A0A087YA29_POEFO Loading...

DNA polymerase eta

AlphaFold DB , UniProt , Accession A0A087YA29, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 776 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	28.1	Very low	27.1	Very low	231 Å²	231	153.3 Å²	153.3	100%	1.138	83%	0.832	S	S	*	*				0	100.2	0	-69.2	163.7	179.6	0	0	106.1
2	T	30.1	Very low	27.2	Very low	127 Å²	127	152.9 Å²	152.9	78%	0.779	82%	0.821	S	S	*	*				63.9	122.7	85	56.2	0	0	0	0	111.7
3	L	28.2	Very low	27.1	Very low	168 Å²	168	154 Å²	154	88%	0.88	82%	0.824	S	S	*	*			cis	-144.8	166.2	22	-111.9	147	0	0	0	113.4
4	S	27.5	Very low	27.2	Very low	95 Å²	95	156 Å²	156	66%	0.664	83%	0.825	S	S	*	*			trans	-77	159.1	169.3	176	0	0	0	0	111.3
5	C	25.3	Very low	27.4	Very low	121 Å²	121	152.9 Å²	152.9	82%	0.818	82%	0.822	S	S	*	*			trans	-137	131.2	161.3	-165.1	0	0	0	0	110.1
6	S	27.6	Very low	27.7	Very low	106 Å²	106	151.8 Å²	151.8	74%	0.741	82%	0.815	S	S	*	*			trans	-121.2	132.6	-179.4	-60.8	0	0	0	0	109.3
7	C	24.6	Very low	27.5	Very low	129 Å²	129	151.7 Å²	151.7	87%	0.872	82%	0.815	S	S	*	*			trans	-115.2	123.6	174.5	-86.4	0	0	0	0	111.1
8	N	27.5	Very low	27.7	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	81%	0.806	S	S	*	*			trans	-157.3	112.7	176.4	-152.2	1.1	0	0	0	107.6
9	F	24.6	Very low	27.8	Very low	201 Å²	201	150.8 Å²	150.8	88%	0.882	81%	0.805	S	S	*	*			trans	-163.3	159.4	156.4	-129.9	-91.8	0	0	0	112.3
10	L	27	Very low	27.7	Very low	151 Å²	151	154.7 Å²	154.7	79%	0.791	81%	0.809	S	S	*	*			trans	-117.6	167.2	-172.5	-78.3	158.7	0	0	0	112.1
11	R	27.8	Very low	27.8	Very low	203 Å²	203	154.4 Å²	154.4	77%	0.766	81%	0.808	S	S	*	*			trans	127	125.1	153.4	-72.7	-173.5	-170.1	-105.9	8.9	113
12	E	27.8	Very low	27.6	Very low	149 Å²	149	147.3 Å²	147.3	70%	0.696	79%	0.794	S	S	*	*			cis	97.7	108	43.3	176.6	-174.6	-118.6	0	0	110.8
13	I	26.7	Very low	27.6	Very low	167 Å²	167	145.6 Å²	145.6	86%	0.856	79%	0.793	S	S	*	*			trans	-141.7	129.3	172.4	-63.3	-178.2	0	0	0	108.3
14	Q	28.6	Very low	27.5	Very low	182 Å²	182	145 Å²	145	85%	0.85	79%	0.789	S	S	*	*			trans	-156.6	123.9	172.2	-175.7	-178.4	10	0	0	110.2
15	S	29	Very low	27.5	Very low	110 Å²	110	147.8 Å²	147.8	77%	0.769	80%	0.796	S	S	*	*			trans	-171.4	140.2	165.3	53.9	0	0	0	0	112.1
16	D	32.3	Very low	27.5	Very low	135 Å²	135	146.6 Å²	146.6	72%	0.722	79%	0.789	S	S	*	*			trans	-96.9	160.5	-176.4	-50.8	-87.5	0	0	0	114.2
17	N	25.7	Very low	27.5	Very low	150 Å²	150	150.6 Å²	150.6	80%	0.802	79%	0.794	S	S	*	*				-179.7	113.6	122.2	-100.7	-65.4	0	0	0	116.8
18	T	29.6	Very low	27.5	Very low	107 Å²	107	149.3 Å²	149.3	66%	0.656	79%	0.786	S	S	*	*				50	106.5	112.5	-37.2	0	0	0	0	123
19	F	29.5	Very low	27.5	Very low	180 Å²	180	146.4 Å²	146.4	79%	0.789	78%	0.778	S	S	*	*			trans	59.6	136.2	143.1	-85	-109.2	0	0	0	124.4	L21	F19-L21 HydrophobicContact CD1-CD1 4.15Å
20	Y	26.5	Very low	27.5	Very low	227 Å²	227	145.1 Å²	145.1	89%	0.89	77%	0.774	S	S	*	*				-159.2	167.9	123.9	-123.1	-86.6	0	0	0	112
21	L	29.3	Very low	27.5	Very low	150 Å²	150	145.7 Å²	145.7	79%	0.785	77%	0.773	S	S	*	*			trans	-104.4	157.3	-175.4	-79.1	71.9	0	0	0	113.7	F19	F19-L21 HydrophobicContact CD1-CD1 4.15Å
22	G	25.1	Very low	27.6	Very low	81 Å²	81	140 Å²	140	84%	0.835	77%	0.769	S	S	*	*			trans	-178.9	161	168.9	0	0	0	0	0	114.7
23	A	28.9	Very low	28.1	Very low	92 Å²	92	139 Å²	139	76%	0.76	78%	0.776	S	S	*	*			trans	-158.6	-175.2	-177.4	0	0	0	0	0	109.9
24	L	26.8	Very low	28.2	Very low	154 Å²	154	142.5 Å²	142.5	81%	0.806	78%	0.778	S	S	*	*			cis	-143.1	-167.2	19.5	-74.7	91.3	0	0	0	112
25	L	27.9	Very low	28.1	Very low	155 Å²	155	145.4 Å²	145.4	81%	0.812	78%	0.781	S	S	*	*			trans	-11.6	155.8	151.8	-52.1	170.5	0	0	0	117.6
26	S	25.2	Very low	27.9	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	78%	0.779	S	S	*	*			cis	-170.7	150.1	36.5	-151.2	0	0	0	0	115.8
27	F	26.6	Very low	27.6	Very low	190 Å²	190	145.2 Å²	145.2	83%	0.833	78%	0.784	S	S	*	*			trans	40.9	132.1	146.7	-89	-97.2	0	0	0	126.8
28	S	25.7	Very low	27.6	Very low	102 Å²	102	145.9 Å²	145.9	71%	0.713	79%	0.786	S	S	*	*			trans	65.4	153.9	139.4	-86.2	0	0	0	0	122.4
29	S	26.8	Very low	27.4	Very low	92 Å²	92	145.7 Å²	145.7	64%	0.643	79%	0.788	S	S	*	*			cis	-164.5	147.5	-5.7	-97.7	0	0	0	0	111.3
30	H	25.2	Very low	27.8	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.806	79%	0.787	S	S	*	*				168.2	163	126.3	-97.6	-64.2	0	0	0	116.9
31	E	27.8	Very low	28.6	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	78%	0.775	S	S	*	*			trans	-62	172.4	172.8	-75.6	129.3	121.2	0	0	116.2
32	A	28	Very low	28.5	Very low	84 Å²	84	137.7 Å²	137.7	69%	0.694	78%	0.776	S	S	*	*			cis	-174.6	-154.4	-15.3	0	0	0	0	0	106.2
33	P	39.8	Very low	28.6	Very low	129 Å²	129	139 Å²	139	84%	0.838	77%	0.772	S	S	*	*			cis	-128.3	-160.7	-20.2	39.2	-19	0	0	0	113.6
34	R	27.5	Very low	28.5	Very low	240 Å²	240	139 Å²	139	91%	0.906	77%	0.772	S	S	*	*			trans	-90.9	156	-173.5	-50.6	171.6	-178.9	174.3	-1.3	115
35	R	26.4	Very low	28.8	Very low	243 Å²	243	139.3 Å²	139.3	92%	0.917	78%	0.775	S	S	*	*			trans	-176.4	150.4	143.5	-100.8	168.2	-169.4	-169	2.7	107.6
36	S	24.6	Very low	28.8	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	77%	0.77	S	S	*	*			cis	166.7	122.1	-17.9	46	0	0	0	0	104.5
37	V	26.3	Very low	29	Very low	137 Å²	137	137.8 Å²	137.8	83%	0.83	78%	0.776	S	S	*	*			trans	-94.2	130.3	-172.7	174.7	0	0	0	0	111.9
38	I	26	Very low	29	Very low	165 Å²	165	135.3 Å²	135.3	85%	0.846	77%	0.771	S	S	*	*			trans	-143.5	125.6	161.4	-62	-175.4	0	0	0	108.9
39	C	26.4	Very low	29.2	Very low	103 Å²	103	135.9 Å²	135.9	70%	0.696	77%	0.773	S	S	*	*			trans	-98.8	174.8	165.3	-62.2	0	0	0	0	108.5
40	P	37.2	Very low	29.2	Very low	118 Å²	118	140.8 Å²	140.8	77%	0.766	78%	0.783	S	S	*	*			cis	-145.9	-142.8	25.1	46.2	-23.1	0	0	0	111.7
41	P	42.8	Very low	29.5	Very low	98 Å²	98	138 Å²	138	64%	0.636	78%	0.784	S	S	*	*			cis	-132.7	-170.5	-20.4	40.8	-22.8	0	0	0	115.4
42	Q	27.4	Very low	29.4	Very low	172 Å²	172	134.1 Å²	134.1	80%	0.804	79%	0.787	S	S	*	*			trans	83.7	105.3	147.3	-85.2	170.6	-5	0	0	122.5
43	S	27.3	Very low	29.5	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	79%	0.787	S	S	*	*				75.9	148.2	119.7	68.7	0	0	0	0	124.1
44	A	27	Very low	29.2	Very low	91 Å²	91	136.8 Å²	136.8	75%	0.752	79%	0.792	S	S	*	*			trans	93.8	146.7	146.9	0	0	0	0	0	119.7
