O-N 3.17Å; H603-M607 VanDerWaalsContact CE1-SD 3.58Å; H603-M607 WeakPolarHBondContact O-CG 3.1Å; H603-M607 PolarHBondContact O-N 3.38Å
604	K	72.8	Confident	65.9	Low	145 Å²	145	113.5 Å²	113.5	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-62.2	-46.9	173.4	-174.9	-174.5	174.3	-170.6	0	111	T600 V601 K606 M607 E608	T600-K604 PolarHBondContact O-N 3.3Å; V601-K604 PolarHBondContact O-N 2.92Å; K604-K606 VanDerWaalsContact C-N 3.33Å; K604-K606 PolarHBondContact O-N 3.06Å; K604-M607 PolarHBondContact O-N 2.05Å; K604-E608 WeakPolarHBondContact O-CB 3.45Å; K604-E608 PolarHBondContact O-N 3.28Å
605	Q	67.3	Low	67.8	Low	116 Å²	116	110.3 Å²	110.3	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-35.5	179.4	-168.6	172.8	6.2	0	0	112	V601 A602 E608 N609	V601-Q605 WeakPolarHBondContact O-CB 3.34Å; V601-Q605 PolarHBondContact O-N 3.28Å; A602-Q605 PolarHBondContact O-N 3.43Å; Q605-E608 PolarHBondContact O-N 3.34Å; Q605-N609 WeakPolarHBondContact O-CB 3.48Å; Q605-N609 VanDerWaalsContact O-CG 3.25Å; Q605-N609 PolarHBondContact O-N 3.46Å; Q605-N609 PolarHBondContact O-ND2 2.71Å
606	K	73.7	Confident	69.8	Low	136 Å²	136	101.8 Å²	101.8	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-63.1	-50.2	170.2	-176	176.2	177.9	179.6	0	111.4	A602 H603 K604 E608 N609 D610	A602-K606 WeakPolarHBondContact O-CB 3.4Å; A602-K606 PolarHBondContact O-N 3.32Å; H603-K606 PolarHBondContact O-N 3.17Å; K604-K606 VanDerWaalsContact C-N 3.33Å; K604-K606 PolarHBondContact O-N 3.06Å; K606-E608 PolarHBondContact O-N 3.31Å; K606-N609 PolarHBondContact O-N 3.16Å; K606-D610 WeakPolarHBondContact O-CB 3.26Å; K606-D610 VanDerWaalsContact O-CG 3.25Å; K606-D610 PolarHBondContact O-N 3.1Å
607	M	73.3	Confident	71.7	Confident	119 Å²	119	100.6 Å²	100.6	59%	0.586	50%	0.504	S	S	*	.	H	α-helix	trans	-59.9	-34.7	177.3	-75.3	-179	137.4	0	0	113	H603 K604 K611	H603-M607 VanDerWaalsContact CE1-SD 3.58Å; H603-M607 WeakPolarHBondContact O-CG 3.1Å; H603-M607 PolarHBondContact O-N 3.38Å; K604-M607 PolarHBondContact O-N 2.05Å; M607-K611 VanDerWaalsContact O-CB 3.29Å; M607-K611 WeakPolarHBondContact O-CB 3.19Å; M607-K611 PolarHBondContact O-N 3.21Å
608	E	73.9	Confident	73.7	Confident	123 Å²	123	102 Å²	102	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-72.6	-39.3	176.7	-167.8	154.5	-161.4	0	0	112	K604 Q605 K606 K611 R612	K604-E608 WeakPolarHBondContact O-CB 3.45Å; K604-E608 PolarHBondContact O-N 3.28Å; Q605-E608 PolarHBondContact O-N 3.34Å; K606-E608 PolarHBondContact O-N 3.31Å; E608-K611 PolarHBondContact O-N 2.7Å; E608-R612 WeakPolarHBondContact O-CB 3.49Å; E608-R612 PolarHBondContact O-N 3.39Å
609	N	72.9	Confident	75.4	Confident	87 Å²	87	105.4 Å²	105.4	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-65.3	-45.8	170.7	-75.5	-18.1	0	0	0	112.3	Q605 K606 K611 R612 L613	Q605-N609 WeakPolarHBondContact O-CB 3.48Å; Q605-N609 VanDerWaalsContact O-CG 3.25Å; Q605-N609 PolarHBondContact O-N 3.46Å; Q605-N609 PolarHBondContact O-ND2 2.71Å; K606-N609 PolarHBondContact O-N 3.16Å; N609-K611 VanDerWaalsContact C-N 3.29Å; N609-K611 PolarHBondContact O-N 3.36Å; N609-R612 CarbonylContact O-C 3.56Å; N609-R612 WeakPolarHBondContact O-CB 3.39Å; N609-R612 PolarHBondContact O-N 2.88Å; N609-R612 VanDerWaalsContact O-N 3.1Å; N609-L613 WeakPolarHBondContact O-CB 3.16Å; N609-L613 PolarHBondContact O-N 2.69Å
610	D	79.8	Confident	77.2	Confident	63 Å²	63	104.3 Å²	104.3	34%	0.337	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-40.6	176.5	-69.6	-2.7	0	0	0	110.6	K606 L613 R614	K606-D610 WeakPolarHBondContact O-CB 3.26Å; K606-D610 VanDerWaalsContact O-CG 3.25Å; K606-D610 PolarHBondContact O-N 3.1Å; D610-L613 PolarHBondContact O-N 2.89Å; D610-R614 WeakPolarHBondContact O-CB 3.43Å; D610-R614 VanDerWaalsContact O-CG 3.27Å; D610-R614 WeakPolarHBondContact O-CG 3.48Å; D610-R614 PolarHBondContact O-N 3Å
611	K	82.1	Confident	78.7	Confident	163 Å²	163	101.5 Å²	101.5	71%	0.709	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-41.4	173.6	-175.2	-178.1	177.5	-173.4	0	111.8	M607 E608 N609 S615	M607-K611 VanDerWaalsContact O-CB 3.29Å; M607-K611 WeakPolarHBondContact O-CB 3.19Å; M607-K611 PolarHBondContact O-N 3.21Å; E608-K611 PolarHBondContact O-N 2.7Å; N609-K611 VanDerWaalsContact C-N 3.29Å; N609-K611 PolarHBondContact O-N 3.36Å; K611-S615 PolarHBondContact O-N 3.22Å
612	R	80.7	Confident	80.1	Confident	135 Å²	135	99.6 Å²	99.6	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.4	-167.4	-178.4	-171.2	-162.8	3	111.8	E608 N609 S615 R616	E608-R612 WeakPolarHBondContact O-CB 3.49Å; E608-R612 PolarHBondContact O-N 3.39Å; N609-R612 CarbonylContact O-C 3.56Å; N609-R612 WeakPolarHBondContact O-CB 3.39Å; N609-R612 PolarHBondContact O-N 2.88Å; N609-R612 VanDerWaalsContact O-N 3.1Å; R612-S615 WeakPolarHBondContact O-CB 3.3Å; R612-S615 PolarHBondContact O-N 3.08Å; R612-R616 PolarHBondContact O-N 3.08Å
613	L	80.8	Confident	81.6	Confident	75 Å²	75	99.1 Å²	99.1	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-48.9	175.9	-169.4	75.7	0	0	0	111	V559 L563 N609 D610 S615 R616 L617	V559-L613 HydrophobicContact CG1-CD1 3.56Å; L563-L613 HydrophobicContact CD1-CD1 4.28Å; N609-L613 WeakPolarHBondContact O-CB 3.16Å; N609-L613 PolarHBondContact O-N 2.69Å; D610-L613 PolarHBondContact O-N 2.89Å; L613-S615 VanDerWaalsContact C-N 3.25Å; L613-S615 PolarHBondContact O-N 3.29Å; L613-R616 PolarHBondContact O-N 2.9Å; L613-R616 VanDerWaalsContact O-N 3.14Å; L613-L617 HydrophobicContact CG-CD1 4.37Å; L613-L617 PolarHBondContact O-N 3.29Å
614	R	84.2	Confident	83	Confident	178 Å²	178	93.5 Å²	93.5	67%	0.672	45%	0.451	S	S	*	.	H	α-helix	trans	-61.1	-31.4	174.2	-70.9	173.5	-175.1	-155.2	0.7	113.2	D610 K618	D610-R614 WeakPolarHBondContact O-CB 3.43Å; D610-R614 VanDerWaalsContact O-CG 3.27Å; D610-R614 WeakPolarHBondContact O-CG 3.48Å; D610-R614 PolarHBondContact O-N 3Å; R614-K618 WeakPolarHBondContact O-CG 3.47Å; R614-K618 PolarHBondContact O-N 3.47Å
615	S	85.9	Confident	84.1	Confident	77 Å²	77	88.2 Å²	88.2	54%	0.538	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-44.4	173.8	-160	0	0	0	0	111.5	K611 R612 L613 K618 E619	K611-S615 PolarHBondContact O-N 3.22Å; R612-S615 WeakPolarHBondContact O-CB 3.3Å; R612-S615 PolarHBondContact O-N 3.08Å; L613-S615 VanDerWaalsContact C-N 3.25Å; L613-S615 PolarHBondContact O-N 3.29Å; S615-K618 PolarHBondContact O-N 2.74Å; S615-E619 PolarHBondContact O-N 3.08Å; S615-E619 VanDerWaalsContact O-N 3.11Å
616	R	85.3	Confident	85.4	Confident	42 Å²	42	86.2 Å²	86.2	16%	0.158	43%	0.427	C	S	.	.	H	α-helix	trans	-65.7	-43	176.7	-74.7	-175.6	165.6	-143	-3.2	112.9	V559 S562 R612 L613 K618 E619 E620	V559-R616 HydrophobicContact CG1-CB 3.94Å; V559-R616 HydrophobicContact CG2-CB 3.98Å; S562-R616 PolarHBondContact O-NH1 2.87Å; S562-R616 PolarHBondContact OG-NH1 3.07Å; S562-R616 VanDerWaalsContact OG-NH1 3.09Å; R612-R616 PolarHBondContact O-N 3.08Å; L613-R616 PolarHBondContact O-N 2.9Å; L613-R616 VanDerWaalsContact O-N 3.14Å; R616-K618 PolarHBondContact O-N 3.37Å; R616-E619 WeakPolarHBondContact O-CB 3.4Å; R616-E619 PolarHBondContact O-N 2.88Å; R616-E620 PolarHBondContact O-N 3.02Å
617	L	86.9	Confident	86.5	Confident	49 Å²	49	81 Å²	81	26%	0.257	41%	0.409	S	S	.	.	H	α-helix	trans	-57.7	-36	175.3	-75.5	166	0	0	0	111.9	L555 E556 V559 L613 A621	L555-L617 HydrophobicContact CB-CD2 4.33Å; E556-L617 HydrophobicContact CG-CD2 4.29Å; V559-L617 HydrophobicContact CB-CD2 4.41Å; V559-L617 HydrophobicContact CG2-CD2 3.77Å; V559-L617 HydrophobicContact CG2-CG 4.04Å; L613-L617 HydrophobicContact CG-CD1 4.37Å; L613-L617 PolarHBondContact O-N 3.29Å; L617-A621 WeakPolarHBondContact O-CB 3.28Å; L617-A621 PolarHBondContact O-N 3.25Å
618	K	88.6	Confident	87.7	Confident	163 Å²	163	75.3 Å²	75.3	71%	0.709	38%	0.381	S	S	*	.	H	α-helix	trans	-71.3	-34.9	173.5	-74.4	-174.2	173.8	-160.2	0	113.7	R614 S615 R616 A622	R614-K618 WeakPolarHBondContact O-CG 3.47Å; R614-K618 PolarHBondContact O-N 3.47Å; S615-K618 PolarHBondContact O-N 2.74Å; R616-K618 PolarHBondContact O-N 3.37Å; K618-A622 WeakPolarHBondContact O-CB 3.37Å; K618-A622 PolarHBondContact O-N 3.38Å
619	E	89.9	Confident	88.7	Confident	136 Å²	136	71.5 Å²	71.5	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-68.3	-47.7	177.2	-169.1	170.2	-166.4	0	0	110.9	S615 R616 A622 A623	S615-E619 PolarHBondContact O-N 3.08Å; S615-E619 VanDerWaalsContact O-N 3.11Å; R616-E619 WeakPolarHBondContact O-CB 3.4Å; R616-E619 PolarHBondContact O-N 2.88Å; E619-A622 PolarHBondContact O-N 3.31Å; E619-A623 PolarHBondContact O-N 3.5Å
620	E	91.1	Very high	89.8	Confident	35 Å²	35	72.3 Å²	72.3	16%	0.164	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-42.2	174	-64.1	-64.8	176.5	0	0	112.1	L555 R558 V559 R616 A622 A623 V624	L555-E620 HydrophobicContact CD2-CB 4.36Å; R558-E620 HydrophobicContact CB-CG 4.18Å; R558-E620 VanDerWaalsContact CD-OE2 3.27Å; R558-E620 WeakPolarHBondContact CD-OE2 3.35Å; R558-E620 IonicContact CZ-OE2 3.54Å; R558-E620 IonicContact NE-OE2 2.75Å; R558-E620 IonicContact NH1-OE2 3.69Å; R558-E620 PolarHBondContact NH1-OE2 3.43Å; V559-E620 HydrophobicContact CG2-CB 4.4Å; V559-E620 HydrophobicContact CG2-CG 3.7Å; R616-E620 PolarHBondContact O-N 3.02Å; E620-A622 VanDerWaalsContact C-N 3.3Å; E620-A622 PolarHBondContact O-N 3.04Å; E620-A623 PolarHBondContact O-N 3.35Å; E620-V624 WeakPolarHBondContact O-CB 3.38Å; E620-V624 WeakPolarHBondContact O-CG2 3.44Å; E620-V624 PolarHBondContact O-N 3.17Å
621	A	92.1	Very high	90.6	Very high	24 Å²	24	72.4 Å²	72.4	20%	0.198	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-37.3	175.3	0	0	0	0	0	112.3	L546 L555 L617 T625	L546-A621 HydrophobicContact CD2-CB 3.78Å; L555-A621 HydrophobicContact CD1-CB 4.33Å; L617-A621 WeakPolarHBondContact O-CB 3.28Å; L617-A621 PolarHBondContact O-N 3.25Å; A621-T625 VanDerWaalsContact O-CB 3.24Å; A621-T625 WeakPolarHBondContact O-CB 3.48Å; A621-T625 PolarHBondContact O-N 2.8Å; A621-T625 PolarHBondContact O-OG1 3.36Å
622	A	93.3	Very high	91.4	Very high	54 Å²	54	64.7 Å²	64.7	45%	0.446	33%	0.328	S	S	.	.	H	α-helix	trans	-68.9	-37.9	174.3	0	0	0	0	0	112.2	K618 E619 E620 T626	K618-A622 WeakPolarHBondContact O-CB 3.37Å; K618-A622 PolarHBondContact O-N 3.38Å; E619-A622 PolarHBondContact O-N 3.31Å; E620-A622 VanDerWaalsContact C-N 3.3Å; E620-A622 PolarHBondContact O-N 3.04Å; A622-T626 WeakPolarHBondContact O-CB 3.39Å; A622-T626 PolarHBondContact O-N 3.45Å; A622-T626 PolarHBondContact O-OG1 2.99Å
623	A	93.7	Very high	92.1	Very high	44 Å²	44	62.2 Å²	62.2	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-47	174.4	0	0	0	0	0	112	E619 E620 T626 A627	E619-A623 PolarHBondContact O-N 3.5Å; E620-A623 PolarHBondContact O-N 3.35Å; A623-T626 PolarHBondContact O-N 2.99Å; A623-A627 WeakPolarHBondContact O-CB 3.46Å; A623-A627 PolarHBondContact O-N 3.1Å
624	V	94.9	Very high	92.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-46.7	174.5	166.6	0	0	0	0	111.1	L523 L546 F550 L555 E620 T626 A627 I628	L523-V624 HydrophobicContact CD2-CG1 3.91Å; L546-V624 HydrophobicContact CD1-CG1 4.02Å; L546-V624 HydrophobicContact CD2-CB 4.41Å; L546-V624 HydrophobicContact CD2-CG1 4.09Å; F550-V624 HydrophobicContact CD1-CG1 3.92Å; F550-V624 HydrophobicContact CD2-CG1 4.23Å; F550-V624 HydrophobicContact CE1-CG1 4.01Å; F550-V624 HydrophobicContact CE1-CG2 4.43Å; F550-V624 HydrophobicContact CE2-CG1 4.33Å; F550-V624 HydrophobicContact CG-CG1 4.02Å; F550-V624 HydrophobicContact CZ-CG1 4.22Å; L555-V624 HydrophobicContact CD2-CB 4.13Å; L555-V624 HydrophobicContact CD2-CG2 3.71Å; E620-V624 WeakPolarHBondContact O-CB 3.38Å; E620-V624 WeakPolarHBondContact O-CG2 3.44Å; E620-V624 PolarHBondContact O-N 3.17Å; V624-T626 VanDerWaalsContact C-N 3.31Å; V624-T626 PolarHBondContact O-N 2.86Å; V624-A627 PolarHBondContact O-N 2.7Å; V624-A627 VanDerWaalsContact O-N 3.11Å; V624-I628 HydrophobicContact CG1-CD1 3.82Å; V624-I628 HydrophobicContact CG1-CG1 4.48Å; V624-I628 WeakPolarHBondContact O-CG1 3.18Å; V624-I628 PolarHBondContact O-N 2.81Å
625	T	95.4	Very high	93.4	Very high	33 Å²	33	54.4 Å²	54.4	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-55.2	-46.3	174.8	-61.6	0	0	0	0	111.3	F543 A621 A627 I628 L629	F543-T625 HydrophobicContact CD1-CG2 4.31Å; F543-T625 HydrophobicContact CE1-CG2 3.78Å; F543-T625 HydrophobicContact CE2-CG2 4.28Å; F543-T625 HydrophobicContact CZ-CG2 3.77Å; A621-T625 VanDerWaalsContact O-CB 3.24Å; A621-T625 WeakPolarHBondContact O-CB 3.48Å; A621-T625 PolarHBondContact O-N 2.8Å; A621-T625 PolarHBondContact O-OG1 3.36Å; T625-A627 PolarHBondContact O-N 2.96Å; T625-I628 PolarHBondContact O-N 3.43Å; T625-L629 HydrophobicContact CG2-CD1 4.1Å; T625-L629 HydrophobicContact CG2-CG 4.47Å; T625-L629 VanDerWaalsContact O-CG 3.3Å; T625-L629 WeakPolarHBondContact O-CG 3.33Å; T625-L629 PolarHBondContact O-N 3.4Å