45	D	33.3	Very low	29.4	Very low	161 Å²	161	131.3 Å²	131.3	86%	0.861	78%	0.78	S	S	*	*			trans	-61.8	152.3	-171	-49.9	-76.5	0	0	0	114.8
46	S	27.9	Very low	29.8	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	78%	0.777	S	S	*	*			trans	-146.4	74.3	161.3	39	0	0	0	0	111.3	L48	S46-L48 PolarHBondContact O-N 3.34Å; S46-L48 VanDerWaalsContact O-N 3.08Å
47	C	29.3	Very low	30.3	Very low	117 Å²	117	129.8 Å²	129.8	79%	0.791	78%	0.777	S	S	*	*			trans	-66.1	102.4	159.1	-172.6	0	0	0	0	108	C49	C47-C49 PolarHBondContact O-N 2.69Å
48	L	27.3	Very low	31	Very low	139 Å²	139	130.7 Å²	130.7	73%	0.728	77%	0.77	S	S	*	*			trans	-78.3	83.4	-176.4	-80.5	171.2	0	0	0	111.5	S46 F50	S46-L48 PolarHBondContact O-N 3.34Å; S46-L48 VanDerWaalsContact O-N 3.08Å; L48-F50 PolarHBondContact O-N 2.82Å
49	C	28	Very low	31.6	Very low	114 Å²	114	128.7 Å²	128.7	77%	0.77	77%	0.769	S	S	*	*			trans	-65.2	97.3	164.2	-64.1	0	0	0	0	110.2	C47	C47-C49 PolarHBondContact O-N 2.69Å
50	F	27.2	Very low	32.7	Very low	195 Å²	195	129.3 Å²	129.3	86%	0.855	76%	0.763	S	S	*	*			trans	-80.9	126.8	164.7	-101.9	-89.9	0	0	0	110.1	L48	L48-F50 PolarHBondContact O-N 2.82Å
51	S	31.6	Very low	34.3	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	75%	0.752	S	S	*	*			trans	-103.1	131.4	-178.5	46.6	0	0	0	0	112.4
52	G	27.1	Very low	36.3	Very low	81 Å²	81	130.9 Å²	130.9	84%	0.835	75%	0.747	S	S	*	*	S	Bend	trans	93.7	119.8	163.7	0	0	0	0	0	116.7
53	G	28.5	Very low	39.1	Very low	67 Å²	67	122.8 Å²	122.8	69%	0.691	71%	0.71	S	S	*	*	S	Bend	trans	100.6	104.5	157	0	0	0	0	0	117.1	L55	G53-L55 PolarHBondContact O-N 3.2Å
54	E	33.7	Very low	42.2	Very low	201 Å²	201	118.5 Å²	118.5	94%	0.939	68%	0.678	S	S	*	*	S	Bend	trans	47.6	40.7	145.6	-58.4	-169.4	113.5	0	0	119.4
55	L	32.1	Very low	45.2	Very low	126 Å²	126	117.2 Å²	117.2	66%	0.66	66%	0.656	S	S	*	*			trans	-129.7	61.2	162	-77.2	178.8	0	0	0	112.8	G53 R57	G53-L55 PolarHBondContact O-N 3.2Å; L55-R57 HydrophobicContact CD2-CG 3.98Å; L55-R57 PolarHBondContact O-N 3.19Å
56	S	34	Very low	48.2	Very low	121 Å²	121	111.1 Å²	111.1	85%	0.846	62%	0.621	S	S	*	*			trans	-71	49.5	159.2	52.4	0	0	0	0	111.7	F58	S56-F58 PolarHBondContact O-N 2.82Å
57	R	36.7	Very low	51.5	Low	192 Å²	192	106.3 Å²	106.3	73%	0.725	59%	0.587	S	S	*	*			trans	-73.5	94.3	178.2	-95.5	-172.8	176.2	164.6	-0.5	110.2	L55 C59	L55-R57 HydrophobicContact CD2-CG 3.98Å; L55-R57 PolarHBondContact O-N 3.19Å; R57-C59 PolarHBondContact O-N 2.84Å
58	F	40.9	Very low	54.8	Low	157 Å²	157	100.7 Å²	100.7	69%	0.689	55%	0.55	S	S	*	.			trans	19.4	72.1	149.6	-71.4	-87.9	0	0	0	115.5	S56 M60 Q249	S56-F58 PolarHBondContact O-N 2.82Å; F58-M60 PolarHBondContact O-N 3.03Å; F58-Q249 HydrophobicContact CD1-CG 4.42Å; F58-Q249 HydrophobicContact CE1-CG 4.21Å
59	C	37.4	Very low	58.2	Low	122 Å²	122	94.1 Å²	94.1	82%	0.824	52%	0.515	S	S	*	.			trans	-75	82.6	165.4	-75.3	0	0	0	0	108.6	R57 E61	R57-C59 PolarHBondContact O-N 2.84Å; C59-E61 PolarHBondContact O-N 3.5Å
60	M	50.8	Low	61.6	Low	116 Å²	116	88.7 Å²	88.7	57%	0.571	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-59.6	123.1	160	-75.1	-176.2	165.5	0	0	108	F58 Y62 E65	F58-M60 PolarHBondContact O-N 3.03Å; M60-Y62 PolarHBondContact O-N 2.92Å; M60-E65 HydrophobicContact CB-CG 4.41Å
61	E	70	Confident	65	Low	114 Å²	114	79.4 Å²	79.4	53%	0.533	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-64.1	122	178.7	-65.6	-165.8	154.9	0	0	110.1	C59 G63 K64	C59-E61 PolarHBondContact O-N 3.5Å; E61-G63 PolarHBondContact O-N 3.11Å; E61-K64 HydrophobicContact CB-CB 4.16Å; E61-K64 HydrophobicContact CB-CD 4.14Å; E61-K64 HydrophobicContact CB-CG 4.14Å; E61-K64 PolarHBondContact O-N 3.41Å; E61-K64 VanDerWaalsContact OE2-CD 3.25Å; E61-K64 WeakPolarHBondContact OE2-CD 3.25Å; E61-K64 WeakPolarHBondContact OE2-CE 3.21Å; E61-K64 IonicContact OE2-NZ 2.75Å; E61-K64 PolarHBondContact OE2-NZ 3.39Å
62	Y	83.9	Confident	68.2	Low	135 Å²	135	75 Å²	75	53%	0.529	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	120.2	-170.9	179.9	-109.5	0	0	0	111.4	M60 I371 F373	M60-Y62 PolarHBondContact O-N 2.92Å; Y62-I371 HydrophobicContact CD1-CD1 3.71Å; Y62-I371 HydrophobicContact CE1-CD1 3.81Å; Y62-I371 HydrophobicContact CE1-CG2 4.14Å; Y62-F373 HydrophobicContact CD2-CZ 4.27Å; Y62-F373 HydrophobicContact CE1-CZ 4.31Å; Y62-F373 HydrophobicContact CE2-CE1 4.42Å; Y62-F373 HydrophobicContact CE2-CE2 4.27Å; Y62-F373 AromaticContact CE2-CZ 3.57Å; Y62-F373 HydrophobicContact CE2-CZ 3.57Å; Y62-F373 AromaticContact CZ-CE2 3.96Å; Y62-F373 AromaticContact CZ-CZ 3.6Å; Y62-F373 WeakPolarHBondContact OH-CE2 3.32Å
63	G	86.6	Confident	71.6	Confident	3 Å²	3	71.3 Å²	71.3	3%	0.031	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-3	-173.5	0	0	0	0	0	115.8	E61 E65 H284	E61-G63 PolarHBondContact O-N 3.11Å; G63-E65 VanDerWaalsContact C-OE2 3.28Å; G63-E65 VanDerWaalsContact CA-OE2 3.23Å; G63-E65 WeakPolarHBondContact CA-OE2 3.48Å; G63-E65 PolarHBondContact N-OE1 3.39Å; G63-E65 PolarHBondContact N-OE2 2.73Å; G63-H284 WeakPolarHBondContact O-CB 3.34Å
64	K	92.3	Very high	74.9	Confident	19 Å²	19	68.4 Å²	68.4	8%	0.083	34%	0.335	C	S	.	.			trans	-103.4	10.3	174.3	-57.6	-161.4	-168.1	170.9	0	113.9	E61 R66 A252 E253 H284 L306 D307	E61-K64 HydrophobicContact CB-CB 4.16Å; E61-K64 HydrophobicContact CB-CD 4.14Å; E61-K64 HydrophobicContact CB-CG 4.14Å; E61-K64 PolarHBondContact O-N 3.41Å; E61-K64 VanDerWaalsContact OE2-CD 3.25Å; E61-K64 WeakPolarHBondContact OE2-CD 3.25Å; E61-K64 WeakPolarHBondContact OE2-CE 3.21Å; E61-K64 IonicContact OE2-NZ 2.75Å; E61-K64 PolarHBondContact OE2-NZ 3.39Å; K64-R66 PolarHBondContact O-N 3.13Å; K64-A252 HydrophobicContact CB-CB 3.83Å; K64-A252 HydrophobicContact CD-CB 3.38Å; K64-A252 HydrophobicContact CG-CB 4.2Å; K64-E253 IonicContact NZ-OE1 3.56Å; K64-E253 PolarHBondContact NZ-OE1 3.05Å; K64-H284 PolarHBondContact O-ND1 2.98Å; K64-L306 HydrophobicContact CD-CD2 4.39Å; K64-L306 HydrophobicContact CG-CB 4.35Å; K64-L306 HydrophobicContact CG-CD2 3.68Å; K64-D307 IonicContact NZ-OD1 3.87Å; K64-D307 PolarHBondContact NZ-OD1 2.69Å
65	E	91.4	Very high	77.9	Confident	64 Å²	64	59.8 Å²	59.8	30%	0.299	30%	0.297	S	S	.	.	S	Bend	trans	-74.1	-0.7	-166.3	-42.3	87	163.4	0	0	115.3	M60 G63	M60-E65 HydrophobicContact CB-CG 4.41Å; G63-E65 VanDerWaalsContact C-OE2 3.28Å; G63-E65 VanDerWaalsContact CA-OE2 3.23Å; G63-E65 WeakPolarHBondContact CA-OE2 3.48Å; G63-E65 PolarHBondContact N-OE1 3.39Å; G63-E65 PolarHBondContact N-OE2 2.73Å