626	T	95.5	Very high	93.8	Very high	75 Å²	75	53.9 Å²	53.9	46%	0.46	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.4	-53.5	0	0	0	0	111.3	A622 A623 V624 I628 L629 E630	A622-T626 WeakPolarHBondContact O-CB 3.39Å; A622-T626 PolarHBondContact O-N 3.45Å; A622-T626 PolarHBondContact O-OG1 2.99Å; A623-T626 PolarHBondContact O-N 2.99Å; V624-T626 VanDerWaalsContact C-N 3.31Å; V624-T626 PolarHBondContact O-N 2.86Å; T626-I628 VanDerWaalsContact C-N 3.32Å; T626-I628 PolarHBondContact O-N 2.85Å; T626-L629 PolarHBondContact O-N 2.81Å; T626-E630 PolarHBondContact O-N 3.33Å
627	A	96.7	Very high	94.1	Very high	26 Å²	26	54.9 Å²	54.9	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-28.8	178.5	0	0	0	0	0	113.7	L523 A623 V624 T625 R631	L523-A627 HydrophobicContact CD1-CB 4.29Å; L523-A627 HydrophobicContact CD2-CB 4.09Å; A623-A627 WeakPolarHBondContact O-CB 3.46Å; A623-A627 PolarHBondContact O-N 3.1Å; V624-A627 PolarHBondContact O-N 2.7Å; V624-A627 VanDerWaalsContact O-N 3.11Å; T625-A627 PolarHBondContact O-N 2.96Å; A627-R631 WeakPolarHBondContact O-CG 3.22Å; A627-R631 PolarHBondContact O-NH1 3.1Å
628	I	97.3	Very high	94.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-72.8	-45.8	170.6	-66.1	165	0	0	0	110.1	L523 A526 A527 L530 F543 L546 F550 V624 T625 T626 E630 R631 W632	L523-I628 HydrophobicContact CD2-CD1 4.33Å; L523-I628 HydrophobicContact CD2-CG1 3.7Å; A526-I628 HydrophobicContact CB-CD1 3.74Å; A526-I628 HydrophobicContact CB-CG1 3.87Å; A526-I628 HydrophobicContact CB-CG2 4.1Å; A527-I628 HydrophobicContact CB-CG2 4.46Å; L530-I628 HydrophobicContact CD1-CG2 3.6Å; F543-I628 HydrophobicContact CE2-CG2 4.35Å; L546-I628 HydrophobicContact CD1-CD1 3.61Å; F550-I628 HydrophobicContact CB-CD1 4.44Å; V624-I628 HydrophobicContact CG1-CD1 3.82Å; V624-I628 HydrophobicContact CG1-CG1 4.48Å; V624-I628 WeakPolarHBondContact O-CG1 3.18Å; V624-I628 PolarHBondContact O-N 2.81Å; T625-I628 PolarHBondContact O-N 3.43Å; T626-I628 VanDerWaalsContact C-N 3.32Å; T626-I628 PolarHBondContact O-N 2.85Å; I628-E630 PolarHBondContact O-N 2.89Å; I628-R631 PolarHBondContact O-N 3.41Å; I628-W632 PolarHBondContact O-N 2.92Å
629	L	96	Very high	94.8	Very high	43 Å²	43	51.2 Å²	51.2	23%	0.225	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-41.4	-179.3	-72.4	175.1	0	0	0	113	F537 F543 T625 T626 W632 K633	F537-L629 HydrophobicContact CD2-CD2 4.46Å; F537-L629 HydrophobicContact CE2-CD2 4.08Å; F543-L629 HydrophobicContact CD2-CD2 3.7Å; F543-L629 HydrophobicContact CD2-CG 4.39Å; F543-L629 HydrophobicContact CE2-CD2 3.81Å; F543-L629 HydrophobicContact CE2-CG 4.16Å; T625-L629 HydrophobicContact CG2-CD1 4.1Å; T625-L629 HydrophobicContact CG2-CG 4.47Å; T625-L629 VanDerWaalsContact O-CG 3.3Å; T625-L629 WeakPolarHBondContact O-CG 3.33Å; T625-L629 PolarHBondContact O-N 3.4Å; T626-L629 PolarHBondContact O-N 2.81Å; L629-W632 HydrophobicContact CD2-CE3 3.99Å; L629-W632 HydrophobicContact CD2-CZ3 4.31Å; L629-W632 PolarHBondContact O-N 3.44Å; L629-K633 WeakPolarHBondContact O-CG 3.22Å; L629-K633 PolarHBondContact O-N 2.85Å; L629-K633 VanDerWaalsContact O-N 3.08Å
630	E	96.1	Very high	95	Very high	104 Å²	104	47.4 Å²	47.4	49%	0.486	31%	0.309	S	S	.	.	H	α-helix	trans	-66.9	-35.3	175.5	-62.4	-46.2	134.5	0	0	112.4	T626 I628 K633 G634	T626-E630 PolarHBondContact O-N 3.33Å; I628-E630 PolarHBondContact O-N 2.89Å; E630-K633 IonicContact OE1-NZ 3.36Å; E630-K633 PolarHBondContact OE1-NZ 2.86Å; E630-K633 WeakPolarHBondContact OE2-CD 3.33Å; E630-K633 IonicContact OE2-NZ 2.7Å; E630-K633 PolarHBondContact OE2-NZ 3.48Å; E630-G634 PolarHBondContact O-N 2.76Å
631	R	97.3	Very high	95.1	Very high	64 Å²	64	50.9 Å²	50.9	24%	0.242	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-43	173.1	-76.2	179.7	-177.9	77.6	-3.6	111.8	E520 A527 A627 I628 K633 G634 L635	E520-R631 IonicContact OE1-CZ 2.71Å; E520-R631 IonicContact OE1-NH2 3.98Å; E520-R631 PolarHBondContact OE1-NH2 2.93Å; E520-R631 IonicContact OE2-CZ 2.73Å; E520-R631 IonicContact OE2-NH2 3.81Å; E520-R631 PolarHBondContact OE2-NH2 3.38Å; A527-R631 HydrophobicContact CB-CB 3.56Å; A627-R631 WeakPolarHBondContact O-CG 3.22Å; A627-R631 PolarHBondContact O-NH1 3.1Å; I628-R631 PolarHBondContact O-N 3.41Å; R631-K633 PolarHBondContact O-N 2.72Å; R631-G634 WeakPolarHBondContact O-CA 3.41Å; R631-G634 PolarHBondContact O-N 3.03Å; R631-L635 PolarHBondContact O-N 3.03Å
632	W	97.1	Very high	95.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-40.1	179	179.9	23.1	0	0	0	112.3	A527 L530 M534 G535 F537 A541 I628 L629 G634 L635	A527-W632 HydrophobicContact CB-CB 4.21Å; L530-W632 HydrophobicContact CB-CD2 3.7Å; L530-W632 HydrophobicContact CB-CE3 3.94Å; L530-W632 HydrophobicContact CB-CG 4.05Å; L530-W632 HydrophobicContact CB-CZ2 4.36Å; L530-W632 HydrophobicContact CB-CZ3 4.35Å; L530-W632 HydrophobicContact CD1-CD2 4.16Å; L530-W632 HydrophobicContact CD1-CE3 3.68Å; L530-W632 HydrophobicContact CD1-CZ3 4.2Å; L530-W632 HydrophobicContact CD2-CZ3 4.42Å; L530-W632 HydrophobicContact CG-CE3 4.29Å; M534-W632 HydrophobicContact CB-CH2 4.14Å; M534-W632 HydrophobicContact CB-CZ2 3.77Å; M534-W632 HydrophobicContact CE-CH2 4.5Å; M534-W632 HydrophobicContact CG-CH2 4.47Å; M534-W632 HydrophobicContact CG-CZ2 4.47Å; M534-W632 HydrophobicContact SD-CH2 3.64Å; M534-W632 HydrophobicContact SD-CZ2 4.2Å; M534-W632 HydrophobicContact SD-CZ3 4.35Å; G535-W632 WeakPolarHBondContact O-CZ2 3.49Å; G535-W632 PolarHBondContact O-NE1 3.5Å; F537-W632 HydrophobicContact CB-CD2 4.09Å; F537-W632 HydrophobicContact CB-CG 4.32Å; F537-W632 HydrophobicContact CB-CZ2 4.48Å; F537-W632 HydrophobicContact CD2-CD2 4.11Å; F537-W632 AromaticContact CD2-CE3 3.69Å; F537-W632 HydrophobicContact CD2-CE3 3.69Å; F537-W632 HydrophobicContact CD2-CH2 4.38Å; F537-W632 AromaticContact CD2-CZ3 3.85Å; F537-W632 HydrophobicContact CD2-CZ3 3.85Å; F537-W632 HydrophobicContact CE2-CZ3 4.48Å; A541-W632 HydrophobicContact CB-CH2 3.72Å; A541-W632 HydrophobicContact CB-CZ3 4.47Å; I628-W632 PolarHBondContact O-N 2.92Å; L629-W632 HydrophobicContact CD2-CE3 3.99Å; L629-W632 HydrophobicContact CD2-CZ3 4.31Å; L629-W632 PolarHBondContact O-N 3.44Å; W632-G634 PolarHBondContact O-N 2.99Å; W632-L635 WeakPolarHBondContact O-CB 3.36Å; W632-L635 PolarHBondContact O-N 2.89Å
633	K	95.9	Very high	95.5	Very high	83 Å²	83	51.2 Å²	51.2	36%	0.361	31%	0.312	S	S	.	.	H	α-helix	trans	-56.3	-32.8	170.4	-69.5	170.1	-162.3	172.7	0	113.1	F537 L629 E630 R631 L635	F537-K633 HydrophobicContact CB-CG 4.08Å; F537-K633 HydrophobicContact CD1-CD 4.37Å; F537-K633 HydrophobicContact CD1-CG 3.58Å; F537-K633 HydrophobicContact CD2-CG 4.22Å; F537-K633 HydrophobicContact CE1-CD 4.43Å; F537-K633 HydrophobicContact CE1-CG 4.09Å; F537-K633 HydrophobicContact CG-CG 3.65Å; L629-K633 WeakPolarHBondContact O-CG 3.22Å; L629-K633 PolarHBondContact O-N 2.85Å; L629-K633 VanDerWaalsContact O-N 3.08Å; E630-K633 IonicContact OE1-NZ 3.36Å; E630-K633 PolarHBondContact OE1-NZ 2.86Å; E630-K633 WeakPolarHBondContact OE2-CD 3.33Å; E630-K633 IonicContact OE2-NZ 2.7Å; E630-K633 PolarHBondContact OE2-NZ 3.48Å; R631-K633 PolarHBondContact O-N 2.72Å; K633-L635 VanDerWaalsContact C-N 3.26Å; K633-L635 PolarHBondContact O-N 2.96Å
634	G	95.9	Very high	95.6	Very high	64 Å²	64	50.3 Å²	50.3	66%	0.66	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.8	176.9	0	0	0	0	0	115	E630 R631 W632	E630-G634 PolarHBondContact O-N 2.76Å; R631-G634 WeakPolarHBondContact O-CA 3.41Å; R631-G634 PolarHBondContact O-N 3.03Å; W632-G634 PolarHBondContact O-N 2.99Å
635	L	96.4	Very high	95.7	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.131	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	6.8	179.7	-61.8	173	0	0	0	113.5	A527 L528 Q531 R631 W632 K633 G637 H638	A527-L635 HydrophobicContact CB-CD1 4.12Å; L528-L635 HydrophobicContact CD2-CD1 3.84Å; L528-L635 HydrophobicContact CD2-CD2 3.96Å; L528-L635 HydrophobicContact CG-CD1 4.08Å; Q531-L635 HydrophobicContact CB-CB 4.3Å; Q531-L635 HydrophobicContact CB-CD1 3.86Å; Q531-L635 HydrophobicContact CG-CB 4Å; Q531-L635 HydrophobicContact CG-CD1 4.39Å; Q531-L635 PolarHBondContact NE2-O 2.82Å; R631-L635 PolarHBondContact O-N 3.03Å; W632-L635 WeakPolarHBondContact O-CB 3.36Å; W632-L635 PolarHBondContact O-N 2.89Å; K633-L635 VanDerWaalsContact C-N 3.26Å; K633-L635 PolarHBondContact O-N 2.96Å; L635-G637 PolarHBondContact O-N 2.8Å; L635-H638 HydrophobicContact CB-CB 4.5Å; L635-H638 VanDerWaalsContact O-CB 3.22Å; L635-H638 WeakPolarHBondContact O-CB 3.45Å; L635-H638 PolarHBondContact O-CD2 3.31Å; L635-H638 PolarHBondContact O-N 3.25Å
636	A	94.1	Very high	95.8	Very high	66 Å²	66	51.6 Å²	51.6	55%	0.545	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	124.9	-176.3	0	0	0	0	0	112.5	D536	D536-A636 WeakPolarHBondContact OD1-CA 3.06Å
637	G	92.9	Very high	95.9	Very high	63 Å²	63	48.1 Å²	48.1	65%	0.649	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-5.8	-174.5	0	0	0	0	0	115.3	D536 L635	D536-G637 PolarHBondContact OD1-N 3.26Å; D536-G637 PolarHBondContact OD2-N 3.3Å; L635-G637 PolarHBondContact O-N 2.8Å
638	H	94.6	Very high	95.9	Very high	86 Å²	86	46.9 Å²	46.9	40%	0.398	28%	0.282	S	S	.	.			trans	-70	129.4	171.2	-78.6	-137.9	0	0	0	110.2	Q531 L635	Q531-H638 HydrophobicContact CG-CB 4.06Å; Q531-H638 PolarHBondContact NE2-O 3.46Å; L635-H638 HydrophobicContact CB-CB 4.5Å; L635-H638 VanDerWaalsContact O-CB 3.22Å; L635-H638 WeakPolarHBondContact O-CB 3.45Å; L635-H638 PolarHBondContact O-CD2 3.31Å; L635-H638 PolarHBondContact O-N 3.25Å
639	S	95.4	Very high	95.9	Very high	49 Å²	49	51.1 Å²	51.1	34%	0.343	31%	0.308	S	S	.	.			trans	-71.6	160	173.9	84.2	0	0	0	0	111.4	R641 D642 S643	S639-R641 PolarHBondContact O-N 3.35Å; S639-R641 PolarHBondContact OG-N 3.17Å; S639-D642 VanDerWaalsContact CB-OD2 3.29Å; S639-D642 WeakPolarHBondContact CB-OD2 3.33Å; S639-D642 PolarHBondContact O-N 3.1Å; S639-D642 PolarHBondContact OG-N 3.13Å; S639-D642 VanDerWaalsContact OG-N 3.13Å; S639-D642 PolarHBondContact OG-OD2 2.95Å; S639-S643 WeakPolarHBondContact O-CB 3.39Å; S639-S643 PolarHBondContact O-N 3.28Å; S639-S643 PolarHBondContact O-OG 3.02Å
640	S	93.6	Very high	96	Very high	56 Å²	56	50.6 Å²	50.6	39%	0.392	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-36.9	173.4	-175.9	0	0	0	0	111.6	T532 S643 M644	T532-S640 WeakPolarHBondContact CG2-OG 3.5Å; T532-S640 PolarHBondContact O-OG 3.46Å; S640-S643 PolarHBondContact O-N 2.99Å; S640-M644 WeakPolarHBondContact O-CG 3.34Å; S640-M644 PolarHBondContact O-N 3.31Å
641	R	94.1	Very high	95.9	Very high	108 Å²	108	45.8 Å²	45.8	41%	0.408	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-52.7	173.8	-179.3	-163.3	177.6	128.8	13.9	112.1	V494 D495 S639 S643 M644 A645	V494-R641 HydrophobicContact CG1-CG 3.73Å; D495-R641 VanDerWaalsContact CG-CZ 3.49Å; D495-R641 IonicContact OD1-CZ 2.65Å; D495-R641 VanDerWaalsContact OD1-CZ 3.22Å; D495-R641 IonicContact OD1-NE 2.79Å; D495-R641 IonicContact OD1-NH1 3.32Å; D495-R641 PolarHBondContact OD1-NH1 3.42Å; D495-R641 IonicContact OD1-NH2 2.83Å; D495-R641 IonicContact OD2-CZ 2.74Å; D495-R641 IonicContact OD2-NH1 3.47Å; D495-R641 PolarHBondContact OD2-NH1 3.13Å; D495-R641 IonicContact OD2-NH2 2.68Å; D495-R641 PolarHBondContact OD2-NH2 3.45Å; S639-R641 PolarHBondContact O-N 3.35Å; S639-R641 PolarHBondContact OG-N 3.17Å; R641-S643 VanDerWaalsContact C-N 3.25Å; R641-S643 PolarHBondContact O-N 3.46Å; R641-M644 PolarHBondContact O-N 2.87Å; R641-A645 WeakPolarHBondContact O-CB 3.5Å; R641-A645 PolarHBondContact O-N 3.3Å
642	D	95.2	Very high	95.8	Very high	85 Å²	85	45.6 Å²	45.6	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-30.9	-177.2	-52.5	-50.9	0	0	0	111.1	S639 A645 A646	S639-D642 VanDerWaalsContact CB-OD2 3.29Å; S639-D642 WeakPolarHBondContact CB-OD2 3.33Å; S639-D642 PolarHBondContact O-N 3.1Å; S639-D642 PolarHBondContact OG-N 3.13Å; S639-D642 VanDerWaalsContact OG-N 3.13Å; S639-D642 PolarHBondContact OG-OD2 2.95Å; D642-A645 PolarHBondContact O-N 2.81Å; D642-A646 WeakPolarHBondContact O-CB 3.36Å; D642-A646 PolarHBondContact O-N 2.91Å
643	S	97.2	Very high	95.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.7	-45.2	175.1	-56.9	0	0	0	0	112	Q531 T532 S639 S640 R641 A645 A646 Y647	Q531-S643 VanDerWaalsContact CG-OG 3.22Å; Q531-S643 WeakPolarHBondContact CG-OG 3.24Å; T532-S643 VanDerWaalsContact OG1-CB 3.25Å; T532-S643 WeakPolarHBondContact OG1-CB 3.29Å; S639-S643 WeakPolarHBondContact O-CB 3.39Å; S639-S643 PolarHBondContact O-N 3.28Å; S639-S643 PolarHBondContact O-OG 3.02Å; S640-S643 PolarHBondContact O-N 2.99Å; R641-S643 VanDerWaalsContact C-N 3.25Å; R641-S643 PolarHBondContact O-N 3.46Å; S643-A645 VanDerWaalsContact C-N 3.33Å; S643-A645 PolarHBondContact O-N 2.91Å; S643-A646 PolarHBondContact O-N 2.95Å; S643-Y647 VanDerWaalsContact O-CB 3.3Å; S643-Y647 WeakPolarHBondContact O-CB 3.38Å; S643-Y647 PolarHBondContact O-N 3.4Å