66	R	95.7	Very high	81.1	Confident	33 Å²	33	54 Å²	54	13%	0.125	27%	0.266	C	S	.	.			trans	-139.7	161.5	-173.1	-61	-175.5	-67.2	163.7	-8.9	111.7	K64 V68 T181 H284 E372 E374	K64-R66 PolarHBondContact O-N 3.13Å; R66-V68 HydrophobicContact CB-CG2 4.21Å; R66-T181 WeakPolarHBondContact CA-OG1 3.39Å; R66-H284 PolarHBondContact NE-O 3.19Å; R66-H284 WeakPolarHBondContact O-CA 3.28Å; R66-H284 PolarHBondContact O-ND1 2.9Å; R66-E372 PolarHBondContact NH2-O 2.91Å; R66-E374 PolarHBondContact NH1-O 2.98Å; R66-E374 PolarHBondContact NH2-O 2.91Å
67	V	98	Very high	84.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.231	C	C	.	.			trans	-120	111.5	161.7	-177.7	0	0	0	0	108.8	L180 T181 V184 Q255 L256 I282	V67-L180 HydrophobicContact CB-CB 4.36Å; V67-L180 HydrophobicContact CG1-CB 4.11Å; V67-L180 HydrophobicContact CG1-CD1 4.44Å; V67-L180 PolarHBondContact O-N 3.1Å; V67-T181 PolarHBondContact N-OG1 2.85Å; V67-T181 PolarHBondContact O-N 3.07Å; V67-V184 HydrophobicContact CB-CG2 4.21Å; V67-V184 HydrophobicContact CG1-CG2 4.17Å; V67-V184 HydrophobicContact CG2-CG1 4.32Å; V67-V184 HydrophobicContact CG2-CG2 4.28Å; V67-Q255 HydrophobicContact CG2-CB 3.82Å; V67-L256 HydrophobicContact CG1-CD2 4.38Å; V67-I282 HydrophobicContact CG1-CG2 3.91Å
68	V	98.5	Very high	87.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.3	-178.4	178.4	0	0	0	0	109.3	R66 Y177 M178 S283 K286 A289 V376	R66-V68 HydrophobicContact CB-CG2 4.21Å; V68-Y177 HydrophobicContact CG1-CD1 4.18Å; V68-M178 WeakPolarHBondContact CA-O 3.45Å; V68-S283 CarbonylContact C-O 3.57Å; V68-S283 WeakPolarHBondContact CA-O 3.4Å; V68-S283 PolarHBondContact N-O 2.57Å; V68-S283 PolarHBondContact O-N 3.04Å; V68-K286 HydrophobicContact CG1-CG 3.88Å; V68-A289 HydrophobicContact CG1-CB 4.21Å; V68-A289 WeakPolarHBondContact O-CB 3.34Å; V68-V376 HydrophobicContact CG1-CG2 4Å; V68-V376 HydrophobicContact CG2-CG2 4.37Å
69	A	98.8	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	152.6	168.1	0	0	0	0	0	111.1	Y177 M178 L180 V263 G281 I282	A69-Y177 CarbonylContact O-C 3.55Å; A69-Y177 VanDerWaalsContact O-CA 3.3Å; A69-Y177 WeakPolarHBondContact O-CA 3.49Å; A69-M178 HydrophobicContact CB-CB 4.29Å; A69-M178 PolarHBondContact N-O 2.9Å; A69-M178 PolarHBondContact O-N 3.42Å; A69-L180 HydrophobicContact CB-CD1 3.79Å; A69-L180 HydrophobicContact CB-CG 4.26Å; A69-V263 HydrophobicContact CB-CG2 3.86Å; A69-G281 CarbonylContact C-O 3.56Å; A69-G281 VanDerWaalsContact CA-O 3.27Å; A69-G281 WeakPolarHBondContact CA-O 3.44Å; A69-I282 HydrophobicContact CB-CG1 4.5Å
70	L	98.8	Very high	92.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.3	155.1	177.7	141.3	0	0	0	109	D72 E175 A176 Y177 A280 G281 A289 K290 C293	L70-D72 HydrophobicContact CD2-CB 3.79Å; L70-E175 HydrophobicContact CD1-CG 4.28Å; L70-A176 WeakPolarHBondContact CA-O 3.34Å; L70-Y177 HydrophobicContact CB-CD1 3.78Å; L70-Y177 HydrophobicContact CB-CE1 3.8Å; L70-Y177 HydrophobicContact CD1-CD1 3.8Å; L70-Y177 HydrophobicContact CD1-CD2 4.14Å; L70-Y177 HydrophobicContact CD1-CE1 3.36Å; L70-Y177 HydrophobicContact CD1-CE2 3.76Å; L70-Y177 HydrophobicContact CD1-CG 4.17Å; L70-Y177 HydrophobicContact CG-CD1 4.29Å; L70-Y177 HydrophobicContact CG-CE1 4.18Å; L70-A280 CarbonylContact O-C 3.57Å; L70-A280 WeakPolarHBondContact O-CA 3.24Å; L70-A280 WeakPolarHBondContact O-CB 3.15Å; L70-G281 PolarHBondContact N-O 2.74Å; L70-G281 PolarHBondContact O-N 3.01Å; L70-A289 HydrophobicContact CB-CB 4.24Å; L70-K290 HydrophobicContact CD1-CB 4.11Å; L70-K290 HydrophobicContact CD1-CD 3.5Å; L70-K290 VanDerWaalsContact CD1-CD 3.5Å; L70-K290 HydrophobicContact CD1-CG 4.35Å; L70-K290 HydrophobicContact CD2-CD 3.75Å; L70-K290 HydrophobicContact CG-CD 4.27Å; L70-C293 HydrophobicContact CD2-CB 3.7Å; L70-C293 VanDerWaalsContact CD2-SG 3.51Å
71	V	98.7	Very high	95	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.9	175.5	-173.5	0	0	0	0	108	M162 E175 A176 M178 M266 C278 A280	V71-M162 HydrophobicContact CB-CE 3.63Å; V71-M162 HydrophobicContact CB-SD 4.26Å; V71-M162 HydrophobicContact CG1-CE 4.37Å; V71-M162 HydrophobicContact CG1-SD 4.45Å; V71-M162 HydrophobicContact CG2-CE 3.68Å; V71-E175 WeakPolarHBondContact O-CA 3.25Å; V71-A176 PolarHBondContact N-O 2.76Å; V71-A176 PolarHBondContact O-N 3.04Å; V71-M178 HydrophobicContact CG2-SD 3.9Å; V71-M266 HydrophobicContact CB-CE 4.43Å; V71-M266 HydrophobicContact CG1-CE 3.89Å; V71-M266 HydrophobicContact CG2-CE 3.72Å; V71-M266 HydrophobicContact CG2-SD 3.89Å; V71-C278 HydrophobicContact CG1-CB 4.18Å; V71-A280 HydrophobicContact CG2-CB 4.16Å
72	D	98.8	Very high	96.3	Very high	23 Å²	23	19.4 Å²	19.4	12%	0.123	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	115.8	-171.9	173.7	-19.7	0	0	0	110	L70 D174 E175 S279 K290 K297	L70-D72 HydrophobicContact CD2-CB 3.79Å; D72-D174 WeakPolarHBondContact CA-O 3.31Å; D72-E175 HydrophobicContact CB-CB 4Å; D72-S279 PolarHBondContact N-O 2.86Å; D72-S279 PolarHBondContact O-N 3.27Å; D72-S279 VanDerWaalsContact O-N 3.13Å; D72-K290 IonicContact OD2-NZ 3.25Å; D72-K290 PolarHBondContact OD2-NZ 2.97Å; D72-K297 PolarHBondContact O-NZ 3.37Å; D72-K297 IonicContact OD1-NZ 3.47Å; D72-K297 PolarHBondContact OD1-NZ 3.48Å; D72-K297 IonicContact OD2-NZ 3.05Å; D72-K297 PolarHBondContact OD2-NZ 3.16Å
73	M	98.6	Very high	96.9	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.02	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.4	-169.8	-58.9	-50.3	-64.6	0	0	112.8	C75 F76 V158 D174 V270 F276 C278	M73-C75 PolarHBondContact O-N 3.44Å; M73-F76 HydrophobicContact CB-CB 3.82Å; M73-F76 HydrophobicContact CB-CD2 3.56Å; M73-F76 HydrophobicContact CB-CE2 4.41Å; M73-F76 HydrophobicContact CB-CG 3.88Å; M73-F76 HydrophobicContact CG-CD2 3.9Å; M73-F76 HydrophobicContact CG-CE2 4.27Å; M73-F76 HydrophobicContact CG-CG 4.44Å; M73-F76 PolarHBondContact O-N 2.77Å; M73-V158 HydrophobicContact CE-CG1 4.46Å; M73-V158 HydrophobicContact CE-CG2 3.88Å; M73-V158 HydrophobicContact CG-CG1 4.29Å; M73-V158 HydrophobicContact CG-CG2 4.41Å; M73-V158 HydrophobicContact SD-CB 4.46Å; M73-V158 HydrophobicContact SD-CG1 3.59Å; M73-V158 VanDerWaalsContact SD-CG1 3.59Å; M73-V158 HydrophobicContact SD-CG2 4.01Å; M73-D174 HydrophobicContact CB-CB 4.2Å; M73-D174 WeakPolarHBondContact CG-O 3.36Å; M73-D174 PolarHBondContact N-O 3Å; M73-V270 HydrophobicContact CE-CG1 3.75Å; M73-V270 HydrophobicContact SD-CG1 4.22Å; M73-F276 HydrophobicContact CE-CB 3.31Å; M73-F276 HydrophobicContact CE-CD2 4.37Å; M73-F276 HydrophobicContact CE-CG 4.27Å; M73-C278 HydrophobicContact CE-CB 3.78Å; M73-C278 HydrophobicContact SD-CB 3.46Å; M73-C278 WeakPolarHBondContact SD-CB 3.17Å
74	D	98	Very high	97.3	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.027	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	122.7	-171.4	-91.5	-59.5	0	0	0	112.3	F76 Q79 Y111 R277 C278 S279 K297 N299	D74-F76 PolarHBondContact O-N 2.71Å; D74-Q79 PolarHBondContact O-NE2 3.12Å; D74-Y111 HydrophobicContact CB-CE2 4.03Å; D74-Y111 WeakPolarHBondContact OD1-CE2 3.42Å; D74-Y111 VanDerWaalsContact OD1-CZ 3.22Å; D74-Y111 PolarHBondContact OD1-OH 2.76Å; D74-R277 PolarHBondContact N-O 2.66Å; D74-C278 VanDerWaalsContact OD2-C 3.24Å; D74-C278 WeakPolarHBondContact OD2-CA 3.48Å; D74-S279 PolarHBondContact OD2-N 3.2Å; D74-S279 VanDerWaalsContact OD2-N 3.15Å; D74-S279 PolarHBondContact OD2-OG 2.94Å; D74-K297 WeakPolarHBondContact OD1-CD 3.25Å; D74-N299 PolarHBondContact OD2-N 2.89Å
75	C	96.8	Very high	97.5	Very high	21 Å²	21	25.3 Å²	25.3	14%	0.142	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.6	25.1	-175.1	69.6	0	0	0	0	115.6	M73 Y77 V78 V109 Y111	M73-C75 PolarHBondContact O-N 3.44Å; C75-Y77 PolarHBondContact O-N 3.15Å; C75-V78 HydrophobicContact CB-CB 4.32Å; C75-V78 PolarHBondContact O-N 3.34Å; C75-V109 WeakPolarHBondContact CB-O 3.48Å; C75-Y111 HydrophobicContact CB-CD2 4.3Å; C75-Y111 HydrophobicContact CB-CE2 3.98Å
76	F	98.5	Very high	97.6	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.013	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-20.7	-62.5	-153.9	-175	-134.8	0	0	0	118	M73 D74 V78 Q79 V80 A154 I173 D174 F276	M73-F76 HydrophobicContact CB-CB 3.82Å; M73-F76 HydrophobicContact CB-CD2 3.56Å; M73-F76 HydrophobicContact CB-CE2 4.41Å; M73-F76 HydrophobicContact CB-CG 3.88Å; M73-F76 HydrophobicContact CG-CD2 3.9Å; M73-F76 HydrophobicContact CG-CE2 4.27Å; M73-F76 HydrophobicContact CG-CG 4.44Å; M73-F76 PolarHBondContact O-N 2.77Å; D74-F76 PolarHBondContact O-N 2.71Å; F76-V78 PolarHBondContact O-N 2.82Å; F76-Q79 PolarHBondContact O-N 2.92Å; F76-V80 HydrophobicContact CD2-CG2 4.08Å; F76-V80 HydrophobicContact CE1-CG2 4.44Å; F76-V80 HydrophobicContact CE2-CG2 3.68Å; F76-V80 HydrophobicContact CZ-CG2 3.88Å; F76-V80 PolarHBondContact O-N 3.13Å; F76-V80 VanDerWaalsContact O-N 3.08Å; F76-A154 HydrophobicContact CE2-CB 4.28Å; F76-A154 HydrophobicContact CZ-CB 3.82Å; F76-I173 HydrophobicContact CD1-CG2 4.42Å; F76-I173 HydrophobicContact CE1-CG1 4.29Å; F76-D174 HydrophobicContact CB-CB 3.7Å; F76-D174 HydrophobicContact CD1-CB 3.74Å; F76-D174 HydrophobicContact CG-CB 3.85Å; F76-F276 HydrophobicContact CE2-CD2 4.26Å; F76-F276 HydrophobicContact CE2-CE2 4.22Å
77	Y	98.5	Very high	97.6	Very high	31 Å²	31	28.6 Å²	28.6	12%	0.122	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-32.2	-174.8	-73.3	20.8	0	0	0	112.3	C75 V80 E81 V95 I107 L148 Y151 I173	C75-Y77 PolarHBondContact O-N 3.15Å; Y77-V80 PolarHBondContact O-N 3.37Å; Y77-E81 WeakPolarHBondContact O-CG 3.35Å; Y77-E81 PolarHBondContact O-N 3.01Å; Y77-E81 VanDerWaalsContact O-N 3.09Å; Y77-V95 HydrophobicContact CD2-CG1 4.46Å; Y77-I107 HydrophobicContact CD2-CD1 3.49Å; Y77-I107 VanDerWaalsContact CD2-CD1 3.49Å; Y77-I107 HydrophobicContact CD2-CG1 4.37Å; Y77-I107 HydrophobicContact CE2-CD1 3.59Å; Y77-L148 HydrophobicContact CE2-CD2 3.98Å; Y77-Y151 AromaticContact CD1-CD1 3.75Å; Y77-Y151 HydrophobicContact CD1-CD1 3.75Å; Y77-Y151 HydrophobicContact CD1-CD2 4.44Å; Y77-Y151 HydrophobicContact CD1-CE1 4.44Å; Y77-Y151 AromaticContact CD1-CG 3.77Å; Y77-Y151 HydrophobicContact CD1-CG 3.77Å; Y77-Y151 AromaticContact CD2-CD1 3.84Å; Y77-Y151 HydrophobicContact CD2-CD1 3.84Å; Y77-Y151 AromaticContact CD2-CD2 3.69Å; Y77-Y151 HydrophobicContact CD2-CD2 3.69Å; Y77-Y151 AromaticContact CD2-CE1 3.84Å; Y77-Y151 HydrophobicContact CD2-CE1 3.84Å; Y77-Y151 AromaticContact CD2-CE2 3.67Å; Y77-Y151 HydrophobicContact CD2-CE2 3.67Å; Y77-Y151 AromaticContact CD2-CG 3.79Å; Y77-Y151 HydrophobicContact CD2-CG 3.79Å; Y77-Y151 AromaticContact CD2-CZ 3.77Å; Y77-Y151 HydrophobicContact CE1-CD1 4.25Å; Y77-Y151 HydrophobicContact CE1-CD2 4.25Å; Y77-Y151 AromaticContact CE1-CG 3.78Å; Y77-Y151 HydrophobicContact CE1-CG 3.78Å; Y77-Y151 HydrophobicContact CE2-CD1 4.33Å; Y77-Y151 AromaticContact CE2-CD2 3.46Å; Y77-Y151 HydrophobicContact CE2-CD2 3.46Å; Y77-Y151 VanDerWaalsContact CE2-CD2 3.46Å; Y77-Y151 AromaticContact CE2-CE2 3.75Å; Y77-Y151 HydrophobicContact CE2-CE2 3.75Å; Y77-Y151 AromaticContact CE2-CG 3.8Å; Y77-Y151 HydrophobicContact CE2-CG 3.8Å; Y77-Y151 AromaticContact CG-CD1 3.53Å; Y77-Y151 HydrophobicContact CG-CD1 3.53Å; Y77-Y151 HydrophobicContact CG-CD2 4.2Å; Y77-Y151 AromaticContact CG-CE1 3.76Å; Y77-Y151 HydrophobicContact CG-CE1 3.76Å; Y77-Y151 HydrophobicContact CG-CE2 4.37Å; Y77-Y151 AromaticContact CG-CG 3.79Å; Y77-Y151 HydrophobicContact CG-CG 3.79Å; Y77-Y151 AromaticContact CZ-CD2 3.76Å; Y77-Y151 AromaticContact CZ-CG 3.79Å; Y77-I173 HydrophobicContact CE1-CD1 4.09Å; Y77-I173 HydrophobicContact CE1-CG2 3.86Å
78	V	98.4	Very high	97.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-45.4	175	176	0	0	0	0	110.5	C75 F76 V80 E81 Q82 C93 V95 A108	C75-V78 HydrophobicContact CB-CB 4.32Å; C75-V78 PolarHBondContact O-N 3.34Å; F76-V78 PolarHBondContact O-N 2.82Å; V78-V80 VanDerWaalsContact C-N 3.29Å; V78-V80 PolarHBondContact O-N 3.2Å; V78-E81 CarbonylContact O-C 3.53Å; V78-E81 PolarHBondContact O-N 3.35Å; V78-E81 VanDerWaalsContact O-N 3.11Å; V78-Q82 HydrophobicContact CG1-CG 4.07Å; V78-Q82 WeakPolarHBondContact O-CB 3.4Å; V78-Q82 VanDerWaalsContact O-CG 3.3Å; V78-Q82 WeakPolarHBondContact O-CG 3.07Å; V78-Q82 PolarHBondContact O-N 2.65Å; V78-C93 HydrophobicContact CG1-CB 4.06Å; V78-V95 HydrophobicContact CB-CG2 4.38Å; V78-V95 HydrophobicContact CG2-CG2 3.8Å; V78-A108 HydrophobicContact CG2-CB 4Å