644	M	96.9	Very high	95.4	Very high	25 Å²	25	48.8 Å²	48.8	12%	0.123	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-40.4	171.4	-71.4	-174.4	-70.9	0	0	112	Y499 L500 F503 T532 S640 R641 Y647 L648	Y499-M644 HydrophobicContact CE1-CB 4.29Å; L500-M644 HydrophobicContact CD1-SD 4.18Å; F503-M644 HydrophobicContact CD1-CG 3.77Å; F503-M644 HydrophobicContact CD1-SD 3.7Å; F503-M644 HydrophobicContact CD2-CB 4.19Å; F503-M644 HydrophobicContact CD2-CG 3.92Å; F503-M644 HydrophobicContact CE1-CG 3.78Å; F503-M644 HydrophobicContact CE1-SD 4.03Å; F503-M644 HydrophobicContact CE2-CB 4.46Å; F503-M644 HydrophobicContact CE2-CG 3.95Å; F503-M644 HydrophobicContact CG-CB 4.31Å; F503-M644 HydrophobicContact CG-CG 3.83Å; F503-M644 HydrophobicContact CG-SD 4.1Å; F503-M644 HydrophobicContact CZ-CG 3.88Å; T532-M644 HydrophobicContact CG2-CG 3.52Å; T532-M644 HydrophobicContact CG2-SD 4.08Å; S640-M644 WeakPolarHBondContact O-CG 3.34Å; S640-M644 PolarHBondContact O-N 3.31Å; R641-M644 PolarHBondContact O-N 2.87Å; M644-Y647 WeakPolarHBondContact O-CB 3.45Å; M644-Y647 PolarHBondContact O-N 3.21Å; M644-L648 PolarHBondContact O-N 3.39Å
645	A	96.4	Very high	95.1	Very high	25 Å²	25	50.9 Å²	50.9	21%	0.207	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-44.4	178.5	0	0	0	0	0	112.3	V494 Y499 R641 D642 S643 T649	V494-A645 HydrophobicContact CG1-CB 4.5Å; Y499-A645 WeakPolarHBondContact OH-CA 3.39Å; R641-A645 WeakPolarHBondContact O-CB 3.5Å; R641-A645 PolarHBondContact O-N 3.3Å; D642-A645 PolarHBondContact O-N 2.81Å; S643-A645 VanDerWaalsContact C-N 3.33Å; S643-A645 PolarHBondContact O-N 2.91Å; A645-T649 WeakPolarHBondContact O-CB 3.25Å; A645-T649 PolarHBondContact O-N 3.03Å; A645-T649 PolarHBondContact O-OG1 2.93Å
646	A	97.3	Very high	94.8	Very high	35 Å²	35	49.9 Å²	49.9	29%	0.289	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-41.1	173.6	0	0	0	0	0	112	L528 D642 S643 T649 I650	L528-A646 HydrophobicContact CD1-CB 4.05Å; L528-A646 HydrophobicContact CD2-CB 3.93Å; D642-A646 WeakPolarHBondContact O-CB 3.36Å; D642-A646 PolarHBondContact O-N 2.91Å; S643-A646 PolarHBondContact O-N 2.95Å; A646-T649 WeakPolarHBondContact O-CB 3.33Å; A646-T649 PolarHBondContact O-N 2.98Å; A646-I650 WeakPolarHBondContact O-CG1 3.41Å; A646-I650 PolarHBondContact O-N 2.83Å
647	Y	98.1	Very high	94.7	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-52.4	177.3	-170.4	-75.5	0	0	0	111.4	F503 C506 H507 L525 L528 R529 S643 M644 T649 I650 A651	F503-Y647 AromaticContact CD2-CD1 3.75Å; F503-Y647 HydrophobicContact CD2-CD1 3.75Å; F503-Y647 HydrophobicContact CD2-CE1 4.3Å; F503-Y647 AromaticContact CD2-CG 3.93Å; F503-Y647 HydrophobicContact CD2-CG 3.93Å; F503-Y647 AromaticContact CE2-CD1 3.8Å; F503-Y647 HydrophobicContact CE2-CD1 3.8Å; F503-Y647 AromaticContact CE2-CD2 3.81Å; F503-Y647 HydrophobicContact CE2-CD2 3.81Å; F503-Y647 HydrophobicContact CE2-CE1 4.27Å; F503-Y647 HydrophobicContact CE2-CE2 4.27Å; F503-Y647 AromaticContact CE2-CG 3.57Å; F503-Y647 HydrophobicContact CE2-CG 3.57Å; C506-Y647 HydrophobicContact CB-CE1 4.5Å; H507-Y647 WeakPolarHBondContact CA-OH 3.32Å; H507-Y647 HydrophobicContact CB-CE1 4.41Å; H507-Y647 PolarHBondContact ND1-OH 3.07Å; L525-Y647 HydrophobicContact CB-CD2 4.12Å; L525-Y647 HydrophobicContact CB-CE2 3.65Å; L525-Y647 HydrophobicContact CD2-CD1 3.71Å; L525-Y647 HydrophobicContact CD2-CD2 3.61Å; L525-Y647 HydrophobicContact CD2-CE1 3.84Å; L525-Y647 HydrophobicContact CD2-CE2 3.74Å; L525-Y647 HydrophobicContact CD2-CG 3.57Å; L525-Y647 WeakPolarHBondContact CD2-O 3.42Å; L525-Y647 HydrophobicContact CG-CD2 4.49Å; L525-Y647 HydrophobicContact CG-CE2 4.29Å; L525-Y647 WeakPolarHBondContact O-CD2 3.38Å; L525-Y647 WeakPolarHBondContact O-CE2 3.44Å; L528-Y647 HydrophobicContact CB-CD2 3.94Å; R529-Y647 HydrophobicContact CB-CE2 4.21Å; S643-Y647 VanDerWaalsContact O-CB 3.3Å; S643-Y647 WeakPolarHBondContact O-CB 3.38Å; S643-Y647 PolarHBondContact O-N 3.4Å; M644-Y647 WeakPolarHBondContact O-CB 3.45Å; M644-Y647 PolarHBondContact O-N 3.21Å; Y647-T649 VanDerWaalsContact C-N 3.31Å; Y647-T649 PolarHBondContact O-N 3.22Å; Y647-I650 PolarHBondContact O-N 3.01Å; Y647-A651 PolarHBondContact O-N 3.35Å
648	L	97.2	Very high	94.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-27.6	178.3	-75	174.9	0	0	0	112.7	Y499 L502 F503 C506 M644 A651 R652 F657	Y499-L648 HydrophobicContact CD1-CD1 4.17Å; Y499-L648 HydrophobicContact CD2-CD1 4.48Å; Y499-L648 HydrophobicContact CE1-CD1 3.67Å; Y499-L648 HydrophobicContact CE2-CD1 4.03Å; L502-L648 HydrophobicContact CB-CD1 4.47Å; L502-L648 HydrophobicContact CD2-CD1 4.21Å; L502-L648 HydrophobicContact CD2-CD2 4.48Å; L502-L648 HydrophobicContact CG-CD1 4.2Å; L502-L648 HydrophobicContact CG-CD2 4.07Å; F503-L648 HydrophobicContact CB-CD1 4.04Å; F503-L648 HydrophobicContact CB-CG 4.41Å; C506-L648 HydrophobicContact CB-CD2 3.85Å; M644-L648 PolarHBondContact O-N 3.39Å; L648-A651 PolarHBondContact O-N 2.89Å; L648-R652 VanDerWaalsContact O-CB 3.3Å; L648-R652 WeakPolarHBondContact O-CB 3.46Å; L648-R652 WeakPolarHBondContact O-CD 3.46Å; L648-R652 WeakPolarHBondContact O-CG 3.48Å; L648-R652 PolarHBondContact O-N 2.91Å; L648-F657 HydrophobicContact CD2-CE2 4.23Å; L648-F657 HydrophobicContact CD2-CZ 3.98Å
649	T	96.6	Very high	94.5	Very high	89 Å²	89	42.8 Å²	42.8	55%	0.546	24%	0.242	S	C	.	.	H	α-helix	trans	-66	-38.6	172.5	-59.8	0	0	0	0	111.9	A645 A646 Y647	A645-T649 WeakPolarHBondContact O-CB 3.25Å; A645-T649 PolarHBondContact O-N 3.03Å; A645-T649 PolarHBondContact O-OG1 2.93Å; A646-T649 WeakPolarHBondContact O-CB 3.33Å; A646-T649 PolarHBondContact O-N 2.98Å; Y647-T649 VanDerWaalsContact C-N 3.31Å; Y647-T649 PolarHBondContact O-N 3.22Å
650	I	96.9	Very high	94.4	Very high	33 Å²	33	42.4 Å²	42.4	17%	0.169	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-49.3	173.4	-66	166.4	0	0	0	110.1	D521 A524 L525 L528 A646 Y647 R652 Q653	D521-I650 HydrophobicContact CB-CG2 3.89Å; A524-I650 HydrophobicContact CB-CD1 4.11Å; L525-I650 HydrophobicContact CD1-CG2 4.23Å; L525-I650 HydrophobicContact CD2-CB 3.95Å; L525-I650 HydrophobicContact CD2-CD1 4.49Å; L525-I650 HydrophobicContact CD2-CG2 3.97Å; L525-I650 HydrophobicContact CG-CG2 4.01Å; L528-I650 HydrophobicContact CD1-CD1 3.73Å; A646-I650 WeakPolarHBondContact O-CG1 3.41Å; A646-I650 PolarHBondContact O-N 2.83Å; Y647-I650 PolarHBondContact O-N 3.01Å; I650-R652 VanDerWaalsContact C-N 3.29Å; I650-R652 PolarHBondContact O-N 3Å; I650-Q653 WeakPolarHBondContact O-CB 3.35Å; I650-Q653 WeakPolarHBondContact O-CG 3.33Å; I650-Q653 PolarHBondContact O-N 3.45Å
651	A	95.5	Very high	94.3	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-32.7	-178.5	0	0	0	0	0	113.8	C506 L515 Y647 L648 Q653 W654 F657	C506-A651 WeakPolarHBondContact SG-CB 3.45Å; L515-A651 HydrophobicContact CD1-CB 4.42Å; L515-A651 HydrophobicContact CD2-CB 4.08Å; Y647-A651 PolarHBondContact O-N 3.35Å; L648-A651 PolarHBondContact O-N 2.89Å; A651-Q653 PolarHBondContact O-N 2.94Å; A651-W654 PolarHBondContact O-N 3.49Å; A651-F657 HydrophobicContact CB-CD2 4.06Å; A651-F657 HydrophobicContact CB-CE2 3.85Å; A651-F657 WeakPolarHBondContact O-CD2 3.4Å
652	R	94	Very high	94.2	Very high	61 Å²	61	36.1 Å²	36.1	23%	0.23	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-6.3	175.6	-74.9	171.8	-165.2	-150.5	1.6	114.7	A489 D490 L648 I650 W654 F657	A489-R652 VanDerWaalsContact O-CZ 3.26Å; A489-R652 PolarHBondContact O-NH1 3.2Å; A489-R652 PolarHBondContact O-NH2 3.28Å; D490-R652 IonicContact OD1-CZ 3.51Å; D490-R652 IonicContact OD1-NH1 3.53Å; D490-R652 PolarHBondContact OD1-NH1 2.94Å; L648-R652 VanDerWaalsContact O-CB 3.3Å; L648-R652 WeakPolarHBondContact O-CB 3.46Å; L648-R652 WeakPolarHBondContact O-CD 3.46Å; L648-R652 WeakPolarHBondContact O-CG 3.48Å; L648-R652 PolarHBondContact O-N 2.91Å; I650-R652 VanDerWaalsContact C-N 3.29Å; I650-R652 PolarHBondContact O-N 3Å; R652-W654 PolarHBondContact O-N 3.36Å; R652-F657 HydrophobicContact CG-CD1 3.69Å; R652-F657 HydrophobicContact CG-CD2 4.22Å; R652-F657 HydrophobicContact CG-CE1 3.72Å; R652-F657 HydrophobicContact CG-CE2 4.24Å; R652-F657 HydrophobicContact CG-CG 3.96Å; R652-F657 HydrophobicContact CG-CZ 4.01Å
653	Q	93.1	Very high	93.9	Very high	139 Å²	139	36.1 Å²	36.1	65%	0.65	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.6	172.7	-62.6	-177.7	33.2	0	0	112.2	I650 A651	I650-Q653 WeakPolarHBondContact O-CB 3.35Å; I650-Q653 WeakPolarHBondContact O-CG 3.33Å; I650-Q653 PolarHBondContact O-N 3.45Å; A651-Q653 PolarHBondContact O-N 2.94Å
654	W	93	Very high	93.5	Very high	13 Å²	13	36.1 Å²	36.1	5%	0.049	20%	0.204	C	C	.	.	S	Bend	trans	-76.2	123	171.2	175.6	47.4	0	0	0	111	M509 L515 P516 A651 R652 G656 F657 C659 L661 Y690 S695	M509-W654 HydrophobicContact CE-CZ3 4.18Å; L515-W654 HydrophobicContact CD1-CE3 3.69Å; L515-W654 HydrophobicContact CD1-CZ3 4.28Å; P516-W654 HydrophobicContact CG-CD2 4.18Å; P516-W654 HydrophobicContact CG-CH2 4.42Å; P516-W654 HydrophobicContact CG-CZ2 3.82Å; A651-W654 PolarHBondContact O-N 3.49Å; R652-W654 PolarHBondContact O-N 3.36Å; W654-G656 VanDerWaalsContact CE2-CA 3.49Å; W654-G656 VanDerWaalsContact CE3-C 3.49Å; W654-G656 WeakPolarHBondContact CZ3-O 3.47Å; W654-G656 PolarHBondContact O-N 3.09Å; W654-G656 VanDerWaalsContact O-N 3.14Å; W654-F657 HydrophobicContact CE3-CB 4.43Å; W654-F657 VanDerWaalsContact O-CB 3.22Å; W654-F657 WeakPolarHBondContact O-CB 3.34Å; W654-F657 PolarHBondContact O-N 3Å; W654-C659 VanDerWaalsContact CH2-SG 3.52Å; W654-L661 HydrophobicContact CH2-CD1 3.93Å; W654-L661 HydrophobicContact CH2-CD2 4.12Å; W654-L661 HydrophobicContact CH2-CG 4.2Å; W654-L661 HydrophobicContact CZ2-CD2 4.43Å; W654-Y690 HydrophobicContact CZ2-CD1 4.45Å; W654-Y690 HydrophobicContact CZ2-CE1 4.05Å; W654-Y690 HydrophobicContact CZ2-CE2 4.39Å; W654-Y690 AromaticContact NE1-CE1 3.78Å; W654-S695 PolarHBondContact NE1-O 2.77Å
655	S	88.9	Confident	92.4	Very high	107 Å²	107	38.7 Å²	38.7	75%	0.748	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.7	-179.6	55.7	0	0	0	0	114.8
656	G	89.9	Confident	90.7	Very high	4 Å²	4	40.4 Å²	40.4	4%	0.041	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	2.9	171.1	0	0	0	0	0	114.9	W654 G658 C659 Y690	W654-G656 VanDerWaalsContact CE2-CA 3.49Å; W654-G656 VanDerWaalsContact CE3-C 3.49Å; W654-G656 WeakPolarHBondContact CZ3-O 3.47Å; W654-G656 PolarHBondContact O-N 3.09Å; W654-G656 VanDerWaalsContact O-N 3.14Å; G656-G658 PolarHBondContact O-N 2.84Å; G656-C659 WeakPolarHBondContact O-CB 3.27Å; G656-C659 PolarHBondContact O-N 3.37Å; G656-C659 PolarHBondContact O-SG 2.79Å; G656-Y690 VanDerWaalsContact CA-OH 3.28Å; G656-Y690 WeakPolarHBondContact CA-OH 3.31Å
657	F	92.6	Very high	88.9	Confident	42 Å²	42	39.2 Å²	39.2	18%	0.184	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	130.3	-179.6	-177.7	-88.3	0	0	0	111.5	L486 A489 L502 C506 L648 A651 R652 W654	L486-F657 HydrophobicContact CD2-CD1 4.3Å; L486-F657 HydrophobicContact CD2-CE1 3.85Å; A489-F657 HydrophobicContact CB-CE1 4.42Å; L502-F657 HydrophobicContact CD1-CE1 4.18Å; L502-F657 HydrophobicContact CD1-CZ 3.84Å; L502-F657 HydrophobicContact CD2-CE1 4.3Å; L502-F657 HydrophobicContact CD2-CZ 4.18Å; L502-F657 HydrophobicContact CG-CZ 4.14Å; C506-F657 HydrophobicContact CB-CE2 4.48Å; L648-F657 HydrophobicContact CD2-CE2 4.23Å; L648-F657 HydrophobicContact CD2-CZ 3.98Å; A651-F657 HydrophobicContact CB-CD2 4.06Å; A651-F657 HydrophobicContact CB-CE2 3.85Å; A651-F657 WeakPolarHBondContact O-CD2 3.4Å; R652-F657 HydrophobicContact CG-CD1 3.69Å; R652-F657 HydrophobicContact CG-CD2 4.22Å; R652-F657 HydrophobicContact CG-CE1 3.72Å; R652-F657 HydrophobicContact CG-CE2 4.24Å; R652-F657 HydrophobicContact CG-CG 3.96Å; R652-F657 HydrophobicContact CG-CZ 4.01Å; W654-F657 HydrophobicContact CE3-CB 4.43Å; W654-F657 VanDerWaalsContact O-CB 3.22Å; W654-F657 WeakPolarHBondContact O-CB 3.34Å; W654-F657 PolarHBondContact O-N 3Å
658	G	90.4	Very high	87	Confident	19 Å²	19	42 Å²	42	20%	0.196	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	-6.2	-174.7	0	0	0	0	0	115.4	G656 Y743	G656-G658 PolarHBondContact O-N 2.84Å; G658-Y743 PolarHBondContact O-OH 2.98Å
659	C	92.6	Very high	85	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.034	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-76.8	148	168.6	82.5	0	0	0	0	111.8	W654 G656 L661 V682 A683	W654-C659 VanDerWaalsContact CH2-SG 3.52Å; G656-C659 WeakPolarHBondContact O-CB 3.27Å; G656-C659 PolarHBondContact O-N 3.37Å; G656-C659 PolarHBondContact O-SG 2.79Å; C659-L661 VanDerWaalsContact SG-CD2 3.53Å; C659-V682 CarbonylContact C-O 3.51Å; C659-V682 VanDerWaalsContact CA-O 3.29Å; C659-V682 WeakPolarHBondContact CA-O 3.41Å; C659-A683 HydrophobicContact CB-CB 3.77Å