79	Q	98.3	Very high	97.1	Very high	19 Å²	19	35.1 Å²	35.1	9%	0.089	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-35.7	175.6	-75.2	-164.9	91.3	0	0	112.7	D74 F76 Q82 R83 F276 R277	D74-Q79 PolarHBondContact O-NE2 3.12Å; F76-Q79 PolarHBondContact O-N 2.92Å; Q79-Q82 PolarHBondContact O-N 2.99Å; Q79-R83 WeakPolarHBondContact O-CB 3.44Å; Q79-R83 PolarHBondContact O-N 2.98Å; Q79-F276 HydrophobicContact CB-CD1 3.88Å; Q79-F276 HydrophobicContact CB-CE1 4.4Å; Q79-R277 PolarHBondContact NE2-O 2.92Å
80	V	98.3	Very high	96.8	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-44.2	173.1	-179.7	0	0	0	0	111	F76 Y77 V78 R83 L84 Y151 A154 F276	F76-V80 HydrophobicContact CD2-CG2 4.08Å; F76-V80 HydrophobicContact CE1-CG2 4.44Å; F76-V80 HydrophobicContact CE2-CG2 3.68Å; F76-V80 HydrophobicContact CZ-CG2 3.88Å; F76-V80 PolarHBondContact O-N 3.13Å; F76-V80 VanDerWaalsContact O-N 3.08Å; Y77-V80 PolarHBondContact O-N 3.37Å; V78-V80 VanDerWaalsContact C-N 3.29Å; V78-V80 PolarHBondContact O-N 3.2Å; V80-R83 PolarHBondContact O-N 3Å; V80-L84 HydrophobicContact CG1-CD1 4.36Å; V80-L84 WeakPolarHBondContact O-CG 3.26Å; V80-L84 PolarHBondContact O-N 3.09Å; V80-Y151 HydrophobicContact CB-CD1 3.9Å; V80-Y151 HydrophobicContact CB-CE1 4.23Å; V80-Y151 HydrophobicContact CG1-CD1 3.84Å; V80-Y151 HydrophobicContact CG1-CE1 4.2Å; V80-Y151 HydrophobicContact CG2-CD1 4.18Å; V80-A154 HydrophobicContact CG1-CB 4.24Å; V80-A154 HydrophobicContact CG2-CB 3.72Å; V80-F276 HydrophobicContact CB-CE1 4.5Å; V80-F276 HydrophobicContact CB-CZ 4.42Å; V80-F276 HydrophobicContact CG2-CE1 4.1Å; V80-F276 HydrophobicContact CG2-CE2 4.44Å; V80-F276 HydrophobicContact CG2-CZ 3.78Å
81	E	98.1	Very high	96.6	Very high	24 Å²	24	39.6 Å²	39.6	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-70.7	-35.5	176.6	-58.5	-68.4	152.8	0	0	112.5	Y77 V78 R83 L84 N85 L88 V95 A137 H150 Y151	Y77-E81 WeakPolarHBondContact O-CG 3.35Å; Y77-E81 PolarHBondContact O-N 3.01Å; Y77-E81 VanDerWaalsContact O-N 3.09Å; V78-E81 CarbonylContact O-C 3.53Å; V78-E81 PolarHBondContact O-N 3.35Å; V78-E81 VanDerWaalsContact O-N 3.11Å; E81-R83 VanDerWaalsContact C-N 3.31Å; E81-R83 PolarHBondContact O-N 3.32Å; E81-L84 PolarHBondContact O-N 3.22Å; E81-N85 PolarHBondContact O-N 2.84Å; E81-L88 HydrophobicContact CB-CD1 4.17Å; E81-V95 HydrophobicContact CG-CG2 3.75Å; E81-A137 HydrophobicContact CB-CB 3.65Å; E81-A137 HydrophobicContact CG-CB 3.53Å; E81-H150 IonicContact OE1-CD2 2.78Å; E81-H150 IonicContact OE1-CE1 3.71Å; E81-H150 IonicContact OE1-NE2 3.91Å; E81-H150 PolarHBondContact OE1-NE2 3.02Å; E81-Y151 HydrophobicContact CG-CE1 4.31Å; E81-Y151 VanDerWaalsContact OE1-CE1 3.22Å; E81-Y151 WeakPolarHBondContact OE1-CE1 3.44Å; E81-Y151 VanDerWaalsContact OE1-CZ 3.23Å; E81-Y151 PolarHBondContact OE1-OH 2.83Å
82	Q	97.1	Very high	96.5	Very high	19 Å²	19	40.8 Å²	40.8	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-68	-28	174.3	-72	174.3	-42.5	0	0	113.1	V78 Q79 N85 L88 K89	V78-Q82 HydrophobicContact CG1-CG 4.07Å; V78-Q82 WeakPolarHBondContact O-CB 3.4Å; V78-Q82 VanDerWaalsContact O-CG 3.3Å; V78-Q82 WeakPolarHBondContact O-CG 3.07Å; V78-Q82 PolarHBondContact O-N 2.65Å; Q79-Q82 PolarHBondContact O-N 2.99Å; Q82-N85 CarbonylContact O-C 3.24Å; Q82-L88 HydrophobicContact CG-CB 3.78Å; Q82-L88 WeakPolarHBondContact CG-O 3.36Å; Q82-L88 PolarHBondContact NE2-O 3.49Å; Q82-K89 HydrophobicContact CB-CG 4.07Å
83	R	96.3	Very high	96.5	Very high	94 Å²	94	39.7 Å²	39.7	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-73.8	-35	170.8	-169.9	176.9	78.7	169.3	6.3	111.9	Q79 V80 E81 E157 T274 F276	Q79-R83 WeakPolarHBondContact O-CB 3.44Å; Q79-R83 PolarHBondContact O-N 2.98Å; V80-R83 PolarHBondContact O-N 3Å; E81-R83 VanDerWaalsContact C-N 3.31Å; E81-R83 PolarHBondContact O-N 3.32Å; R83-E157 IonicContact CZ-OE1 3.43Å; R83-E157 IonicContact CZ-OE2 3.38Å; R83-E157 IonicContact NH1-OE1 3.6Å; R83-E157 IonicContact NH1-OE2 3.26Å; R83-E157 PolarHBondContact NH1-OE2 3.07Å; R83-E157 IonicContact NH2-OE1 2.76Å; R83-E157 PolarHBondContact NH2-OE1 3.05Å; R83-E157 IonicContact NH2-OE2 3.22Å; R83-E157 PolarHBondContact NH2-OE2 2.79Å; R83-T274 WeakPolarHBondContact CD-O 3.21Å; R83-T274 PolarHBondContact NH1-O 2.91Å; R83-F276 HydrophobicContact CB-CE1 3.92Å; R83-F276 HydrophobicContact CG-CE1 4.39Å; R83-F276 VanDerWaalsContact NH1-CZ 3.35Å
84	L	95	Very high	96.5	Very high	111 Å²	111	39.5 Å²	39.5	58%	0.581	21%	0.214	S	C	*	.	H	α-helix	trans	-78.6	-32.7	177.5	-68.8	170.2	0	0	0	112.9	V80 E81	V80-L84 HydrophobicContact CG1-CD1 4.36Å; V80-L84 WeakPolarHBondContact O-CG 3.26Å; V80-L84 PolarHBondContact O-N 3.09Å; E81-L84 PolarHBondContact O-N 3.22Å
85	N	96	Very high	96.5	Very high	77 Å²	77	39.3 Å²	39.3	41%	0.412	21%	0.212	S	C	.	.			trans	-132.3	97.3	175.9	-180	9.6	0	0	0	110.2	E81 Q82 A87 L88	E81-N85 PolarHBondContact O-N 2.84Å; Q82-N85 CarbonylContact O-C 3.24Å; N85-A87 PolarHBondContact O-N 2.71Å; N85-A87 VanDerWaalsContact O-N 3.08Å; N85-A87 WeakPolarHBondContact OD1-CB 3.41Å; N85-A87 PolarHBondContact OD1-N 2.73Å; N85-L88 HydrophobicContact CB-CD1 4.06Å; N85-L88 HydrophobicContact CB-CG 4.19Å; N85-L88 WeakPolarHBondContact O-CB 3.37Å; N85-L88 PolarHBondContact O-N 3.39Å
86	P	94	Very high	96.6	Very high	88 Å²	88	38.3 Å²	38.3	57%	0.571	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-56.1	-25.5	-179.5	-28.9	36.7	0	0	0	114.9	L88 K89	P86-L88 PolarHBondContact O-N 3.42Å; P86-K89 WeakPolarHBondContact O-CB 3.27Å; P86-K89 PolarHBondContact O-N 3.12Å
87	A	95.4	Very high	96.5	Very high	78 Å²	78	40.5 Å²	40.5	65%	0.645	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-68.4	-2.5	177.2	0	0	0	0	0	114.2	N85	N85-A87 PolarHBondContact O-N 2.71Å; N85-A87 VanDerWaalsContact O-N 3.08Å; N85-A87 WeakPolarHBondContact OD1-CB 3.41Å; N85-A87 PolarHBondContact OD1-N 2.73Å
88	L	94.9	Very high	96.4	Very high	14 Å²	14	42.2 Å²	42.2	7%	0.073	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-95.8	-11.4	171.3	-59.2	177.7	0	0	0	113.1	E81 Q82 N85 P86 T91 Q135 A137	E81-L88 HydrophobicContact CB-CD1 4.17Å; Q82-L88 HydrophobicContact CG-CB 3.78Å; Q82-L88 WeakPolarHBondContact CG-O 3.36Å; Q82-L88 PolarHBondContact NE2-O 3.49Å; N85-L88 HydrophobicContact CB-CD1 4.06Å; N85-L88 HydrophobicContact CB-CG 4.19Å; N85-L88 WeakPolarHBondContact O-CB 3.37Å; N85-L88 PolarHBondContact O-N 3.39Å; P86-L88 PolarHBondContact O-N 3.42Å; L88-T91 PolarHBondContact O-OG1 3.41Å; L88-Q135 HydrophobicContact CD2-CB 3.71Å; L88-Q135 HydrophobicContact CD2-CG 4.21Å; L88-A137 HydrophobicContact CD1-CB 4.1Å