660	T	93.1	Very high	82.6	Confident	41 Å²	41	42.2 Å²	42.2	25%	0.252	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.4	163.3	-49.3	0	0	0	0	108.3	Y662 G681 V682 L739	T660-Y662 HydrophobicContact CG2-CD2 4.49Å; T660-Y662 HydrophobicContact CG2-CE2 3.76Å; T660-G681 WeakPolarHBondContact O-CA 3.17Å; T660-V682 PolarHBondContact N-O 2.82Å; T660-V682 PolarHBondContact O-N 2.88Å; T660-L739 VanDerWaalsContact CB-CD2 3.45Å; T660-L739 HydrophobicContact CG2-CD2 4.06Å; T660-L739 WeakPolarHBondContact OG1-CD2 3.33Å
661	L	92.2	Very high	80.2	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.084	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.4	179.2	-63.7	173	0	0	0	111.2	Q514 W654 C659 W679 Y690	Q514-L661 HydrophobicContact CB-CD1 4.22Å; Q514-L661 WeakPolarHBondContact O-CD1 3.44Å; W654-L661 HydrophobicContact CH2-CD1 3.93Å; W654-L661 HydrophobicContact CH2-CD2 4.12Å; W654-L661 HydrophobicContact CH2-CG 4.2Å; W654-L661 HydrophobicContact CZ2-CD2 4.43Å; C659-L661 VanDerWaalsContact SG-CD2 3.53Å; L661-W679 HydrophobicContact CB-CB 4.47Å; L661-W679 HydrophobicContact CD1-CD2 4.13Å; L661-W679 HydrophobicContact CD1-CE3 3.88Å; L661-W679 HydrophobicContact CD1-CZ3 4.22Å; L661-W679 HydrophobicContact CD2-CB 3.92Å; L661-Y690 HydrophobicContact CD2-CD2 4.03Å; L661-Y690 HydrophobicContact CD2-CE2 4.27Å
662	Y	91.3	Very high	78.2	Confident	17 Å²	17	49.1 Å²	49.1	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.3	169.7	-64.3	-90.7	0	0	0	110.1	T660 V664 W679 L680 K732 E735 I736 L739	T660-Y662 HydrophobicContact CG2-CD2 4.49Å; T660-Y662 HydrophobicContact CG2-CE2 3.76Å; Y662-V664 PolarHBondContact O-N 3.35Å; Y662-W679 WeakPolarHBondContact O-CA 3.37Å; Y662-L680 PolarHBondContact N-O 2.97Å; Y662-L680 PolarHBondContact O-N 3.4Å; Y662-K732 HydrophobicContact CD1-CB 3.67Å; Y662-K732 HydrophobicContact CD1-CG 4.1Å; Y662-K732 HydrophobicContact CE1-CB 4.16Å; Y662-E735 HydrophobicContact CE1-CB 3.91Å; Y662-I736 HydrophobicContact CD1-CD1 4.19Å; Y662-I736 HydrophobicContact CD1-CG1 3.7Å; Y662-I736 HydrophobicContact CD2-CD1 4.4Å; Y662-I736 HydrophobicContact CD2-CG1 3.64Å; Y662-I736 HydrophobicContact CE1-CG1 3.91Å; Y662-I736 HydrophobicContact CE2-CG1 3.86Å; Y662-I736 HydrophobicContact CG-CD1 3.95Å; Y662-I736 HydrophobicContact CG-CG1 3.55Å; Y662-L739 HydrophobicContact CE2-CD2 3.89Å
663	E	89.3	Confident	76.4	Confident	84 Å²	84	51.5 Å²	51.5	39%	0.393	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.1	166.8	-63	-151.9	156.5	0	0	110	K677 Q692 T730	E663-K677 IonicContact OE2-NZ 3.84Å; E663-K677 PolarHBondContact OE2-NZ 3.06Å; E663-Q692 PolarHBondContact OE1-NE2 2.9Å; E663-T730 PolarHBondContact O-OG1 3.42Å
664	V	87.6	Confident	74.8	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.4	172.4	-60.1	0	0	0	0	109.2	Y662 L678 L680 F728 E729 T730	Y662-V664 PolarHBondContact O-N 3.35Å; V664-L678 HydrophobicContact CG2-CB 3.98Å; V664-L678 PolarHBondContact N-O 2.94Å; V664-L678 PolarHBondContact O-N 2.87Å; V664-L680 HydrophobicContact CG1-CB 3.81Å; V664-L680 HydrophobicContact CG1-CD2 4.43Å; V664-L680 HydrophobicContact CG2-CB 4.28Å; V664-F728 HydrophobicContact CB-CB 4.2Å; V664-F728 HydrophobicContact CB-CD1 4.46Å; V664-F728 HydrophobicContact CG1-CB 4.23Å; V664-F728 HydrophobicContact CG2-CD1 4.04Å; V664-E729 WeakPolarHBondContact CA-O 3.33Å; V664-T730 HydrophobicContact CG1-CG2 4.35Å
665	D	73.4	Confident	73.1	Confident	79 Å²	79	54.2 Å²	54.2	42%	0.422	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.8	168.6	-75.6	-62.6	0	0	0	108.2	K677 E729	D665-K677 VanDerWaalsContact OD1-CG 3.24Å; D665-K677 WeakPolarHBondContact OD1-CG 3.18Å; D665-E729 PolarHBondContact N-O 3.47Å; D665-E729 WeakPolarHBondContact O-CA 3.47Å; D665-E729 WeakPolarHBondContact O-CB 3.43Å; D665-E729 PolarHBondContact O-N 3.23Å
666	F	60.8	Low	72.1	Confident	61 Å²	61	55 Å²	55	27%	0.268	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.7	137	175.2	-164.4	-125.9	0	0	0	116.1	I668 F674	F666-I668 HydrophobicContact CD1-CG1 4.37Å; F666-I668 HydrophobicContact CE1-CD1 3.59Å; F666-I668 HydrophobicContact CE1-CG1 3.59Å; F666-I668 HydrophobicContact CE2-CG1 4.46Å; F666-I668 HydrophobicContact CZ-CD1 3.76Å; F666-I668 HydrophobicContact CZ-CG1 3.64Å; F666-F674 WeakPolarHBondContact CD2-O 3.45Å
667	Y	59.5	Low	71.5	Confident	10 Å²	10	59.3 Å²	59.3	4%	0.039	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	118.2	174.9	171.6	-116.6	0	0	0	110	S669 N673 F674 L678 I689 E699 L726 F728	Y667-S669 VanDerWaalsContact CZ-CB 3.42Å; Y667-S669 WeakPolarHBondContact OH-CB 3.47Å; Y667-S669 PolarHBondContact OH-OG 3.19Å; Y667-N673 WeakPolarHBondContact O-CA 3.43Å; Y667-F674 HydrophobicContact CD1-CB 4.38Å; Y667-F674 AromaticContact CD1-CD2 3.75Å; Y667-F674 HydrophobicContact CD1-CD2 3.75Å; Y667-F674 HydrophobicContact CD1-CE2 4.45Å; Y667-F674 HydrophobicContact CD1-CG 4.34Å; Y667-F674 HydrophobicContact CE1-CD2 4.3Å; Y667-F674 PolarHBondContact N-O 2.64Å; Y667-F674 PolarHBondContact O-N 3.32Å; Y667-L678 HydrophobicContact CG-CD1 4.43Å; Y667-I689 HydrophobicContact CD2-CD1 3.99Å; Y667-I689 HydrophobicContact CE2-CD1 3.41Å; Y667-I689 VanDerWaalsContact CE2-CD1 3.41Å; Y667-E699 PolarHBondContact OH-OE1 3.2Å; Y667-L726 HydrophobicContact CE2-CB 4.2Å; Y667-L726 HydrophobicContact CE2-CD2 3.96Å; Y667-F728 HydrophobicContact CD2-CD1 4.26Å; Y667-F728 AromaticContact CD2-CE1 3.68Å; Y667-F728 HydrophobicContact CD2-CE1 3.68Å; Y667-F728 HydrophobicContact CD2-CZ 4.26Å; Y667-F728 HydrophobicContact CE2-CE1 4.12Å; Y667-F728 HydrophobicContact CE2-CZ 4.32Å
668	I	58.4	Low	71.3	Confident	58 Å²	58	57.4 Å²	57.4	30%	0.297	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.9	165.4	-60.6	-179.7	0	0	0	108.2	F666 I727	F666-I668 HydrophobicContact CD1-CG1 4.37Å; F666-I668 HydrophobicContact CE1-CD1 3.59Å; F666-I668 HydrophobicContact CE1-CG1 3.59Å; F666-I668 HydrophobicContact CE2-CG1 4.46Å; F666-I668 HydrophobicContact CZ-CD1 3.76Å; F666-I668 HydrophobicContact CZ-CG1 3.64Å; I668-I727 PolarHBondContact N-O 2.81Å
669	S	55.9	Low	71.3	Confident	8 Å²	8	57 Å²	57	6%	0.056	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.8	170.8	174	0	0	0	0	109.3	Y667 K671 G672	Y667-S669 VanDerWaalsContact CZ-CB 3.42Å; Y667-S669 WeakPolarHBondContact OH-CB 3.47Å; Y667-S669 PolarHBondContact OH-OG 3.19Å; S669-K671 PolarHBondContact O-N 3.26Å; S669-G672 PolarHBondContact N-O 3.2Å; S669-G672 PolarHBondContact O-N 3.19Å
670	S	46.5	Very low	71.3	Confident	87 Å²	87	56.8 Å²	56.8	61%	0.608	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-1.6	-179.7	56.2	0	0	0	0	114.8
671	K	46.9	Very low	71.3	Confident	150 Å²	150	54.9 Å²	54.9	65%	0.652	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-7.7	174.5	-62.2	175.6	-176.3	166.7	0	114.6	S669 E699	S669-K671 PolarHBondContact O-N 3.26Å; K671-E699 IonicContact NZ-OE2 3.88Å
672	G	53.8	Low	71.5	Confident	29 Å²	29	54.1 Å²	54.1	30%	0.299	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.4	173.7	177.9	0	0	0	0	0	114.9	S669	S669-G672 PolarHBondContact N-O 3.2Å; S669-G672 PolarHBondContact O-N 3.19Å
673	N	54.8	Low	71.7	Confident	112 Å²	112	54 Å²	54	60%	0.599	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.8	176.2	-67.8	20.9	0	0	0	110.6	Y667	Y667-N673 WeakPolarHBondContact O-CA 3.43Å
674	F	60.6	Low	71.8	Confident	98 Å²	98	51.1 Å²	51.1	43%	0.43	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.2	173.8	-67.3	-102.3	0	0	0	109.8	F666 Y667	F666-F674 WeakPolarHBondContact CD2-O 3.45Å; Y667-F674 HydrophobicContact CD1-CB 4.38Å; Y667-F674 AromaticContact CD1-CD2 3.75Å; Y667-F674 HydrophobicContact CD1-CD2 3.75Å; Y667-F674 HydrophobicContact CD1-CE2 4.45Å; Y667-F674 HydrophobicContact CD1-CG 4.34Å; Y667-F674 HydrophobicContact CE1-CD2 4.3Å; Y667-F674 PolarHBondContact N-O 2.64Å; Y667-F674 PolarHBondContact O-N 3.32Å
675	S	57	Low	72	Confident	111 Å²	111	56 Å²	56	78%	0.776	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	39.1	-176.1	-175.3	0	0	0	0	111.6
676	Q	67.6	Low	72.9	Confident	122 Å²	122	53 Å²	53	57%	0.57	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	157.5	178	-68.3	-179.2	-12	0	0	109.5
677	K	77.3	Confident	74.4	Confident	95 Å²	95	50 Å²	50	41%	0.413	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.9	168.4	-83.2	-165.4	161.5	-150.3	0	110.5	E663 D665	E663-K677 IonicContact OE2-NZ 3.84Å; E663-K677 PolarHBondContact OE2-NZ 3.06Å; D665-K677 VanDerWaalsContact OD1-CG 3.24Å; D665-K677 WeakPolarHBondContact OD1-CG 3.18Å
678	L	87.6	Confident	76	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	164.1	177.3	-61.8	173.2	0	0	0	109.5	V664 Y667 I689 Y690 K691 L698	V664-L678 HydrophobicContact CG2-CB 3.98Å; V664-L678 PolarHBondContact N-O 2.94Å; V664-L678 PolarHBondContact O-N 2.87Å; Y667-L678 HydrophobicContact CG-CD1 4.43Å; L678-I689 HydrophobicContact CB-CG2 4.26Å; L678-I689 HydrophobicContact CD1-CG2 3.92Å; L678-Y690 WeakPolarHBondContact CA-O 3.02Å; L678-K691 HydrophobicContact CD2-CG 4.1Å; L678-L698 HydrophobicContact CD2-CD1 3.95Å
679	W	90.9	Very high	77.6	Confident	10 Å²	10	47.1 Å²	47.1	4%	0.038	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.4	167.8	-66.8	-33.4	0	0	0	110.7	G513 P516 L661 Y662 I689 Y690 Q692	G513-W679 WeakPolarHBondContact O-CH2 3.46Å; P516-W679 HydrophobicContact CG-CZ3 4.24Å; L661-W679 HydrophobicContact CB-CB 4.47Å; L661-W679 HydrophobicContact CD1-CD2 4.13Å; L661-W679 HydrophobicContact CD1-CE3 3.88Å; L661-W679 HydrophobicContact CD1-CZ3 4.22Å; L661-W679 HydrophobicContact CD2-CB 3.92Å; Y662-W679 WeakPolarHBondContact O-CA 3.37Å; W679-I689 WeakPolarHBondContact O-CA 3.45Å; W679-Y690 PolarHBondContact N-O 2.89Å; W679-Y690 PolarHBondContact O-N 3.02Å; W679-Q692 HydrophobicContact CH2-CG 4.15Å; W679-Q692 HydrophobicContact CZ2-CB 4.4Å; W679-Q692 HydrophobicContact CZ2-CG 3.69Å
680	L	92.8	Very high	79.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	106.8	168.1	-171.6	72	0	0	0	108.4	Y662 V664 V687 I689 F728 I736	Y662-L680 PolarHBondContact N-O 2.97Å; Y662-L680 PolarHBondContact O-N 3.4Å; V664-L680 HydrophobicContact CG1-CB 3.81Å; V664-L680 HydrophobicContact CG1-CD2 4.43Å; V664-L680 HydrophobicContact CG2-CB 4.28Å; L680-V687 HydrophobicContact CD1-CG1 3.51Å; L680-V687 HydrophobicContact CG-CG1 3.98Å; L680-I689 HydrophobicContact CD1-CG1 4.28Å; L680-F728 HydrophobicContact CD1-CE1 4.05Å; L680-F728 HydrophobicContact CD1-CE2 4.36Å; L680-F728 HydrophobicContact CD1-CZ 3.9Å; L680-I736 HydrophobicContact CD2-CD1 4.3Å; L680-I736 HydrophobicContact CD2-CG2 4.08Å
681	G	94.3	Very high	81	Confident	1 Å²	1	46 Å²	46	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.8	176.8	0	0	0	0	0	111.7	T660 V687 S688	T660-G681 WeakPolarHBondContact O-CA 3.17Å; G681-V687 CarbonylContact O-C 3.44Å; G681-V687 WeakPolarHBondContact O-CA 3.41Å; G681-S688 PolarHBondContact N-O 3.44Å; G681-S688 PolarHBondContact O-N 3.04Å
682	V	95.4	Very high	82.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117	177.2	-177.9	0	0	0	0	109.4	C659 T660 V687 L739 M740 Y743	C659-V682 CarbonylContact C-O 3.51Å; C659-V682 VanDerWaalsContact CA-O 3.29Å; C659-V682 WeakPolarHBondContact CA-O 3.41Å; T660-V682 PolarHBondContact N-O 2.82Å; T660-V682 PolarHBondContact O-N 2.88Å; V682-V687 HydrophobicContact CG1-CG2 4.46Å; V682-V687 HydrophobicContact CG2-CG1 4.34Å; V682-V687 HydrophobicContact CG2-CG2 4.44Å; V682-L739 HydrophobicContact CB-CD2 3.84Å; V682-L739 HydrophobicContact CB-CG 4.46Å; V682-L739 HydrophobicContact CG1-CD2 3.94Å; V682-L739 HydrophobicContact CG1-CG 4.02Å; V682-M740 HydrophobicContact CG1-CG 3.83Å; V682-M740 HydrophobicContact CG2-CG 4.36Å; V682-Y743 HydrophobicContact CG1-CD2 3.83Å; V682-Y743 HydrophobicContact CG1-CE2 4.1Å
683	A	94.6	Very high	83.7	Confident	14 Å²	14	44.6 Å²	44.6	12%	0.116	25%	0.25	C	S	.	.			trans	-125.7	-177.2	-175.3	0	0	0	0	0	112.2	C659 S686 Y703	C659-A683 HydrophobicContact CB-CB 3.77Å; A683-S686 PolarHBondContact N-O 3Å; A683-Y703 WeakPolarHBondContact O-CE2 3.44Å; A683-Y703 VanDerWaalsContact O-CZ 3.29Å; A683-Y703 PolarHBondContact O-OH 3.18Å
684	A	92.4	Very high	85.1	Confident	23 Å²	23	43 Å²	43	19%	0.19	24%	0.239	C	C	.	.	S	Bend	trans	-69.6	-26.3	175.1	0	0	0	0	0	115.1	L486 L487 Y703 Y743 I747	L486-A684 VanDerWaalsContact O-CB 3.29Å; L486-A684 WeakPolarHBondContact O-CB 3.43Å; L487-A684 HydrophobicContact CD2-CB 3.86Å; A684-Y703 WeakPolarHBondContact O-CE2 3.21Å; A684-Y743 HydrophobicContact CB-CD1 4.09Å; A684-Y743 HydrophobicContact CB-CE1 3.83Å; A684-I747 VanDerWaalsContact O-CD1 3.26Å; A684-I747 WeakPolarHBondContact O-CD1 3.18Å
685	T	90.6	Very high	86.3	Confident	104 Å²	104	41.2 Å²	41.2	64%	0.638	24%	0.238	S	C	*	.	S	Bend	trans	-100.3	-31.7	-174.8	57.7	0	0	0	0	113.4	P702 Y703	T685-P702 WeakPolarHBondContact O-CA 3.38Å; T685-Y703 PolarHBondContact O-N 3.38Å
686	S	92.6	Very high	87.9	Confident	15 Å²	15	43.2 Å²	43.2	11%	0.105	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	165.4	-167.3	58.9	0	0	0	0	112.3	A683 S688 F701	A683-S686 PolarHBondContact N-O 3Å; S686-S688 PolarHBondContact OG-OG 2.93Å; S686-F701 VanDerWaalsContact CA-O 3.27Å; S686-F701 WeakPolarHBondContact CA-O 3.5Å; S686-F701 WeakPolarHBondContact CB-O 3.31Å
687	V	93.8	Very high	88.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.6	157.7	-178	0	0	0	0	107.7	L680 G681 V682 F701 Y703 I706 I719 M740	L680-V687 HydrophobicContact CD1-CG1 3.51Å; L680-V687 HydrophobicContact CG-CG1 3.98Å; G681-V687 CarbonylContact O-C 3.44Å; G681-V687 WeakPolarHBondContact O-CA 3.41Å; V682-V687 HydrophobicContact CG1-CG2 4.46Å; V682-V687 HydrophobicContact CG2-CG1 4.34Å; V682-V687 HydrophobicContact CG2-CG2 4.44Å; V687-F701 PolarHBondContact N-O 3.27Å; V687-F701 PolarHBondContact O-N 2.93Å; V687-Y703 HydrophobicContact CG2-CE1 4.03Å; V687-I706 HydrophobicContact CB-CD1 4.3Å; V687-I706 HydrophobicContact CG2-CD1 3.93Å; V687-I719 HydrophobicContact CG1-CD1 3.99Å; V687-M740 HydrophobicContact CG2-CE 3.97Å; V687-M740 HydrophobicContact CG2-CG 4.48Å; V687-M740 HydrophobicContact CG2-SD 4.26Å
688	S	93	Very high	89.4	Confident	5 Å²	5	38.1 Å²	38.1	4%	0.035	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.3	-175.4	-66	0	0	0	0	112.2	G681 S686 E699 S700	G681-S688 PolarHBondContact N-O 3.44Å; G681-S688 PolarHBondContact O-N 3.04Å; S686-S688 PolarHBondContact OG-OG 2.93Å; S688-E699 WeakPolarHBondContact CA-O 3.27Å; S688-S700 VanDerWaalsContact OG-CB 3.27Å; S688-S700 WeakPolarHBondContact OG-CB 3.43Å; S688-S700 PolarHBondContact OG-OG 3.01Å
689	I	90.5	Very high	89.4	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.3	179.4	-55.3	173.4	0	0	0	109	Y667 L678 W679 L680 A697 L698 E699 F701 F728	Y667-I689 HydrophobicContact CD2-CD1 3.99Å; Y667-I689 HydrophobicContact CE2-CD1 3.41Å; Y667-I689 VanDerWaalsContact CE2-CD1 3.41Å; L678-I689 HydrophobicContact CB-CG2 4.26Å; L678-I689 HydrophobicContact CD1-CG2 3.92Å; W679-I689 WeakPolarHBondContact O-CA 3.45Å; L680-I689 HydrophobicContact CD1-CG1 4.28Å; I689-A697 CarbonylContact O-C 3.52Å; I689-A697 WeakPolarHBondContact O-CA 3.24Å; I689-L698 HydrophobicContact CG2-CD1 4.34Å; I689-L698 PolarHBondContact O-N 3.26Å; I689-E699 PolarHBondContact N-O 2.73Å; I689-F701 HydrophobicContact CD1-CE2 3.87Å; I689-F701 HydrophobicContact CG1-CE2 4.29Å; I689-F728 HydrophobicContact CD1-CE1 3.77Å; I689-F728 HydrophobicContact CD1-CZ 3.95Å; I689-F728 HydrophobicContact CG1-CE1 4.22Å; I689-F728 HydrophobicContact CG1-CZ 4.45Å
690	Y	89.3	Confident	89.4	Confident	8 Å²	8	42.4 Å²	42.4	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152.7	177.5	-55.6	-95.4	0	0	0	110.6	W654 G656 L661 L678 W679 A697	W654-Y690 HydrophobicContact CZ2-CD1 4.45Å; W654-Y690 HydrophobicContact CZ2-CE1 4.05Å; W654-Y690 HydrophobicContact CZ2-CE2 4.39Å; W654-Y690 AromaticContact NE1-CE1 3.78Å; G656-Y690 VanDerWaalsContact CA-OH 3.28Å; G656-Y690 WeakPolarHBondContact CA-OH 3.31Å; L661-Y690 HydrophobicContact CD2-CD2 4.03Å; L661-Y690 HydrophobicContact CD2-CE2 4.27Å; L678-Y690 WeakPolarHBondContact CA-O 3.02Å; W679-Y690 PolarHBondContact N-O 2.89Å; W679-Y690 PolarHBondContact O-N 3.02Å; Y690-A697 HydrophobicContact CD1-CB 4.06Å; Y690-A697 HydrophobicContact CE1-CB 3.7Å
691	K	86	Confident	89.3	Confident	63 Å²	63	42.8 Å²	42.8	27%	0.274	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	147.9	158.1	-56.8	-159.5	-147.9	79.1	0	109.1	L678 G693 E694 L698	L678-K691 HydrophobicContact CD2-CG 4.1Å; K691-G693 PolarHBondContact O-N 3.37Å; K691-G693 VanDerWaalsContact O-N 3.12Å; K691-E694 HydrophobicContact CB-CB 4.19Å; K691-E694 HydrophobicContact CB-CG 4.03Å; K691-E694 WeakPolarHBondContact CD-OE1 3.41Å; K691-E694 WeakPolarHBondContact CG-OE2 3.2Å; K691-E694 IonicContact NZ-OE1 2.69Å; K691-E694 PolarHBondContact NZ-OE1 3.39Å; K691-E694 IonicContact NZ-OE2 2.61Å; K691-E694 PolarHBondContact NZ-OE2 3.21Å; K691-E694 PolarHBondContact O-N 3.05Å; K691-L698 HydrophobicContact CG-CD1 3.87Å; K691-L698 HydrophobicContact CG-CD2 4.11Å; K691-L698 HydrophobicContact CG-CG 4.21Å
692	Q	80.4	Confident	89.2	Confident	99 Å²	99	45.4 Å²	45.4	46%	0.463	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	116.7	176	-177.6	155.2	48.1	0	0	110.6	E663 W679	E663-Q692 PolarHBondContact OE1-NE2 2.9Å; W679-Q692 HydrophobicContact CH2-CG 4.15Å; W679-Q692 HydrophobicContact CZ2-CB 4.4Å; W679-Q692 HydrophobicContact CZ2-CG 3.69Å
693	G	75.6	Confident	88.9	Confident	52 Å²	52	46.4 Å²	46.4	54%	0.536	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-3.2	-178.2	0	0	0	0	0	116.7	K691	K691-G693 PolarHBondContact O-N 3.37Å; K691-G693 VanDerWaalsContact O-N 3.12Å
694	E	84.9	Confident	88.6	Confident	78 Å²	78	49.9 Å²	49.9	36%	0.364	31%	0.308	S	S	.	.			trans	-92.2	140.1	172.1	-70.2	179.8	-174.8	0	0	111.1	K691	K691-E694 HydrophobicContact CB-CB 4.19Å; K691-E694 HydrophobicContact CB-CG 4.03Å; K691-E694 WeakPolarHBondContact CD-OE1 3.41Å; K691-E694 WeakPolarHBondContact CG-OE2 3.2Å; K691-E694 IonicContact NZ-OE1 2.69Å; K691-E694 PolarHBondContact NZ-OE1 3.39Å; K691-E694 IonicContact NZ-OE2 2.61Å; K691-E694 PolarHBondContact NZ-OE2 3.21Å; K691-E694 PolarHBondContact O-N 3.05Å
695	S	86.3	Confident	88.5	Confident	60 Å²	60	53.9 Å²	53.9	42%	0.42	32%	0.323	S	S	.	.	S	Bend	trans	-84.8	-29	179.9	52.5	0	0	0	0	113.7	W654	W654-S695 PolarHBondContact NE1-O 2.77Å
696	E	89.6	Confident	88.5	Confident	154 Å²	154	49.5 Å²	49.5	72%	0.72	30%	0.295	S	S	*	.	S	Bend	trans	-81	140.1	175.6	-63	-170.2	157.7	0	0	111.4
697	A	89.8	Confident	88.4	Confident	35 Å²	35	52.1 Å²	52.1	29%	0.289	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	139.1	173.7	0	0	0	0	0	110.8	I689 Y690 S700	I689-A697 CarbonylContact O-C 3.52Å; I689-A697 WeakPolarHBondContact O-CA 3.24Å; Y690-A697 HydrophobicContact CD1-CB 4.06Å; Y690-A697 HydrophobicContact CE1-CB 3.7Å; A697-S700 WeakPolarHBondContact CB-OG 3.45Å
698	L	87.8	Confident	88.2	Confident	75 Å²	75	55.1 Å²	55.1	39%	0.393	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	-48.8	172.5	-64.7	-179.1	0	0	0	111.4	L678 I689 K691	L678-L698 HydrophobicContact CD2-CD1 3.95Å; I689-L698 HydrophobicContact CG2-CD1 4.34Å; I689-L698 PolarHBondContact O-N 3.26Å; K691-L698 HydrophobicContact CG-CD1 3.87Å; K691-L698 HydrophobicContact CG-CD2 4.11Å; K691-L698 HydrophobicContact CG-CG 4.21Å
699	E	87.3	Confident	88.2	Confident	41 Å²	41	58 Å²	58	19%	0.192	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.2	172.4	-61.9	-157.7	-113.7	0	0	109.2	Y667 K671 S688 I689 F701 R724	Y667-E699 PolarHBondContact OH-OE1 3.2Å; K671-E699 IonicContact NZ-OE2 3.88Å; S688-E699 WeakPolarHBondContact CA-O 3.27Å; I689-E699 PolarHBondContact N-O 2.73Å; E699-F701 HydrophobicContact CB-CE1 4.41Å; E699-F701 HydrophobicContact CB-CE2 3.68Å; E699-F701 HydrophobicContact CB-CZ 3.51Å; E699-F701 HydrophobicContact CG-CZ 4.35Å; E699-R724 IonicContact OE1-NH1 3.62Å; E699-R724 IonicContact OE2-CZ 3.75Å; E699-R724 IonicContact OE2-NH1 2.62Å; E699-R724 PolarHBondContact OE2-NH1 2.73Å
700	S	91.3	Very high	88.2	Confident	61 Å²	61	58.9 Å²	58.9	43%	0.427	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.4	177.7	-66.6	0	0	0	0	110	S688 A697 P702	S688-S700 VanDerWaalsContact OG-CB 3.27Å; S688-S700 WeakPolarHBondContact OG-CB 3.43Å; S688-S700 PolarHBondContact OG-OG 3.01Å; A697-S700 WeakPolarHBondContact CB-OG 3.45Å; S700-P702 WeakPolarHBondContact O-CD 3.42Å
701	F	90.9	Very high	88.1	Confident	10 Å²	10	61.6 Å²	61.6	4%	0.044	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	95.8	-174.1	-54.1	-80.2	0	0	0	109.3	S686 V687 I689 E699 I706 A721 L726	S686-F701 VanDerWaalsContact CA-O 3.27Å; S686-F701 WeakPolarHBondContact CA-O 3.5Å; S686-F701 WeakPolarHBondContact CB-O 3.31Å; V687-F701 PolarHBondContact N-O 3.27Å; V687-F701 PolarHBondContact O-N 2.93Å; I689-F701 HydrophobicContact CD1-CE2 3.87Å; I689-F701 HydrophobicContact CG1-CE2 4.29Å; E699-F701 HydrophobicContact CB-CE1 4.41Å; E699-F701 HydrophobicContact CB-CE2 3.68Å; E699-F701 HydrophobicContact CB-CZ 3.51Å; E699-F701 HydrophobicContact CG-CZ 4.35Å; F701-I706 HydrophobicContact CB-CD1 4.43Å; F701-I706 HydrophobicContact CB-CG1 4.3Å; F701-A721 HydrophobicContact CD1-CB 3.67Å; F701-A721 HydrophobicContact CE1-CB 4.27Å; F701-A721 HydrophobicContact CG-CB 4.3Å; F701-L726 HydrophobicContact CD1-CD1 4.2Å; F701-L726 HydrophobicContact CD2-CD1 3.82Å; F701-L726 HydrophobicContact CE1-CD1 3.84Å; F701-L726 HydrophobicContact CE1-CD2 4.49Å; F701-L726 HydrophobicContact CE2-CD1 3.44Å; F701-L726 VanDerWaalsContact CE2-CD1 3.44Å; F701-L726 HydrophobicContact CG-CD1 4.19Å; F701-L726 HydrophobicContact CZ-CD1 3.45Å; F701-L726 VanDerWaalsContact CZ-CD1 3.45Å; F701-L726 HydrophobicContact CZ-CD2 4.12Å; F701-L726 HydrophobicContact CZ-CG 4.44Å
702	P	91.9	Very high	88	Confident	56 Å²	56	62.1 Å²	62.1	36%	0.364	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	144.2	172.6	-24.3	34.1	0	0	0	111.2	T685 S700 G704 Q705	T685-P702 WeakPolarHBondContact O-CA 3.38Å; S700-P702 WeakPolarHBondContact O-CD 3.42Å; P702-G704 PolarHBondContact O-N 3.22Å; P702-Q705 WeakPolarHBondContact O-CB 3.34Å; P702-Q705 PolarHBondContact O-N 2.74Å
703	Y	89.1	Confident	88.1	Confident	21 Å²	21	60.9 Å²	60.9	8%	0.082	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-55.6	-31.8	-175.6	-73.3	-63.3	0	0	0	114.1	A683 A684 T685 V687 Q705 I706 Y743 F744 I747	A683-Y703 WeakPolarHBondContact O-CE2 3.44Å; A683-Y703 VanDerWaalsContact O-CZ 3.29Å; A683-Y703 PolarHBondContact O-OH 3.18Å; A684-Y703 WeakPolarHBondContact O-CE2 3.21Å; T685-Y703 PolarHBondContact O-N 3.38Å; V687-Y703 HydrophobicContact CG2-CE1 4.03Å; Y703-Q705 PolarHBondContact O-N 2.79Å; Y703-I706 HydrophobicContact CD1-CD1 4.05Å; Y703-I706 PolarHBondContact O-N 3.34Å; Y703-I706 VanDerWaalsContact O-N 3.14Å; Y703-Y743 WeakPolarHBondContact OH-CB 3.33Å; Y703-F744 HydrophobicContact CD1-CD1 4.45Å; Y703-F744 HydrophobicContact CD1-CD2 4.26Å; Y703-F744 AromaticContact CD1-CE1 3.83Å; Y703-F744 HydrophobicContact CD1-CE1 3.83Å; Y703-F744 AromaticContact CD1-CE2 3.56Å; Y703-F744 HydrophobicContact CD1-CE2 3.56Å; Y703-F744 AromaticContact CD1-CZ 3.33Å; Y703-F744 HydrophobicContact CD1-CZ 3.33Å; Y703-F744 HydrophobicContact CE1-CD2 4.25Å; Y703-F744 AromaticContact CE1-CE2 3.79Å; Y703-F744 HydrophobicContact CE1-CE2 3.79Å; Y703-F744 HydrophobicContact CE1-CZ 4.06Å; Y703-F744 HydrophobicContact CG-CE1 4.1Å; Y703-F744 HydrophobicContact CG-CZ 4.06Å; Y703-I747 HydrophobicContact CD2-CD1 3.78Å; Y703-I747 HydrophobicContact CE2-CD1 3.87Å
704	G	87.1	Confident	88.5	Confident	87 Å²	87	63.6 Å²	63.6	90%	0.897	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-68.5	-5.3	174.6	0	0	0	0	0	115.8	P702	P702-G704 PolarHBondContact O-N 3.22Å
705	Q	89.9	Confident	88.6	Confident	107 Å²	107	62.8 Å²	62.8	50%	0.5	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-103.9	-13.3	172	-61.4	-177.1	2.5	0	0	112.8	P702 Y703 C707 A721 G722	P702-Q705 WeakPolarHBondContact O-CB 3.34Å; P702-Q705 PolarHBondContact O-N 2.74Å; Y703-Q705 PolarHBondContact O-N 2.79Å; Q705-C707 PolarHBondContact O-N 3.29Å; Q705-A721 CarbonylContact O-C 3.59Å; Q705-A721 VanDerWaalsContact O-CA 3.31Å; Q705-A721 WeakPolarHBondContact O-CA 3.22Å; Q705-G722 PolarHBondContact O-N 3.05Å
706	I	91.1	Very high	88.7	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.056	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112.9	-179.5	-61.9	178.3	0	0	0	108.5	V687 F701 Y703 Y709 I719 T720 M740	V687-I706 HydrophobicContact CB-CD1 4.3Å; V687-I706 HydrophobicContact CG2-CD1 3.93Å; F701-I706 HydrophobicContact CB-CD1 4.43Å; F701-I706 HydrophobicContact CB-CG1 4.3Å; Y703-I706 HydrophobicContact CD1-CD1 4.05Å; Y703-I706 PolarHBondContact O-N 3.34Å; Y703-I706 VanDerWaalsContact O-N 3.14Å; I706-Y709 HydrophobicContact CG2-CD1 3.89Å; I706-I719 HydrophobicContact CD1-CG2 4.26Å; I706-I719 HydrophobicContact CG1-CG2 4.23Å; I706-I719 HydrophobicContact CG2-CG2 3.94Å; I706-T720 CarbonylContact C-O 3.59Å; I706-M740 HydrophobicContact CD1-CE 4.3Å
707	C	89.9	Confident	88.7	Confident	71 Å²	71	53.3 Å²	53.3	48%	0.48	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-32.1	-177.7	-56.3	0	0	0	0	112.3	Q705 T720	Q705-C707 PolarHBondContact O-N 3.29Å; C707-T720 PolarHBondContact N-O 3.4Å
708	S	91	Very high	88.7	Confident	62 Å²	62	54.2 Å²	54.2	43%	0.434	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	162.5	173	63.3	0	0	0	0	110.9	T720	S708-T720 PolarHBondContact N-O 2.8Å; S708-T720 PolarHBondContact O-N 3.39Å; S708-T720 VanDerWaalsContact OG-CB 3.32Å; S708-T720 WeakPolarHBondContact OG-CB 3.33Å; S708-T720 PolarHBondContact OG-OG1 3.14Å