89	K	92.6	Very high	96.2	Very high	122 Å²	122	49.4 Å²	49.4	53%	0.53	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	140.1	178.1	-73	-174.9	170.9	-167.2	0	110.3	Q82 P86 T91	Q82-K89 HydrophobicContact CB-CG 4.07Å; P86-K89 WeakPolarHBondContact O-CB 3.27Å; P86-K89 PolarHBondContact O-N 3.12Å; K89-T91 PolarHBondContact O-N 2.92Å
90	N	91.6	Very high	95.9	Very high	58 Å²	58	55.5 Å²	55.5	31%	0.31	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	24.1	174.1	-56	17.3	0	0	0	114	E112 E674 D675	N90-E112 WeakPolarHBondContact CA-OE1 3.45Å; N90-E674 VanDerWaalsContact ND2-C 3.25Å; N90-E674 PolarHBondContact ND2-O 3.01Å; N90-D675 PolarHBondContact ND2-OD1 3.07Å
91	T	94.9	Very high	95.7	Very high	36 Å²	36	63.7 Å²	63.7	22%	0.221	32%	0.323	C	S	.	.	S	Bend	trans	-113.7	152.8	173.5	64.7	0	0	0	0	110.1	L88 K89 C93 S110	L88-T91 PolarHBondContact O-OG1 3.41Å; K89-T91 PolarHBondContact O-N 2.92Å; T91-C93 PolarHBondContact O-N 2.94Å; T91-S110 PolarHBondContact O-OG 2.9Å
92	P	97.2	Very high	95.5	Very high	27 Å²	27	66.5 Å²	66.5	18%	0.175	34%	0.335	C	S	.	.			trans	-61.4	105	169.1	26.2	-34	0	0	0	109.6	E112 A113 L134 Q135	P92-E112 HydrophobicContact CB-CB 4.46Å; P92-A113 HydrophobicContact CB-CB 4.05Å; P92-L134 HydrophobicContact CB-CD1 4.34Å; P92-L134 WeakPolarHBondContact O-CA 3.16Å; P92-Q135 PolarHBondContact O-N 3.28Å
93	C	97.4	Very high	95.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.8	-170.5	-174.4	0	0	0	0	112.5	V78 T91 S110 Q135	V78-C93 HydrophobicContact CG1-CB 4.06Å; T91-C93 PolarHBondContact O-N 2.94Å; C93-S110 PolarHBondContact N-OG 3.38Å; C93-S110 VanDerWaalsContact N-OG 3.14Å; C93-S110 VanDerWaalsContact O-CB 3.26Å; C93-S110 WeakPolarHBondContact O-CB 3.47Å; C93-S110 PolarHBondContact O-N 3.45Å; C93-Q135 WeakPolarHBondContact CA-O 3.4Å; C93-Q135 HydrophobicContact CB-CB 4.3Å
94	V	98.4	Very high	95.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.7	173.9	-75.7	0	0	0	0	111.9	I106 A108 V109 A113 V118 L134 Q135 V136 A137	V94-I106 HydrophobicContact CB-CD1 4.42Å; V94-I106 HydrophobicContact CB-CG1 4.25Å; V94-I106 HydrophobicContact CB-CG2 4.01Å; V94-I106 HydrophobicContact CG1-CD1 4.18Å; V94-I106 HydrophobicContact CG1-CG1 4.41Å; V94-I106 HydrophobicContact CG1-CG2 3.8Å; V94-I106 HydrophobicContact CG2-CD1 4.25Å; V94-I106 HydrophobicContact CG2-CG1 4.25Å; V94-A108 WeakPolarHBondContact CA-O 3.43Å; V94-V109 HydrophobicContact CG1-CB 4.17Å; V94-V109 HydrophobicContact CG1-CG1 3.81Å; V94-V109 HydrophobicContact CG1-CG2 4.08Å; V94-A113 HydrophobicContact CG1-CB 4.5Å; V94-V118 HydrophobicContact CG1-CG1 3.92Å; V94-L134 HydrophobicContact CG1-CD1 4.06Å; V94-L134 HydrophobicContact CG2-CD1 4.07Å; V94-L134 HydrophobicContact CG2-CD2 3.89Å; V94-L134 HydrophobicContact CG2-CG 3.9Å; V94-Q135 WeakPolarHBondContact CG2-O 3.5Å; V94-Q135 PolarHBondContact N-O 3.16Å; V94-V136 HydrophobicContact CG2-CB 4.29Å; V94-V136 HydrophobicContact CG2-CG1 4.09Å; V94-V136 HydrophobicContact CG2-CG2 3.91Å; V94-V136 WeakPolarHBondContact O-CA 3.45Å; V94-A137 PolarHBondContact O-N 3.25Å
95	V	98.5	Very high	95.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.8	166.1	-173.7	0	0	0	0	109	Y77 V78 E81 I107 A108 A137 V139 Y151	Y77-V95 HydrophobicContact CD2-CG1 4.46Å; V78-V95 HydrophobicContact CB-CG2 4.38Å; V78-V95 HydrophobicContact CG2-CG2 3.8Å; E81-V95 HydrophobicContact CG-CG2 3.75Å; V95-I107 HydrophobicContact CB-CG1 4.22Å; V95-I107 HydrophobicContact CG1-CD1 4.11Å; V95-I107 HydrophobicContact CG1-CG1 4.07Å; V95-I107 VanDerWaalsContact O-CG1 3.25Å; V95-I107 WeakPolarHBondContact O-CG1 3.48Å; V95-I107 PolarHBondContact O-N 2.85Å; V95-A108 HydrophobicContact CB-CB 4.26Å; V95-A108 HydrophobicContact CG2-CB 4.39Å; V95-A108 PolarHBondContact N-O 2.96Å; V95-A108 PolarHBondContact O-N 3.44Å; V95-A137 HydrophobicContact CG2-CB 4.37Å; V95-V139 HydrophobicContact CG1-CG2 3.6Å; V95-Y151 WeakPolarHBondContact CG1-OH 3.42Å
96	A	98.1	Very high	95.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.2	-178.4	0	0	0	0	0	113.3	G105 I106 V124 V136 A137 V139	A96-G105 CarbonylContact C-O 3.5Å; A96-G105 VanDerWaalsContact CA-O 3.3Å; A96-G105 WeakPolarHBondContact CA-O 3.27Å; A96-I106 HydrophobicContact CB-CG1 4.46Å; A96-V124 HydrophobicContact CB-CG2 3.56Å; A96-V136 HydrophobicContact CB-CG1 3.91Å; A96-A137 PolarHBondContact N-O 3.15Å; A96-V139 PolarHBondContact O-N 2.62Å
97	Q	96.8	Very high	95.8	Very high	50 Å²	50	51.4 Å²	51.4	23%	0.234	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.1	172.2	-72.2	-174.6	9.1	0	0	111.5	G104 G105 I107 V139 A146	Q97-G104 WeakPolarHBondContact O-CA 3.45Å; Q97-G105 PolarHBondContact N-O 2.84Å; Q97-G105 PolarHBondContact O-N 3.02Å; Q97-I107 HydrophobicContact CG-CD1 4.03Å; Q97-I107 HydrophobicContact CG-CG2 4.11Å; Q97-V139 HydrophobicContact CG-CB 3.93Å; Q97-V139 HydrophobicContact CG-CG1 4.18Å; Q97-V139 HydrophobicContact CG-CG2 3.62Å; Q97-A146 HydrophobicContact CB-CB 4.5Å; Q97-A146 HydrophobicContact CG-CB 4.03Å
98	Y	96	Very high	95.9	Very high	67 Å²	67	48.3 Å²	48.3	26%	0.263	24%	0.24	S	C	.	.			trans	58.7	177.5	-176.6	-49.4	-76	0	0	0	112.8	G104 R138 E141 A146	Y98-G104 WeakPolarHBondContact O-CA 3.35Å; Y98-R138 PolarHBondContact O-NH1 3.08Å; Y98-E141 WeakPolarHBondContact CA-OE1 3.36Å; Y98-E141 VanDerWaalsContact CD1-CD 3.5Å; Y98-E141 WeakPolarHBondContact CD1-OE1 3.47Å; Y98-E141 VanDerWaalsContact CD1-OE2 3.24Å; Y98-E141 WeakPolarHBondContact CD1-OE2 3.23Å; Y98-E141 WeakPolarHBondContact CE1-OE2 3.33Å; Y98-A146 HydrophobicContact CE2-CB 4.27Å; Y98-A146 PolarHBondContact OH-N 2.94Å; Y98-A146 VanDerWaalsContact OH-N 3.14Å
99	K	94.7	Very high	96.1	Very high	151 Å²	151	48 Å²	48	66%	0.657	24%	0.239	S	C	*	.	S	Bend	trans	-136.8	-28.9	178.1	-173.7	177.2	176.7	-179.2	0	114.3	W101 G103	K99-W101 VanDerWaalsContact C-N 3.34Å; K99-W101 PolarHBondContact O-N 2.86Å; K99-G103 CarbonylContact O-C 3.48Å; K99-G103 VanDerWaalsContact O-CA 3.31Å; K99-G103 WeakPolarHBondContact O-CA 3.48Å; K99-G103 PolarHBondContact O-N 3.25Å
100	T	92.4	Very high	96.4	Very high	147 Å²	147	42.2 Å²	42.2	90%	0.902	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-19.3	-166.4	49.9	0	0	0	0	115.8