709	Y	92.2	Very high	88.8	Confident	67 Å²	67	50.7 Å²	50.7	26%	0.263	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	160.6	171.5	56.9	-83.7	0	0	0	109.5	I706 F717 K718 M740 N741 F744	I706-Y709 HydrophobicContact CG2-CD1 3.89Å; Y709-F717 HydrophobicContact CD2-CZ 4.01Å; Y709-K718 CarbonylContact C-O 3.46Å; Y709-K718 WeakPolarHBondContact CA-O 3.43Å; Y709-M740 HydrophobicContact CD1-CE 3.64Å; Y709-M740 HydrophobicContact CD2-CB 4.49Å; Y709-M740 HydrophobicContact CD2-CE 3.74Å; Y709-M740 HydrophobicContact CD2-SD 4.02Å; Y709-M740 HydrophobicContact CE1-CE 4.03Å; Y709-M740 HydrophobicContact CE2-CB 3.93Å; Y709-M740 HydrophobicContact CE2-CE 4.1Å; Y709-M740 HydrophobicContact CE2-SD 4.41Å; Y709-M740 HydrophobicContact CG-CE 3.49Å; Y709-M740 VanDerWaalsContact CG-CE 3.49Å; Y709-M740 HydrophobicContact CG-SD 4.29Å; Y709-N741 WeakPolarHBondContact CE2-OD1 3.2Å; Y709-N741 PolarHBondContact OH-OD1 3.2Å; Y709-F744 HydrophobicContact CD1-CE2 4.21Å; Y709-F744 AromaticContact CE1-CD2 3.99Å; Y709-F744 HydrophobicContact CE1-CD2 3.99Å; Y709-F744 AromaticContact CE1-CE2 3.3Å; Y709-F744 HydrophobicContact CE1-CE2 3.3Å; Y709-F744 AromaticContact CE1-CZ 3.97Å; Y709-F744 HydrophobicContact CE1-CZ 3.97Å; Y709-F744 AromaticContact CZ-CD2 3.93Å; Y709-F744 AromaticContact CZ-CE2 3.69Å; Y709-F744 VanDerWaalsContact OH-CD2 3.3Å; Y709-F744 WeakPolarHBondContact OH-CD2 3.5Å
710	G	90.4	Very high	89	Confident	18 Å²	18	49.9 Å²	49.9	19%	0.186	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.8	176.5	176.1	0	0	0	0	0	114.6	K718	G710-K718 PolarHBondContact N-O 3.23Å; G710-K718 PolarHBondContact O-N 3Å
711	V	87.9	Confident	88.8	Confident	66 Å²	66	47.2 Å²	47.2	40%	0.4	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	129	174.9	178.1	0	0	0	0	109.7	D713 F717 L733 M737	V711-D713 WeakPolarHBondContact CG1-O 3.27Å; V711-F717 HydrophobicContact CG2-CD2 4.32Å; V711-L733 HydrophobicContact CG1-CD1 3.96Å; V711-L733 HydrophobicContact CG2-CB 4.02Å; V711-L733 HydrophobicContact CG2-CD1 4.48Å; V711-M737 HydrophobicContact CG2-SD 4.33Å
712	S	83.7	Confident	88.4	Confident	73 Å²	73	49.3 Å²	49.3	51%	0.51	32%	0.32	S	S	.	.			trans	-99.1	-33.9	178.8	-60.8	0	0	0	0	112.9	T716 K718	S712-T716 PolarHBondContact N-O 2.8Å; S712-K718 WeakPolarHBondContact OG-CB 3.45Å
713	D	83.4	Confident	87.8	Confident	74 Å²	74	53.4 Å²	53.4	40%	0.396	34%	0.339	S	S	.	.	S	Bend	trans	-154	-159.3	176.4	62.5	47	0	0	0	110.8	V711 N715 T716	V711-D713 WeakPolarHBondContact CG1-O 3.27Å; D713-N715 VanDerWaalsContact C-N 3.31Å; D713-N715 PolarHBondContact O-N 3.26Å; D713-N715 PolarHBondContact OD1-N 3.29Å; D713-N715 PolarHBondContact OD1-OD1 2.96Å; D713-T716 VanDerWaalsContact CG-CB 3.46Å; D713-T716 VanDerWaalsContact OD1-CB 3.23Å; D713-T716 WeakPolarHBondContact OD1-CB 3.5Å; D713-T716 PolarHBondContact OD1-N 3.36Å; D713-T716 PolarHBondContact OD1-OG1 3.05Å; D713-T716 VanDerWaalsContact OD2-CB 3.22Å; D713-T716 WeakPolarHBondContact OD2-CB 3.49Å; D713-T716 PolarHBondContact OD2-OG1 3.16Å
714	S	83.6	Confident	87.4	Confident	109 Å²	109	55 Å²	55	76%	0.762	35%	0.345	S	S	*	.	S	Bend	trans	-64.6	-22.2	-178.9	44.7	0	0	0	0	116.5	L733	S714-L733 WeakPolarHBondContact O-CD1 3.49Å
715	N	86.6	Confident	87.3	Confident	61 Å²	61	54.6 Å²	54.6	33%	0.326	32%	0.322	S	S	.	.	S	Bend	trans	-137.8	-7	-175.6	53.3	-69.5	0	0	0	113.6	D713 E729 T730	D713-N715 VanDerWaalsContact C-N 3.31Å; D713-N715 PolarHBondContact O-N 3.26Å; D713-N715 PolarHBondContact OD1-N 3.29Å; D713-N715 PolarHBondContact OD1-OD1 2.96Å; N715-E729 PolarHBondContact ND2-OE2 3.42Å; N715-E729 CarbonylContact O-C 3.57Å; N715-E729 WeakPolarHBondContact O-CA 3.48Å; N715-T730 PolarHBondContact O-N 3.1Å; N715-T730 VanDerWaalsContact O-O 3.13Å
716	T	87.4	Confident	87	Confident	15 Å²	15	49.5 Å²	49.5	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.2	-174.6	-54.8	0	0	0	0	113.2	S712 D713 I727 F728	S712-T716 PolarHBondContact N-O 2.8Å; D713-T716 VanDerWaalsContact CG-CB 3.46Å; D713-T716 VanDerWaalsContact OD1-CB 3.23Å; D713-T716 WeakPolarHBondContact OD1-CB 3.5Å; D713-T716 PolarHBondContact OD1-N 3.36Å; D713-T716 PolarHBondContact OD1-OG1 3.05Å; D713-T716 VanDerWaalsContact OD2-CB 3.22Å; D713-T716 WeakPolarHBondContact OD2-CB 3.49Å; D713-T716 PolarHBondContact OD2-OG1 3.16Å; T716-I727 HydrophobicContact CG2-CG2 3.34Å; T716-F728 CarbonylContact C-O 3.48Å; T716-F728 WeakPolarHBondContact CA-O 3.49Å
717	F	90.1	Very high	86.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140	166.4	-159.9	-111.9	0	0	0	110.4	Y709 V711 I719 F728 L733 I736 M737 M740	Y709-F717 HydrophobicContact CD2-CZ 4.01Å; V711-F717 HydrophobicContact CG2-CD2 4.32Å; F717-I719 HydrophobicContact CD1-CD1 4.31Å; F717-I719 HydrophobicContact CD1-CG1 3.91Å; F717-I719 HydrophobicContact CE1-CD1 3.96Å; F717-I719 HydrophobicContact CE1-CG1 3.64Å; F717-F728 HydrophobicContact CD1-CD2 4.5Å; F717-F728 PolarHBondContact N-O 3.38Å; F717-F728 PolarHBondContact O-N 3Å; F717-L733 HydrophobicContact CB-CD2 3.67Å; F717-L733 HydrophobicContact CD2-CD2 4.29Å; F717-L733 HydrophobicContact CG-CD2 4.46Å; F717-I736 HydrophobicContact CD1-CG2 4.13Å; F717-I736 HydrophobicContact CE1-CG2 3.67Å; F717-I736 HydrophobicContact CE2-CG2 4.31Å; F717-I736 HydrophobicContact CZ-CG2 3.77Å; F717-M737 HydrophobicContact CE2-CB 4.1Å; F717-M740 HydrophobicContact CE1-SD 3.86Å; F717-M740 HydrophobicContact CZ-SD 3.9Å
718	K	90.3	Very high	86.6	Confident	54 Å²	54	48 Å²	48	24%	0.235	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.2	175.1	179.3	176.1	172.3	176.5	0	110.9	Y709 G710 S712 T720 D725 L726 I727	Y709-K718 CarbonylContact C-O 3.46Å; Y709-K718 WeakPolarHBondContact CA-O 3.43Å; G710-K718 PolarHBondContact N-O 3.23Å; G710-K718 PolarHBondContact O-N 3Å; S712-K718 WeakPolarHBondContact OG-CB 3.45Å; K718-T720 WeakPolarHBondContact CE-OG1 3.46Å; K718-D725 WeakPolarHBondContact CE-OD1 3.4Å; K718-D725 IonicContact NZ-OD1 4Å; K718-D725 PolarHBondContact NZ-OD1 3Å; K718-D725 IonicContact NZ-OD2 2.71Å; K718-D725 PolarHBondContact NZ-OD2 3.34Å; K718-L726 WeakPolarHBondContact CA-O 3.42Å; K718-I727 HydrophobicContact CG-CG1 4.48Å
719	I	90.7	Very high	86.4	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.1	167.2	-56.6	178.1	0	0	0	108	V687 I706 F717 L726 F728 M740	V687-I719 HydrophobicContact CG1-CD1 3.99Å; I706-I719 HydrophobicContact CD1-CG2 4.26Å; I706-I719 HydrophobicContact CG1-CG2 4.23Å; I706-I719 HydrophobicContact CG2-CG2 3.94Å; F717-I719 HydrophobicContact CD1-CD1 4.31Å; F717-I719 HydrophobicContact CD1-CG1 3.91Å; F717-I719 HydrophobicContact CE1-CD1 3.96Å; F717-I719 HydrophobicContact CE1-CG1 3.64Å; I719-L726 HydrophobicContact CB-CB 4.38Å; I719-L726 HydrophobicContact CB-CD1 4.4Å; I719-L726 HydrophobicContact CG2-CD1 4.47Å; I719-L726 PolarHBondContact N-O 3.49Å; I719-L726 WeakPolarHBondContact O-CB 3.31Å; I719-L726 PolarHBondContact O-N 3.22Å; I719-F728 HydrophobicContact CB-CE2 4.34Å; I719-F728 HydrophobicContact CD1-CE2 3.9Å; I719-F728 HydrophobicContact CG1-CE2 4.02Å; I719-M740 HydrophobicContact CD1-CE 4.48Å; I719-M740 HydrophobicContact CD1-SD 4.42Å
720	T	90.2	Very high	86.3	Confident	23 Å²	23	46.4 Å²	46.4	14%	0.141	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.8	173.6	-41.7	0	0	0	0	108.2	I706 C707 S708 K718 R724	I706-T720 CarbonylContact C-O 3.59Å; C707-T720 PolarHBondContact N-O 3.4Å; S708-T720 PolarHBondContact N-O 2.8Å; S708-T720 PolarHBondContact O-N 3.39Å; S708-T720 VanDerWaalsContact OG-CB 3.32Å; S708-T720 WeakPolarHBondContact OG-CB 3.33Å; S708-T720 PolarHBondContact OG-OG1 3.14Å; K718-T720 WeakPolarHBondContact CE-OG1 3.46Å; T720-R724 CarbonylContact C-O 3.58Å; T720-R724 WeakPolarHBondContact CA-O 3.35Å
721	A	87.3	Confident	86.2	Confident	6 Å²	6	51 Å²	51	5%	0.05	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	109	-179.2	0	0	0	0	0	110.8	F701 Q705 D723 R724	F701-A721 HydrophobicContact CD1-CB 3.67Å; F701-A721 HydrophobicContact CE1-CB 4.27Å; F701-A721 HydrophobicContact CG-CB 4.3Å; Q705-A721 CarbonylContact O-C 3.59Å; Q705-A721 VanDerWaalsContact O-CA 3.31Å; Q705-A721 WeakPolarHBondContact O-CA 3.22Å; A721-D723 PolarHBondContact O-N 3.33Å; A721-D723 VanDerWaalsContact O-N 3.13Å; A721-R724 PolarHBondContact N-O 3.34Å; A721-R724 PolarHBondContact O-N 3.36Å
722	G	83.4	Confident	86.3	Confident	53 Å²	53	50.2 Å²	50.2	55%	0.546	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	-112.3	-173.8	0	0	0	0	0	112.6	Q705	Q705-G722 PolarHBondContact O-N 3.05Å
723	D	79.6	Confident	86.5	Confident	143 Å²	143	47.4 Å²	47.4	77%	0.765	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	6	178.9	69.3	-32.4	0	0	0	114	A721	A721-D723 PolarHBondContact O-N 3.33Å; A721-D723 VanDerWaalsContact O-N 3.13Å
724	R	80.7	Confident	86.8	Confident	54 Å²	54	47.3 Å²	47.3	20%	0.204	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.3	-172.2	-46.2	-165.7	-158.3	153.3	21.7	113.3	E699 T720 A721 L726	E699-R724 IonicContact OE1-NH1 3.62Å; E699-R724 IonicContact OE2-CZ 3.75Å; E699-R724 IonicContact OE2-NH1 2.62Å; E699-R724 PolarHBondContact OE2-NH1 2.73Å; T720-R724 CarbonylContact C-O 3.58Å; T720-R724 WeakPolarHBondContact CA-O 3.35Å; A721-R724 PolarHBondContact N-O 3.34Å; A721-R724 PolarHBondContact O-N 3.36Å; R724-L726 HydrophobicContact CB-CD2 4.07Å
725	D	84.2	Confident	87.1	Confident	78 Å²	78	42.8 Å²	42.8	42%	0.417	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.6	159.9	-77.1	-14	0	0	0	109.3	K718	K718-D725 WeakPolarHBondContact CE-OD1 3.4Å; K718-D725 IonicContact NZ-OD1 4Å; K718-D725 PolarHBondContact NZ-OD1 3Å; K718-D725 IonicContact NZ-OD2 2.71Å; K718-D725 PolarHBondContact NZ-OD2 3.34Å
726	L	84.1	Confident	87.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.3	172.5	-43.1	178.3	0	0	0	107.9	Y667 F701 K718 I719 R724 F728	Y667-L726 HydrophobicContact CE2-CB 4.2Å; Y667-L726 HydrophobicContact CE2-CD2 3.96Å; F701-L726 HydrophobicContact CD1-CD1 4.2Å; F701-L726 HydrophobicContact CD2-CD1 3.82Å; F701-L726 HydrophobicContact CE1-CD1 3.84Å; F701-L726 HydrophobicContact CE1-CD2 4.49Å; F701-L726 HydrophobicContact CE2-CD1 3.44Å; F701-L726 VanDerWaalsContact CE2-CD1 3.44Å; F701-L726 HydrophobicContact CG-CD1 4.19Å; F701-L726 HydrophobicContact CZ-CD1 3.45Å; F701-L726 VanDerWaalsContact CZ-CD1 3.45Å; F701-L726 HydrophobicContact CZ-CD2 4.12Å; F701-L726 HydrophobicContact CZ-CG 4.44Å; K718-L726 WeakPolarHBondContact CA-O 3.42Å; I719-L726 HydrophobicContact CB-CB 4.38Å; I719-L726 HydrophobicContact CB-CD1 4.4Å; I719-L726 HydrophobicContact CG2-CD1 4.47Å; I719-L726 PolarHBondContact N-O 3.49Å; I719-L726 WeakPolarHBondContact O-CB 3.31Å; I719-L726 PolarHBondContact O-N 3.22Å; R724-L726 HydrophobicContact CB-CD2 4.07Å; L726-F728 HydrophobicContact CB-CE2 3.76Å; L726-F728 HydrophobicContact CB-CZ 3.79Å; L726-F728 HydrophobicContact CD1-CZ 4.37Å
727	I	86.1	Confident	87.6	Confident	50 Å²	50	41.9 Å²	41.9	26%	0.256	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.5	-174.8	-57	-178.8	0	0	0	109	I668 T716 K718	I668-I727 PolarHBondContact N-O 2.81Å; T716-I727 HydrophobicContact CG2-CG2 3.34Å; K718-I727 HydrophobicContact CG-CG1 4.48Å
728	F	85.9	Confident	87.6	Confident	2 Å²	2	45 Å²	45	1%	0.009	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.1	-173.8	-47.9	-86.3	0	0	0	110.8	V664 Y667 L680 I689 T716 F717 I719 L726	V664-F728 HydrophobicContact CB-CB 4.2Å; V664-F728 HydrophobicContact CB-CD1 4.46Å; V664-F728 HydrophobicContact CG1-CB 4.23Å; V664-F728 HydrophobicContact CG2-CD1 4.04Å; Y667-F728 HydrophobicContact CD2-CD1 4.26Å; Y667-F728 AromaticContact CD2-CE1 3.68Å; Y667-F728 HydrophobicContact CD2-CE1 3.68Å; Y667-F728 HydrophobicContact CD2-CZ 4.26Å; Y667-F728 HydrophobicContact CE2-CE1 4.12Å; Y667-F728 HydrophobicContact CE2-CZ 4.32Å; L680-F728 HydrophobicContact CD1-CE1 4.05Å; L680-F728 HydrophobicContact CD1-CE2 4.36Å; L680-F728 HydrophobicContact CD1-CZ 3.9Å; I689-F728 HydrophobicContact CD1-CE1 3.77Å; I689-F728 HydrophobicContact CD1-CZ 3.95Å; I689-F728 HydrophobicContact CG1-CE1 4.22Å; I689-F728 HydrophobicContact CG1-CZ 4.45Å; T716-F728 CarbonylContact C-O 3.48Å; T716-F728 WeakPolarHBondContact CA-O 3.49Å; F717-F728 HydrophobicContact CD1-CD2 4.5Å; F717-F728 PolarHBondContact N-O 3.38Å; F717-F728 PolarHBondContact O-N 3Å; I719-F728 HydrophobicContact CB-CE2 4.34Å; I719-F728 HydrophobicContact CD1-CE2 3.9Å; I719-F728 HydrophobicContact CG1-CE2 4.02Å; L726-F728 HydrophobicContact CB-CE2 3.76Å; L726-F728 HydrophobicContact CB-CZ 3.79Å; L726-F728 HydrophobicContact CD1-CZ 4.37Å