101	W	93.6	Very high	96.6	Very high	175 Å²	175	41 Å²	41	66%	0.663	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.8	117.2	177.7	-178.2	-92.5	0	0	0	110.5	K99 G103 G104 W123	K99-W101 VanDerWaalsContact C-N 3.34Å; K99-W101 PolarHBondContact O-N 2.86Å; W101-G103 PolarHBondContact O-N 2.71Å; W101-G103 VanDerWaalsContact O-N 3.16Å; W101-G104 PolarHBondContact O-N 3.36Å; W101-W123 AromaticContact CD1-CE3 3.98Å; W101-W123 AromaticContact CD1-CH2 3.64Å; W101-W123 AromaticContact CD1-CZ3 3.57Å; W101-W123 AromaticContact NE1-CH2 3.94Å; W101-W123 AromaticContact NE1-CZ2 3.98Å
102	K	95.3	Very high	96.7	Very high	83 Å²	83	40.1 Å²	40.1	36%	0.361	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	41.2	-175.8	-66.5	-168.5	141.2	-153.2	0	114.3	G104 W123 V124 D125 D126	K102-G104 PolarHBondContact O-N 3.28Å; K102-G104 VanDerWaalsContact O-N 3.14Å; K102-W123 HydrophobicContact CB-CB 3.6Å; K102-W123 HydrophobicContact CB-CD2 3.86Å; K102-W123 HydrophobicContact CB-CE3 4Å; K102-W123 HydrophobicContact CB-CG 3.68Å; K102-W123 HydrophobicContact CD-CB 4.02Å; K102-W123 VanDerWaalsContact CD-CD1 3.48Å; K102-W123 HydrophobicContact CD-CD2 3.97Å; K102-W123 HydrophobicContact CD-CG 3.52Å; K102-W123 HydrophobicContact CG-CB 4.49Å; K102-W123 HydrophobicContact CG-CD2 4.44Å; K102-W123 HydrophobicContact CG-CG 4.25Å; K102-V124 PolarHBondContact O-N 3.43Å; K102-D125 WeakPolarHBondContact CA-OD2 3.44Å; K102-D125 HydrophobicContact CB-CB 4.5Å; K102-D125 PolarHBondContact O-N 3.47Å; K102-D126 IonicContact NZ-OD1 2.68Å; K102-D126 IonicContact NZ-OD2 2.68Å; K102-D126 PolarHBondContact NZ-OD2 3.04Å
103	G	93.8	Very high	96.7	Very high	10 Å²	10	38.9 Å²	38.9	10%	0.103	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	4.3	-179	0	0	0	0	0	115.3	K99 W101 V124 D125 R138	K99-G103 CarbonylContact O-C 3.48Å; K99-G103 VanDerWaalsContact O-CA 3.31Å; K99-G103 WeakPolarHBondContact O-CA 3.48Å; K99-G103 PolarHBondContact O-N 3.25Å; W101-G103 PolarHBondContact O-N 2.71Å; W101-G103 VanDerWaalsContact O-N 3.16Å; G103-V124 WeakPolarHBondContact O-CB 3.5Å; G103-V124 WeakPolarHBondContact O-CG2 3.49Å; G103-D125 VanDerWaalsContact CA-OD1 3.24Å; G103-D125 WeakPolarHBondContact CA-OD1 3.45Å; G103-D125 PolarHBondContact N-OD1 2.97Å; G103-D125 PolarHBondContact N-OD2 2.96Å; G103-D125 VanDerWaalsContact N-OD2 3.09Å; G103-R138 VanDerWaalsContact O-CZ 3.25Å; G103-R138 PolarHBondContact O-NH1 3.31Å; G103-R138 PolarHBondContact O-NH2 3.3Å
104	G	96.1	Very high	96.6	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.021	21%	0.207	C	C	.	.			trans	101.3	158.8	-176.1	0	0	0	0	0	114	Q97 Y98 W101 K102 W123 V124	Q97-G104 WeakPolarHBondContact O-CA 3.45Å; Y98-G104 WeakPolarHBondContact O-CA 3.35Å; W101-G104 PolarHBondContact O-N 3.36Å; K102-G104 PolarHBondContact O-N 3.28Å; K102-G104 VanDerWaalsContact O-N 3.14Å; G104-W123 WeakPolarHBondContact O-CA 3.45Å; G104-V124 PolarHBondContact O-N 3.3Å
105	G	97.7	Very high	96.5	Very high	20 Å²	20	45 Å²	45	21%	0.206	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.6	179.1	0	0	0	0	0	111.8	A96 Q97	A96-G105 CarbonylContact C-O 3.5Å; A96-G105 VanDerWaalsContact CA-O 3.3Å; A96-G105 WeakPolarHBondContact CA-O 3.27Å; Q97-G105 PolarHBondContact N-O 2.84Å; Q97-G105 PolarHBondContact O-N 3.02Å
106	I	98.4	Very high	96.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.7	-178	-67.3	165.9	0	0	0	110.4	V94 A96 V109 V118 N121 M122 V124 A127	V94-I106 HydrophobicContact CB-CD1 4.42Å; V94-I106 HydrophobicContact CB-CG1 4.25Å; V94-I106 HydrophobicContact CB-CG2 4.01Å; V94-I106 HydrophobicContact CG1-CD1 4.18Å; V94-I106 HydrophobicContact CG1-CG1 4.41Å; V94-I106 HydrophobicContact CG1-CG2 3.8Å; V94-I106 HydrophobicContact CG2-CD1 4.25Å; V94-I106 HydrophobicContact CG2-CG1 4.25Å; A96-I106 HydrophobicContact CB-CG1 4.46Å; I106-V109 HydrophobicContact CG2-CG2 3.67Å; I106-V118 HydrophobicContact CD1-CG1 4.1Å; I106-N121 PolarHBondContact O-N 3.42Å; I106-M122 WeakPolarHBondContact CB-O 3.5Å; I106-M122 HydrophobicContact CD1-CB 4.08Å; I106-M122 PolarHBondContact N-O 2.81Å; I106-V124 HydrophobicContact CD1-CG2 4.22Å; I106-V124 HydrophobicContact CG1-CG2 3.77Å; I106-A127 HydrophobicContact CD1-CB 3.47Å; I106-A127 VanDerWaalsContact CD1-CB 3.47Å
107	I	97.8	Very high	96.3	Very high	38 Å²	38	51.5 Å²	51.5	20%	0.195	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-24.7	-178.4	59.3	161.4	0	0	0	113.9	Y77 V95 Q97 R120 V139	Y77-I107 HydrophobicContact CD2-CD1 3.49Å; Y77-I107 VanDerWaalsContact CD2-CD1 3.49Å; Y77-I107 HydrophobicContact CD2-CG1 4.37Å; Y77-I107 HydrophobicContact CE2-CD1 3.59Å; V95-I107 HydrophobicContact CB-CG1 4.22Å; V95-I107 HydrophobicContact CG1-CD1 4.11Å; V95-I107 HydrophobicContact CG1-CG1 4.07Å; V95-I107 VanDerWaalsContact O-CG1 3.25Å; V95-I107 WeakPolarHBondContact O-CG1 3.48Å; V95-I107 PolarHBondContact O-N 2.85Å; Q97-I107 HydrophobicContact CG-CD1 4.03Å; Q97-I107 HydrophobicContact CG-CG2 4.11Å; I107-R120 VanDerWaalsContact O-CD 3.27Å; I107-R120 WeakPolarHBondContact O-CD 3.42Å; I107-R120 WeakPolarHBondContact O-CG 3.4Å; I107-R120 PolarHBondContact O-NE 3.14Å; I107-V139 HydrophobicContact CD1-CG2 3.65Å; I107-V139 HydrophobicContact CG1-CG2 4.44Å
108	A	98.1	Very high	96.3	Very high	14 Å²	14	49.1 Å²	49.1	12%	0.116	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.9	173.4	0	0	0	0	0	110.5	V78 V94 V95	V78-A108 HydrophobicContact CG2-CB 4Å; V94-A108 WeakPolarHBondContact CA-O 3.43Å; V95-A108 HydrophobicContact CB-CB 4.26Å; V95-A108 HydrophobicContact CG2-CB 4.39Å; V95-A108 PolarHBondContact N-O 2.96Å; V95-A108 PolarHBondContact O-N 3.44Å
109	V	98.5	Very high	96.3	Very high	8 Å²	8	49.7 Å²	49.7	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	130.1	-172.6	-166	0	0	0	0	109.5	C75 V94 I106 A113 R114 V118	C75-V109 WeakPolarHBondContact CB-O 3.48Å; V94-V109 HydrophobicContact CG1-CB 4.17Å; V94-V109 HydrophobicContact CG1-CG1 3.81Å; V94-V109 HydrophobicContact CG1-CG2 4.08Å; I106-V109 HydrophobicContact CG2-CG2 3.67Å; V109-A113 HydrophobicContact CG1-CB 3.55Å; V109-R114 HydrophobicContact CB-CG 4.21Å; V109-R114 HydrophobicContact CG1-CG 3.84Å; V109-R114 PolarHBondContact O-NE 2.91Å; V109-R114 PolarHBondContact O-NH2 3.28Å; V109-V118 HydrophobicContact CG1-CB 4.11Å; V109-V118 HydrophobicContact CG1-CG1 3.97Å