729	E	87.3	Confident	87.8	Confident	80 Å²	80	42.5 Å²	42.5	37%	0.374	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.5	168.7	-64.4	-169.4	-144.8	0	0	111.2	V664 D665 N715	V664-E729 WeakPolarHBondContact CA-O 3.33Å; D665-E729 PolarHBondContact N-O 3.47Å; D665-E729 WeakPolarHBondContact O-CA 3.47Å; D665-E729 WeakPolarHBondContact O-CB 3.43Å; D665-E729 PolarHBondContact O-N 3.23Å; N715-E729 PolarHBondContact ND2-OE2 3.42Å; N715-E729 CarbonylContact O-C 3.57Å; N715-E729 WeakPolarHBondContact O-CA 3.48Å
730	T	88.9	Confident	87.9	Confident	14 Å²	14	42.4 Å²	42.4	9%	0.086	24%	0.24	C	C	.	.			trans	-164	153.9	176.3	-174	0	0	0	0	112.1	E663 V664 N715 K732 L733 I736	E663-T730 PolarHBondContact O-OG1 3.42Å; V664-T730 HydrophobicContact CG1-CG2 4.35Å; N715-T730 PolarHBondContact O-N 3.1Å; N715-T730 VanDerWaalsContact O-O 3.13Å; T730-K732 VanDerWaalsContact C-N 3.29Å; T730-K732 PolarHBondContact OG1-N 3.1Å; T730-L733 HydrophobicContact CG2-CD2 3.83Å; T730-L733 HydrophobicContact CG2-CG 4.46Å; T730-L733 WeakPolarHBondContact O-CG 3.48Å; T730-I736 HydrophobicContact CG2-CD1 3.69Å
731	S	88.4	Confident	88	Confident	116 Å²	116	44.3 Å²	44.3	81%	0.811	25%	0.249	S	C	*	.	S	Bend	trans	-80	-9.1	170.6	56.6	0	0	0	0	113.5
732	K	89.6	Confident	88.3	Confident	49 Å²	49	45 Å²	45	21%	0.213	25%	0.254	C	S	.	.			trans	-98.2	20.6	-171.1	-70.7	-70.4	-164.7	162.9	0	114.7	E447 Y662 T730 T734 E735 I736	E447-K732 PolarHBondContact O-NZ 3.42Å; Y662-K732 HydrophobicContact CD1-CB 3.67Å; Y662-K732 HydrophobicContact CD1-CG 4.1Å; Y662-K732 HydrophobicContact CE1-CB 4.16Å; T730-K732 VanDerWaalsContact C-N 3.29Å; T730-K732 PolarHBondContact OG1-N 3.1Å; K732-T734 PolarHBondContact O-N 2.85Å; K732-E735 VanDerWaalsContact CD-CD 3.41Å; K732-E735 HydrophobicContact CD-CG 4.48Å; K732-E735 WeakPolarHBondContact CD-OE1 3.25Å; K732-E735 WeakPolarHBondContact CD-OE2 3.4Å; K732-E735 WeakPolarHBondContact CE-OE1 3.43Å; K732-E735 IonicContact NZ-OE1 3.05Å; K732-E735 PolarHBondContact NZ-OE1 2.93Å; K732-E735 IonicContact NZ-OE2 3.63Å; K732-E735 PolarHBondContact NZ-OE2 3.17Å; K732-E735 PolarHBondContact O-N 3.24Å; K732-E735 VanDerWaalsContact O-N 3.14Å; K732-I736 HydrophobicContact CB-CD1 4.28Å; K732-I736 WeakPolarHBondContact O-CG1 3.34Å; K732-I736 PolarHBondContact O-N 3.19Å; K732-I736 VanDerWaalsContact O-N 3.09Å
733	L	89.9	Confident	88.8	Confident	14 Å²	14	42.5 Å²	42.5	7%	0.073	23%	0.229	C	C	.	.	H	α-helix	trans	-45.7	-50.2	-175.7	-62.7	178.6	0	0	0	115	V711 S714 F717 T730 M737	V711-L733 HydrophobicContact CG1-CD1 3.96Å; V711-L733 HydrophobicContact CG2-CB 4.02Å; V711-L733 HydrophobicContact CG2-CD1 4.48Å; S714-L733 WeakPolarHBondContact O-CD1 3.49Å; F717-L733 HydrophobicContact CB-CD2 3.67Å; F717-L733 HydrophobicContact CD2-CD2 4.29Å; F717-L733 HydrophobicContact CG-CD2 4.46Å; T730-L733 HydrophobicContact CG2-CD2 3.83Å; T730-L733 HydrophobicContact CG2-CG 4.46Å; T730-L733 WeakPolarHBondContact O-CG 3.48Å; L733-M737 WeakPolarHBondContact O-CB 3.25Å; L733-M737 PolarHBondContact O-N 3.18Å; L733-M737 VanDerWaalsContact O-N 3.1Å
734	T	87.9	Confident	89.2	Confident	71 Å²	71	37.2 Å²	37.2	44%	0.436	20%	0.199	S	C	.	.	H	α-helix	trans	-69.1	-37.9	-175.9	44.5	0	0	0	0	112.2	K732 Q738	K732-T734 PolarHBondContact O-N 2.85Å; T734-Q738 WeakPolarHBondContact O-CB 3.32Å; T734-Q738 WeakPolarHBondContact O-CG 3.23Å; T734-Q738 PolarHBondContact O-N 3.21Å
735	E	90.3	Very high	89.6	Confident	14 Å²	14	37.7 Å²	37.7	7%	0.065	21%	0.21	C	C	.	.	H	α-helix	trans	-70.1	-43	179.6	-66.4	172.3	-135	0	0	111.5	Q448 P449 Y662 K732 Q738 L739	Q448-E735 HydrophobicContact CG-CG 4.08Å; Q448-E735 WeakPolarHBondContact CG-OE1 3.41Å; P449-E735 HydrophobicContact CG-CG 4.12Å; Y662-E735 HydrophobicContact CE1-CB 3.91Å; K732-E735 VanDerWaalsContact CD-CD 3.41Å; K732-E735 HydrophobicContact CD-CG 4.48Å; K732-E735 WeakPolarHBondContact CD-OE1 3.25Å; K732-E735 WeakPolarHBondContact CD-OE2 3.4Å; K732-E735 WeakPolarHBondContact CE-OE1 3.43Å; K732-E735 IonicContact NZ-OE1 3.05Å; K732-E735 PolarHBondContact NZ-OE1 2.93Å; K732-E735 IonicContact NZ-OE2 3.63Å; K732-E735 PolarHBondContact NZ-OE2 3.17Å; K732-E735 PolarHBondContact O-N 3.24Å; K732-E735 VanDerWaalsContact O-N 3.14Å; E735-Q738 PolarHBondContact O-N 3.4Å; E735-L739 WeakPolarHBondContact O-CB 3.32Å; E735-L739 PolarHBondContact O-N 3.08Å
736	I	92.6	Very high	89.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-48.2	174.6	-65.1	162.4	0	0	0	110.1	Y662 L680 F717 T730 K732 Q738 L739 M740	Y662-I736 HydrophobicContact CD1-CD1 4.19Å; Y662-I736 HydrophobicContact CD1-CG1 3.7Å; Y662-I736 HydrophobicContact CD2-CD1 4.4Å; Y662-I736 HydrophobicContact CD2-CG1 3.64Å; Y662-I736 HydrophobicContact CE1-CG1 3.91Å; Y662-I736 HydrophobicContact CE2-CG1 3.86Å; Y662-I736 HydrophobicContact CG-CD1 3.95Å; Y662-I736 HydrophobicContact CG-CG1 3.55Å; L680-I736 HydrophobicContact CD2-CD1 4.3Å; L680-I736 HydrophobicContact CD2-CG2 4.08Å; F717-I736 HydrophobicContact CD1-CG2 4.13Å; F717-I736 HydrophobicContact CE1-CG2 3.67Å; F717-I736 HydrophobicContact CE2-CG2 4.31Å; F717-I736 HydrophobicContact CZ-CG2 3.77Å; T730-I736 HydrophobicContact CG2-CD1 3.69Å; K732-I736 HydrophobicContact CB-CD1 4.28Å; K732-I736 WeakPolarHBondContact O-CG1 3.34Å; K732-I736 PolarHBondContact O-N 3.19Å; K732-I736 VanDerWaalsContact O-N 3.09Å; I736-Q738 PolarHBondContact O-N 2.96Å; I736-L739 PolarHBondContact O-N 2.89Å; I736-M740 HydrophobicContact CG2-SD 4.17Å; I736-M740 WeakPolarHBondContact O-CG 3.33Å; I736-M740 PolarHBondContact O-N 2.7Å
737	M	91.5	Very high	90	Very high	58 Å²	58	36.8 Å²	36.8	29%	0.286	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-43.7	178.6	-171.3	172.8	64.1	0	0	112.1	V711 F717 L733 N741	V711-M737 HydrophobicContact CG2-SD 4.33Å; F717-M737 HydrophobicContact CE2-CB 4.1Å; L733-M737 WeakPolarHBondContact O-CB 3.25Å; L733-M737 PolarHBondContact O-N 3.18Å; L733-M737 VanDerWaalsContact O-N 3.1Å; M737-N741 WeakPolarHBondContact O-CB 3.3Å; M737-N741 PolarHBondContact O-N 2.84Å; M737-N741 PolarHBondContact O-ND2 2.75Å; M737-N741 PolarHBondContact O-OD1 3.12Å
738	Q	91.3	Very high	89.9	Confident	66 Å²	66	39.3 Å²	39.3	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-43.5	176.3	-76.8	171.1	-2.2	0	0	112.1	T734 E735 I736 N741 A742	T734-Q738 WeakPolarHBondContact O-CB 3.32Å; T734-Q738 WeakPolarHBondContact O-CG 3.23Å; T734-Q738 PolarHBondContact O-N 3.21Å; E735-Q738 PolarHBondContact O-N 3.4Å; I736-Q738 PolarHBondContact O-N 2.96Å; Q738-N741 PolarHBondContact O-N 3.14Å; Q738-A742 WeakPolarHBondContact O-CB 3.49Å; Q738-A742 PolarHBondContact O-N 2.9Å
739	L	93.9	Very high	89.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68.3	-42.3	-179.8	-179	65.4	0	0	0	112.2	Y484 T660 Y662 V682 E735 I736 A742 Y743	Y484-L739 HydrophobicContact CD2-CD1 3.9Å; Y484-L739 HydrophobicContact CE1-CD1 4.44Å; Y484-L739 HydrophobicContact CE2-CB 4.43Å; Y484-L739 HydrophobicContact CE2-CD1 3.56Å; Y484-L739 HydrophobicContact CG-CD1 4.48Å; Y484-L739 WeakPolarHBondContact OH-CA 3.48Å; Y484-L739 PolarHBondContact OH-N 3.17Å; T660-L739 VanDerWaalsContact CB-CD2 3.45Å; T660-L739 HydrophobicContact CG2-CD2 4.06Å; T660-L739 WeakPolarHBondContact OG1-CD2 3.33Å; Y662-L739 HydrophobicContact CE2-CD2 3.89Å; V682-L739 HydrophobicContact CB-CD2 3.84Å; V682-L739 HydrophobicContact CB-CG 4.46Å; V682-L739 HydrophobicContact CG1-CD2 3.94Å; V682-L739 HydrophobicContact CG1-CG 4.02Å; E735-L739 WeakPolarHBondContact O-CB 3.32Å; E735-L739 PolarHBondContact O-N 3.08Å; I736-L739 PolarHBondContact O-N 2.89Å; L739-A742 PolarHBondContact O-N 3.41Å; L739-Y743 HydrophobicContact CD1-CD2 3.85Å; L739-Y743 HydrophobicContact CD1-CE2 3.61Å; L739-Y743 HydrophobicContact CD2-CE2 4.19Å; L739-Y743 HydrophobicContact CG-CD2 3.86Å; L739-Y743 HydrophobicContact CG-CE2 3.81Å; L739-Y743 WeakPolarHBondContact O-CD2 3.27Å; L739-Y743 PolarHBondContact O-N 2.97Å
740	M	93.8	Very high	89.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-49.6	172.7	-73.2	-178.1	67.3	0	0	110.5	V682 V687 I706 Y709 F717 I719 I736 A742 Y743 F744	V682-M740 HydrophobicContact CG1-CG 3.83Å; V682-M740 HydrophobicContact CG2-CG 4.36Å; V687-M740 HydrophobicContact CG2-CE 3.97Å; V687-M740 HydrophobicContact CG2-CG 4.48Å; V687-M740 HydrophobicContact CG2-SD 4.26Å; I706-M740 HydrophobicContact CD1-CE 4.3Å; Y709-M740 HydrophobicContact CD1-CE 3.64Å; Y709-M740 HydrophobicContact CD2-CB 4.49Å; Y709-M740 HydrophobicContact CD2-CE 3.74Å; Y709-M740 HydrophobicContact CD2-SD 4.02Å; Y709-M740 HydrophobicContact CE1-CE 4.03Å; Y709-M740 HydrophobicContact CE2-CB 3.93Å; Y709-M740 HydrophobicContact CE2-CE 4.1Å; Y709-M740 HydrophobicContact CE2-SD 4.41Å; Y709-M740 HydrophobicContact CG-CE 3.49Å; Y709-M740 VanDerWaalsContact CG-CE 3.49Å; Y709-M740 HydrophobicContact CG-SD 4.29Å; F717-M740 HydrophobicContact CE1-SD 3.86Å; F717-M740 HydrophobicContact CZ-SD 3.9Å; I719-M740 HydrophobicContact CD1-CE 4.48Å; I719-M740 HydrophobicContact CD1-SD 4.42Å; I736-M740 HydrophobicContact CG2-SD 4.17Å; I736-M740 WeakPolarHBondContact O-CG 3.33Å; I736-M740 PolarHBondContact O-N 2.7Å; M740-A742 VanDerWaalsContact C-N 3.26Å; M740-A742 PolarHBondContact O-N 3.4Å; M740-Y743 PolarHBondContact O-N 3.18Å; M740-F744 HydrophobicContact CE-CE2 4.37Å; M740-F744 VanDerWaalsContact O-CD2 3.23Å; M740-F744 WeakPolarHBondContact O-CD2 2.99Å; M740-F744 PolarHBondContact O-N 3.4Å
741	N	92.1	Very high	88.4	Confident	63 Å²	63	54.5 Å²	54.5	34%	0.337	27%	0.272	S	S	.	.	H	α-helix	trans	-57.4	-38.1	176	-69.5	-2.6	0	0	0	112.2	Y709 M737 Q738 S745	Y709-N741 WeakPolarHBondContact CE2-OD1 3.2Å; Y709-N741 PolarHBondContact OH-OD1 3.2Å; M737-N741 WeakPolarHBondContact O-CB 3.3Å; M737-N741 PolarHBondContact O-N 2.84Å; M737-N741 PolarHBondContact O-ND2 2.75Å; M737-N741 PolarHBondContact O-OD1 3.12Å; Q738-N741 PolarHBondContact O-N 3.14Å; N741-S745 VanDerWaalsContact O-CB 3.23Å; N741-S745 WeakPolarHBondContact O-CB 3.18Å; N741-S745 PolarHBondContact O-N 3.01Å; N741-S745 PolarHBondContact O-OG 2.75Å
742	A	92.3	Very high	87.1	Confident	19 Å²	19	51.9 Å²	51.9	16%	0.157	26%	0.263	C	S	.	.	H	α-helix	trans	-68.4	-44.9	178.2	0	0	0	0	0	112.5	Y484 Q738 L739 M740 S745 A746	Y484-A742 HydrophobicContact CD1-CB 4.18Å; Y484-A742 HydrophobicContact CE1-CB 3.48Å; Y484-A742 VanDerWaalsContact CE1-CB 3.48Å; Q738-A742 WeakPolarHBondContact O-CB 3.49Å; Q738-A742 PolarHBondContact O-N 2.9Å; L739-A742 PolarHBondContact O-N 3.41Å; M740-A742 VanDerWaalsContact C-N 3.26Å; M740-A742 PolarHBondContact O-N 3.4Å; A742-S745 PolarHBondContact O-N 3.05Å; A742-A746 WeakPolarHBondContact O-CB 3.43Å; A742-A746 PolarHBondContact O-N 3.14Å
743	Y	94.1	Very high	85.5	Confident	1 Å²	1	59 Å²	59	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-52.4	173.2	-87.4	-64.5	0	0	0	111.1	C485 L486 L487 G658 V682 A684 Y703 L739 M740 S745 A746 I747	C485-Y743 HydrophobicContact CB-CD1 3.7Å; C485-Y743 HydrophobicContact CB-CE1 3.45Å; C485-Y743 VanDerWaalsContact CB-CE1 3.45Å; C485-Y743 HydrophobicContact CB-CG 4.33Å; L486-Y743 PolarHBondContact N-OH 3.15Å; L487-Y743 HydrophobicContact CD2-CD1 3.87Å; L487-Y743 HydrophobicContact CD2-CE1 4.2Å; G658-Y743 PolarHBondContact O-OH 2.98Å; V682-Y743 HydrophobicContact CG1-CD2 3.83Å; V682-Y743 HydrophobicContact CG1-CE2 4.1Å; A684-Y743 HydrophobicContact CB-CD1 4.09Å; A684-Y743 HydrophobicContact CB-CE1 3.83Å; Y703-Y743 WeakPolarHBondContact OH-CB 3.33Å; L739-Y743 HydrophobicContact CD1-CD2 3.85Å; L739-Y743 HydrophobicContact CD1-CE2 3.61Å; L739-Y743 HydrophobicContact CD2-CE2 4.19Å; L739-Y743 HydrophobicContact CG-CD2 3.86Å; L739-Y743 HydrophobicContact CG-CE2 3.81Å; L739-Y743 WeakPolarHBondContact O-CD2 3.27Å; L739-Y743 PolarHBondContact O-N 2.97Å; M740-Y743 PolarHBondContact O-N 3.18Å; Y743-S745 VanDerWaalsContact C-N 3.32Å; Y743-S745 PolarHBondContact O-N 2.6Å; Y743-A746 PolarHBondContact O-N 3.15Å; Y743-A746 VanDerWaalsContact O-N 3.1Å; Y743-I747 WeakPolarHBondContact O-CD1 3.42Å; Y743-I747 WeakPolarHBondContact O-CG1 3.46Å; Y743-I747 PolarHBondContact O-N 3.05Å
744	F	88.9	Confident	83.5	Confident	33 Å²	33	61.4 Å²	61.4	15%	0.145	32%	0.322	C	S	.	.	H	α-helix	trans	-52.2	-50.1	174.8	-84.6	-70.6	0	0	0	111.5	Y703 Y709 M740 A746 I747 H748	Y703-F744 HydrophobicContact CD1-CD1 4.45Å; Y703-F744 HydrophobicContact CD1-CD2 4.26Å; Y703-F744 AromaticContact CD1-CE1 3.83Å; Y703-F744 HydrophobicContact CD1-CE1 3.83Å; Y703-F744 AromaticContact CD1-CE2 3.56Å; Y703-F744 HydrophobicContact CD1-CE2 3.56Å; Y703-F744 AromaticContact CD1-CZ 3.33Å; Y703-F744 HydrophobicContact CD1-CZ 3.33Å; Y703-F744 HydrophobicContact CE1-CD2 4.25Å; Y703-F744 AromaticContact CE1-CE2 3.79Å; Y703-F744 HydrophobicContact CE1-CE2 3.79Å; Y703-F744 HydrophobicContact CE1-CZ 4.06Å; Y703-F744 HydrophobicContact CG-CE1 4.1Å; Y703-F744 HydrophobicContact CG-CZ 4.06Å; Y709-F744 HydrophobicContact CD1-CE2 4.21Å; Y709-F744 AromaticContact CE1-CD2 3.99Å; Y709-F744 HydrophobicContact CE1-CD2 3.99Å; Y709-F744 AromaticContact CE1-CE2 3.3Å; Y709-F744 HydrophobicContact CE1-CE2 3.3Å; Y709-F744 AromaticContact CE1-CZ 3.97Å; Y709-F744 HydrophobicContact CE1-CZ 3.97Å; Y709-F744 AromaticContact CZ-CD2 3.93Å; Y709-F744 AromaticContact CZ-CE2 3.69Å; Y709-F744 VanDerWaalsContact OH-CD2 3.3Å; Y709-F744 WeakPolarHBondContact OH-CD2 3.5Å; M740-F744 HydrophobicContact CE-CE2 4.37Å; M740-F744 VanDerWaalsContact O-CD2 3.23Å; M740-F744 WeakPolarHBondContact O-CD2 2.99Å; M740-F744 PolarHBondContact O-N 3.4Å; F744-A746 VanDerWaalsContact C-N 3.3Å; F744-A746 PolarHBondContact O-N 3.01Å; F744-I747 PolarHBondContact O-N 3.43Å; F744-H748 PolarHBondContact O-N 2.91Å; F744-H748 VanDerWaalsContact O-N 3.09Å; F744-H748 PolarHBondContact O-ND1 3.11Å
745	S	89.4	Confident	81.1	Confident	63 Å²	63	65.4 Å²	65.4	44%	0.441	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-32.8	-179.8	-61.3	0	0	0	0	113.2	N741 A742 Y743 R749	N741-S745 VanDerWaalsContact O-CB 3.23Å; N741-S745 WeakPolarHBondContact O-CB 3.18Å; N741-S745 PolarHBondContact O-N 3.01Å; N741-S745 PolarHBondContact O-OG 2.75Å; A742-S745 PolarHBondContact O-N 3.05Å; Y743-S745 VanDerWaalsContact C-N 3.32Å; Y743-S745 PolarHBondContact O-N 2.6Å; S745-R749 VanDerWaalsContact O-CG 3.31Å; S745-R749 WeakPolarHBondContact O-CG 3.39Å; S745-R749 PolarHBondContact O-N 2.94Å; S745-R749 PolarHBondContact O-NE 2.79Å
746	A	88.8	Confident	78.6	Confident	5 Å²	5	72.9 Å²	72.9	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-79.2	-40.8	179	0	0	0	0	0	112.6	T436 L487 A742 Y743 F744 H748 R749 Q750	T436-A746 HydrophobicContact CG2-CB 3.77Å; L487-A746 HydrophobicContact CD1-CB 3.45Å; L487-A746 VanDerWaalsContact CD1-CB 3.45Å; L487-A746 HydrophobicContact CD2-CB 4.3Å; A742-A746 WeakPolarHBondContact O-CB 3.43Å; A742-A746 PolarHBondContact O-N 3.14Å; Y743-A746 PolarHBondContact O-N 3.15Å; Y743-A746 VanDerWaalsContact O-N 3.1Å; F744-A746 VanDerWaalsContact C-N 3.3Å; F744-A746 PolarHBondContact O-N 3.01Å; A746-H748 PolarHBondContact O-N 2.95Å; A746-R749 PolarHBondContact O-N 3.47Å; A746-R749 VanDerWaalsContact O-N 3.16Å; A746-Q750 PolarHBondContact O-N 3.32Å
747	I	86.4	Confident	75.7	Confident	55 Å²	55	76.9 Å²	76.9	28%	0.282	41%	0.409	S	S	.	.	H	α-helix	trans	-59.3	-46	174.8	-64.8	159.3	0	0	0	110.4	L487 A684 Y703 Y743 F744 R749 Q750 R751	L487-I747 HydrophobicContact CD2-CG1 3.96Å; A684-I747 VanDerWaalsContact O-CD1 3.26Å; A684-I747 WeakPolarHBondContact O-CD1 3.18Å; Y703-I747 HydrophobicContact CD2-CD1 3.78Å; Y703-I747 HydrophobicContact CE2-CD1 3.87Å; Y743-I747 WeakPolarHBondContact O-CD1 3.42Å; Y743-I747 WeakPolarHBondContact O-CG1 3.46Å; Y743-I747 PolarHBondContact O-N 3.05Å; F744-I747 PolarHBondContact O-N 3.43Å; I747-R749 VanDerWaalsContact C-N 3.34Å; I747-R749 PolarHBondContact O-N 2.81Å; I747-Q750 PolarHBondContact O-N 3.12Å; I747-R751 PolarHBondContact O-N 3.33Å
748	H	84.1	Confident	72.9	Confident	102 Å²	102	81.8 Å²	81.8	47%	0.472	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-39.3	175.5	-74.1	91.5	0	0	0	112.5	F744 A746 Q750 R751 G752	F744-H748 PolarHBondContact O-N 2.91Å; F744-H748 VanDerWaalsContact O-N 3.09Å; F744-H748 PolarHBondContact O-ND1 3.11Å; A746-H748 PolarHBondContact O-N 2.95Å; H748-Q750 PolarHBondContact O-N 3.28Å; H748-R751 PolarHBondContact O-N 3.49Å; H748-G752 PolarHBondContact O-N 3.41Å
749	R	83	Confident	70	Confident	155 Å²	155	84 Å²	84	59%	0.585	46%	0.455	S	S	*	.	H	α-helix	trans	-68.3	-29.2	176.5	-78.1	177	-67.2	175	3.1	113.7	S745 A746 I747	S745-R749 VanDerWaalsContact O-CG 3.31Å; S745-R749 WeakPolarHBondContact O-CG 3.39Å; S745-R749 PolarHBondContact O-N 2.94Å; S745-R749 PolarHBondContact O-NE 2.79Å; A746-R749 PolarHBondContact O-N 3.47Å; A746-R749 VanDerWaalsContact O-N 3.16Å; I747-R749 VanDerWaalsContact C-N 3.34Å; I747-R749 PolarHBondContact O-N 2.81Å
750	Q	76.1	Confident	67.3	Low	82 Å²	82	89.3 Å²	89.3	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-71.9	-46.5	170.6	-70.2	-172.2	0.6	0	0	110.9	K434 A746 I747 H748 K753	K434-Q750 PolarHBondContact O-NE2 2.92Å; A746-Q750 PolarHBondContact O-N 3.32Å; I747-Q750 PolarHBondContact O-N 3.12Å; H748-Q750 PolarHBondContact O-N 3.28Å; Q750-K753 PolarHBondContact O-N 2.87Å
751	R	72.9	Confident	64.1	Low	179 Å²	179	95.2 Å²	95.2	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-65.5	-41.1	-179	-165.7	174.8	-176.9	-167.1	-2.7	113.1	I747 H748 K753 G754 E755	I747-R751 PolarHBondContact O-N 3.33Å; H748-R751 PolarHBondContact O-N 3.49Å; R751-K753 PolarHBondContact O-N 2.88Å; R751-K753 VanDerWaalsContact O-N 3.14Å; R751-G754 PolarHBondContact O-N 3.44Å; R751-E755 PolarHBondContact O-N 2.91Å
752	G	59.3	Low	61.5	Low	60 Å²	60	98.7 Å²	98.7	62%	0.619	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-0.1	176.9	0	0	0	0	0	115.6	H748	H748-G752 PolarHBondContact O-N 3.41Å
753	K	56.2	Low	58.4	Low	199 Å²	199	103.8 Å²	103.8	87%	0.865	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-4.5	164.8	-77.2	-175.1	174.3	-175.8	0	113.1	Q750 R751	Q750-K753 PolarHBondContact O-N 2.87Å; R751-K753 PolarHBondContact O-N 2.88Å; R751-K753 VanDerWaalsContact O-N 3.14Å
754	G	48.7	Very low	55.1	Low	65 Å²	65	112.3 Å²	112.3	67%	0.67	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-47.9	-172.6	0	0	0	0	0	115.3	R751	R751-G754 PolarHBondContact O-N 3.44Å
755	E	38	Very low	52.2	Low	154 Å²	154	116.1 Å²	116.1	72%	0.72	63%	0.631	S	S	*	*	S	Bend	trans	-144.1	161.1	-172.4	-79.1	174.2	159	0	0	112.1	R751	R751-E755 PolarHBondContact O-N 2.91Å
756	D	36.3	Very low	49.3	Very low	171 Å²	171	118.6 Å²	118.6	91%	0.914	64%	0.644	S	S	*	*			trans	-60.4	145.8	179.8	-85.2	-54.2	0	0	0	113.3	D758	D756-D758 PolarHBondContact O-N 3.46Å
757	A	33.4	Very low	46.2	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	68%	0.676	S	S	*	*			trans	-89.7	87.6	-165.6	0	0	0	0	0	114.1	T759	A757-T759 PolarHBondContact O-N 3.37Å; A757-T759 VanDerWaalsContact O-N 3.16Å; A757-T759 PolarHBondContact O-OG1 3.19Å
758	D	32.2	Very low	43.6	Very low	162 Å²	162	128.9 Å²	128.9	87%	0.866	70%	0.703	S	S	*	*			trans	-56.9	118.6	157.9	-99	-26.4	0	0	0	109.4	D756 I760	D756-D758 PolarHBondContact O-N 3.46Å; D758-I760 PolarHBondContact O-N 2.83Å
759	T	30.5	Very low	40.7	Very low	112 Å²	112	125.8 Å²	125.8	69%	0.687	70%	0.699	S	S	*	*			trans	-85.5	109.6	-161.8	-63.1	0	0	0	0	112.2	A757 T761	A757-T759 PolarHBondContact O-N 3.37Å; A757-T759 VanDerWaalsContact O-N 3.16Å; A757-T759 PolarHBondContact O-OG1 3.19Å; T759-T761 HydrophobicContact CG2-CG2 3.88Å
760	I	36.1	Very low	38	Very low	112 Å²	112	128.1 Å²	128.1	57%	0.574	71%	0.714	S	S	*	*			trans	-99	89.6	165.5	-51.1	-179.4	0	0	0	109	D758 F762	D758-I760 PolarHBondContact O-N 2.83Å; I760-F762 HydrophobicContact CG2-CD2 3.73Å; I760-F762 HydrophobicContact CG2-CE2 3.43Å; I760-F762 VanDerWaalsContact CG2-CE2 3.43Å; I760-F762 HydrophobicContact CG2-CZ 4.13Å; I760-F762 PolarHBondContact O-N 2.69Å; I760-F762 VanDerWaalsContact O-N 3.15Å
761	T	26.5	Very low	35.5	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	74%	0.738	S	S	*	*			trans	-78.1	90.6	175.3	20	0	0	0	0	111.4	T759	T759-T761 HydrophobicContact CG2-CG2 3.88Å
762	F	38.6	Very low	33.2	Very low	136 Å²	136	135.9 Å²	135.9	60%	0.596	75%	0.747	S	S	*	*			trans	-78.7	129.5	159.7	-74.7	-72.9	0	0	0	110	I760	I760-F762 HydrophobicContact CG2-CD2 3.73Å; I760-F762 HydrophobicContact CG2-CE2 3.43Å; I760-F762 VanDerWaalsContact CG2-CE2 3.43Å; I760-F762 HydrophobicContact CG2-CZ 4.13Å; I760-F762 PolarHBondContact O-N 2.69Å; I760-F762 VanDerWaalsContact O-N 3.15Å
763	T	26.4	Very low	31.5	Very low	126 Å²	126	141 Å²	141	77%	0.773	76%	0.76	S	S	*	*			trans	-76.9	121.8	177.8	50	0	0	0	0	110.9	S765	T763-S765 PolarHBondContact O-N 2.87Å
764	E	26.2	Very low	30.1	Very low	179 Å²	179	135.5 Å²	135.5	84%	0.836	75%	0.751	S	S	*	*			trans	-64	98.4	167	-67.4	-173.1	121.4	0	0	109.9	T766	E764-T766 PolarHBondContact O-N 3.25Å; E764-T766 VanDerWaalsContact O-N 3.13Å
765	S	26.4	Very low	29	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	76%	0.758	S	S	*	*			trans	-86	47.3	174.1	66.4	0	0	0	0	111.8	T763 D767	T763-S765 PolarHBondContact O-N 2.87Å; S765-D767 PolarHBondContact O-N 2.95Å
766	T	28.3	Very low	28.6	Very low	115 Å²	115	137.3 Å²	137.3	71%	0.706	76%	0.762	S	S	*	*			trans	-89	48.2	174.2	35.6	0	0	0	0	111.6	E764	E764-T766 PolarHBondContact O-N 3.25Å; E764-T766 VanDerWaalsContact O-N 3.13Å
767	D	24.4	Very low	28.2	Very low	135 Å²	135	134.8 Å²	134.8	72%	0.722	76%	0.755	S	S	*	*			trans	-121.1	114.6	168	-175.9	20.4	0	0	0	110	S765 G769	S765-D767 PolarHBondContact O-N 2.95Å; D767-G769 PolarHBondContact O-N 2.97Å; D767-G769 PolarHBondContact OD1-N 2.8Å
768	V	31.8	Very low	27.9	Very low	140 Å²	140	137 Å²	137	85%	0.848	76%	0.761	S	S	*	*			trans	-80.3	61.4	169	-173	0	0	0	0	107.7	F770	V768-F770 PolarHBondContact O-N 2.76Å
769	G	24.4	Very low	27.6	Very low	38 Å²	38	135.2 Å²	135.2	39%	0.392	76%	0.757	S	S	.	*			trans	-68.8	104.1	-169.6	0	0	0	0	0	111.5	D767 R771	D767-G769 PolarHBondContact O-N 2.97Å; D767-G769 PolarHBondContact OD1-N 2.8Å; G769-R771 PolarHBondContact O-N 3.49Å
770	F	24.6	Very low	27.4	Very low	204 Å²	204	136.3 Å²	136.3	90%	0.895	76%	0.764	S	S	*	*			trans	-57.5	92	157	-94.1	-93.3	0	0	0	108.2	V768 H772	V768-F770 PolarHBondContact O-N 2.76Å; F770-H772 PolarHBondContact O-N 3.28Å
771	R	24.6	Very low	26.9	Very low	237 Å²	237	139.1 Å²	139.1	89%	0.894	78%	0.779	S	S	*	*			trans	-64.2	103.5	-179.5	-75.6	-171.2	175.1	-172.3	-0.6	109.7	G769 L773	G769-R771 PolarHBondContact O-N 3.49Å; R771-L773 PolarHBondContact O-N 3.35Å
772	H	24.1	Very low	27	Very low	186 Å²	186	141 Å²	141	86%	0.861	78%	0.784	S	S	*	*			trans	-50	123.4	160.2	-105.7	-77.8	0	0	0	108.8	F770 A774	F770-H772 PolarHBondContact O-N 3.28Å; H772-A774 PolarHBondContact O-N 3.26Å
773	L	24.4	Very low	26.4	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	80%	0.797	S	S	*	*			trans	-65.9	104.6	172.8	-76.6	163	0	0	0	108.9	R771	R771-L773 PolarHBondContact O-N 3.35Å
774	A	25.9	Very low	26.5	Very low	83 Å²	83	145.4 Å²	145.4	69%	0.686	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.9	138.1	159.5	0	0	0	0	0	108.5	H772 T776	H772-A774 PolarHBondContact O-N 3.26Å; A774-T776 PolarHBondContact O-N 3.49Å
775	P	26.7	Very low	26.6	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.7	134.6	-174.8	25.7	-34.1	0	0	0	111.2
776	T	28.6	Very low	26.7	Very low	131 Å²	131	142 Å²	142	80%	0.804	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.5	136.5	176.3	44.7	0	0	0	0	111.1	A774	A774-T776 PolarHBondContact O-N 3.49Å
777	P	27.3	Very low	26.7	Very low	118 Å²	118	144.9 Å²	144.9	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.3	141.8	169.4	28.6	-33.8	0	0	0	110
778	T	27.7	Very low	27.1	Very low	132 Å²	132	143.8 Å²	143.8	81%	0.81	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.6	-179.5	-15	0	0	0	0	110.6	T780	T778-T780 PolarHBondContact O-N 3.06Å
779	P	25.9	Very low	27.1	Very low	123 Å²	123	147.5 Å²	147.5	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-68.3	125.7	175.1	27.6	-33.6	0	0	0	110.3
780	T	26.4	Very low	27.3	Very low	136 Å²	136	153 Å²	153	83%	0.834	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-66.3	144.4	173.9	-29.4	0	0	0	0	110.4	T778 L782	T778-T780 PolarHBondContact O-N 3.06Å; T780-L782 PolarHBondContact O-N 2.76Å
781	L	26.4	Very low	27.4	Very low	170 Å²	170	150.3 Å²	150.3	89%	0.89	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-57.7	118.6	177.1	-80.8	150.5	0	0	0	111.4
782	L	27.2	Very low	27.5	Very low	164 Å²	164	145.5 Å²	145.5	86%	0.859	84%	0.84	S	S	*	*			trans	-84.2	115.7	160.9	-86.5	164.1	0	0	0	108.4	T780	T780-L782 PolarHBondContact O-N 2.76Å
783	E	25.9	Very low	27.7	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-67.9	131.7	174.9	-63.5	-176.7	125.5	0	0	110.4
784	L	29.3	Very low	28	Very low	168 Å²	168	141.5 Å²	141.5	88%	0.88	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-80.7	131.2	173.4	-73.7	168.2	0	0	0	109.6	S786	L784-S786 PolarHBondContact O-N 3.24Å
785	P	27.8	Very low	28.1	Very low	106 Å²	106	145.4 Å²	145.4	69%	0.688	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-69.4	129.5	178.4	28.5	-34	0	0	0	110.8
786	S	28.6	Very low	28.2	Very low	116 Å²	116	146.9 Å²	146.9	81%	0.811	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-81.3	132.3	171.6	48	0	0	0	0	110.9	L784	L784-S786 PolarHBondContact O-N 3.24Å
787	H	27.6	Very low	28.2	Very low	175 Å²	175	148.1 Å²	148.1	81%	0.81	85%	0.852	S	S	*	*			trans	-110.3	146.8	164.4	-79.3	-56.8	0	0	0	109.8
788	P	33.7	Very low	28.2	Very low	112 Å²	112	150.6 Å²	150.6	73%	0.727	86%	0.859	S	S	*	*			trans	-91.5	156.7	-165.1	35.9	-36.8	0	0	0	114.4
789	V	32.2	Very low	28.3	Very low	219 Å²	219	152.3 Å²	152.3	100%	1.327	86%	0.863	S	S	*	*			trans	76.1	0	176.9	-166.6	0	0	0	0	114.4

Retrieved 789 of 789 residues in 5330.8 ms (Link to these results)

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