110	S	98.2	Very high	96.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.			trans	-63.4	168.1	172.6	92	0	0	0	0	110.8	T91 C93 E112 A113 R114	T91-S110 PolarHBondContact O-OG 2.9Å; C93-S110 PolarHBondContact N-OG 3.38Å; C93-S110 VanDerWaalsContact N-OG 3.14Å; C93-S110 VanDerWaalsContact O-CB 3.26Å; C93-S110 WeakPolarHBondContact O-CB 3.47Å; C93-S110 PolarHBondContact O-N 3.45Å; S110-E112 WeakPolarHBondContact CB-OE2 3.43Å; S110-E112 PolarHBondContact OG-OE2 3.05Å; S110-A113 WeakPolarHBondContact OG-CB 3.4Å; S110-A113 PolarHBondContact OG-N 2.99Å; S110-R114 VanDerWaalsContact O-CG 3.3Å; S110-R114 WeakPolarHBondContact O-CG 3.42Å; S110-R114 PolarHBondContact O-N 3.17Å; S110-R114 PolarHBondContact O-NE 3.47Å
111	Y	96.5	Very high	96.4	Very high	32 Å²	32	49.5 Å²	49.5	13%	0.125	25%	0.249	C	C	.	.	H	α-helix	trans	-79.3	-34.3	-178.9	-74.9	-97	0	0	0	111.5	D74 C75 R114 A115 K297 P298	D74-Y111 HydrophobicContact CB-CE2 4.03Å; D74-Y111 WeakPolarHBondContact OD1-CE2 3.42Å; D74-Y111 VanDerWaalsContact OD1-CZ 3.22Å; D74-Y111 PolarHBondContact OD1-OH 2.76Å; C75-Y111 HydrophobicContact CB-CD2 4.3Å; C75-Y111 HydrophobicContact CB-CE2 3.98Å; Y111-R114 WeakPolarHBondContact O-CB 3.46Å; Y111-R114 PolarHBondContact O-N 3.45Å; Y111-R114 VanDerWaalsContact O-N 3.17Å; Y111-R114 PolarHBondContact OH-NH1 3.39Å; Y111-A115 PolarHBondContact O-N 2.95Å; Y111-K297 HydrophobicContact CE1-CB 4.3Å; Y111-P298 HydrophobicContact CD1-CB 4.06Å; Y111-P298 HydrophobicContact CD1-CG 3.92Å; Y111-P298 HydrophobicContact CD2-CB 3.91Å; Y111-P298 HydrophobicContact CD2-CG 4.29Å; Y111-P298 HydrophobicContact CE1-CB 3.87Å; Y111-P298 HydrophobicContact CE1-CG 4.15Å; Y111-P298 HydrophobicContact CE2-CB 3.71Å; Y111-P298 HydrophobicContact CG-CB 4.09Å; Y111-P298 HydrophobicContact CG-CG 4.01Å
112	E	96.4	Very high	96.6	Very high	18 Å²	18	42.9 Å²	42.9	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-57.5	-44.3	168	-42.4	86.6	153.9	0	0	111.2	N90 P92 S110 A115 H116 V688	N90-E112 WeakPolarHBondContact CA-OE1 3.45Å; P92-E112 HydrophobicContact CB-CB 4.46Å; S110-E112 WeakPolarHBondContact CB-OE2 3.43Å; S110-E112 PolarHBondContact OG-OE2 3.05Å; E112-A115 VanDerWaalsContact O-CB 3.31Å; E112-A115 WeakPolarHBondContact O-CB 3.36Å; E112-A115 PolarHBondContact O-N 3.04Å; E112-H116 PolarHBondContact O-CD2 3.03Å; E112-H116 VanDerWaalsContact O-CD2 3.29Å; E112-V688 HydrophobicContact CB-CG1 3.82Å; E112-V688 HydrophobicContact CG-CB 4.25Å; E112-V688 HydrophobicContact CG-CG1 3.62Å
113	A	97.3	Very high	96.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-69.8	-32.2	175.1	0	0	0	0	0	112.9	P92 V94 V109 S110 A115 H116 V118 L134	P92-A113 HydrophobicContact CB-CB 4.05Å; V94-A113 HydrophobicContact CG1-CB 4.5Å; V109-A113 HydrophobicContact CG1-CB 3.55Å; S110-A113 WeakPolarHBondContact OG-CB 3.4Å; S110-A113 PolarHBondContact OG-N 2.99Å; A113-A115 VanDerWaalsContact C-N 3.29Å; A113-A115 PolarHBondContact O-N 3.36Å; A113-H116 PolarHBondContact O-N 2.95Å; A113-V118 HydrophobicContact CB-CB 4.39Å; A113-V118 VanDerWaalsContact O-CB 3.23Å; A113-V118 WeakPolarHBondContact O-CB 3.26Å; A113-V118 WeakPolarHBondContact O-CG2 3.46Å; A113-V118 PolarHBondContact O-N 2.97Å; A113-L134 HydrophobicContact CB-CD1 3.76Å
114	R	96.8	Very high	96.9	Very high	98 Å²	98	43.3 Å²	43.3	37%	0.37	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-30.1	173	-71.5	172.4	-140.4	-179.6	8.6	112.5	V109 S110 Y111 H116 G117	V109-R114 HydrophobicContact CB-CG 4.21Å; V109-R114 HydrophobicContact CG1-CG 3.84Å; V109-R114 PolarHBondContact O-NE 2.91Å; V109-R114 PolarHBondContact O-NH2 3.28Å; S110-R114 VanDerWaalsContact O-CG 3.3Å; S110-R114 WeakPolarHBondContact O-CG 3.42Å; S110-R114 PolarHBondContact O-N 3.17Å; S110-R114 PolarHBondContact O-NE 3.47Å; Y111-R114 WeakPolarHBondContact O-CB 3.46Å; Y111-R114 PolarHBondContact O-N 3.45Å; Y111-R114 VanDerWaalsContact O-N 3.17Å; Y111-R114 PolarHBondContact OH-NH1 3.39Å; R114-H116 PolarHBondContact O-N 3.31Å; R114-G117 WeakPolarHBondContact O-CA 3.23Å; R114-G117 PolarHBondContact O-N 3.41Å
115	A	95.1	Very high	97	Very high	31 Å²	31	47.1 Å²	47.1	26%	0.256	24%	0.242	S	C	.	.	H	α-helix	trans	-58.4	-33.3	174.9	0	0	0	0	0	112.1	Y111 E112 A113 G117 P692	Y111-A115 PolarHBondContact O-N 2.95Å; E112-A115 VanDerWaalsContact O-CB 3.31Å; E112-A115 WeakPolarHBondContact O-CB 3.36Å; E112-A115 PolarHBondContact O-N 3.04Å; A113-A115 VanDerWaalsContact C-N 3.29Å; A113-A115 PolarHBondContact O-N 3.36Å; A115-G117 PolarHBondContact O-N 2.96Å; A115-P692 VanDerWaalsContact CA-CG 3.5Å; A115-P692 HydrophobicContact CB-CG 3.44Å; A115-P692 VanDerWaalsContact CB-CG 3.44Å
116	H	96.1	Very high	97	Very high	94 Å²	94	48 Å²	48	44%	0.435	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	17.6	171.4	-57.7	-77.8	0	0	0	114	E112 A113 R114 V118 L130 C131	E112-H116 PolarHBondContact O-CD2 3.03Å; E112-H116 VanDerWaalsContact O-CD2 3.29Å; A113-H116 PolarHBondContact O-N 2.95Å; R114-H116 PolarHBondContact O-N 3.31Å; H116-V118 PolarHBondContact O-N 2.82Å; H116-L130 WeakPolarHBondContact O-CB 3.08Å; H116-C131 HydrophobicContact CB-CB 3.81Å
117	G	96.1	Very high	97	Very high	43 Å²	43	47.9 Å²	47.9	44%	0.443	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	10.8	-179.2	0	0	0	0	0	115.4	R114 A115 T119	R114-G117 WeakPolarHBondContact O-CA 3.23Å; R114-G117 PolarHBondContact O-N 3.41Å; A115-G117 PolarHBondContact O-N 2.96Å; G117-T119 PolarHBondContact O-N 2.88Å
118	V	97.5	Very high	97	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	C	.	.			trans	-70.7	131.2	176.6	-177.1	0	0	0	0	109.7	V94 I106 V109 A113 H116 M122 A127 L130 C131 L134	V94-V118 HydrophobicContact CG1-CG1 3.92Å; I106-V118 HydrophobicContact CD1-CG1 4.1Å; V109-V118 HydrophobicContact CG1-CB 4.11Å; V109-V118 HydrophobicContact CG1-CG1 3.97Å; A113-V118 HydrophobicContact CB-CB 4.39Å; A113-V118 VanDerWaalsContact O-CB 3.23Å; A113-V118 WeakPolarHBondContact O-CB 3.26Å; A113-V118 WeakPolarHBondContact O-CG2 3.46Å; A113-V118 PolarHBondContact O-N 2.97Å; H116-V118 PolarHBondContact O-N 2.82Å; V118-M122 HydrophobicContact CG1-SD 4.38Å; V118-A127 HydrophobicContact CG1-CB 3.72Å; V118-A127 HydrophobicContact CG2-CB 4.15Å; V118-L130 HydrophobicContact CG2-CB 4.49Å; V118-C131 HydrophobicContact CG2-CB 4.34Å; V118-L134 HydrophobicContact CG2-CD1 4.43Å; V118-L134 HydrophobicContact CG2-CD2 4.45Å
119	T	96.9	Very high	97	Very high	78 Å²	78	56.5 Å²	56.5	48%	0.479	28%	0.275	S	S	.	.			trans	-129.3	157.1	-176	55.7	0	0	0	0	113	G117 M122	G117-T119 PolarHBondContact O-N 2.88Å; T119-M122 PolarHBondContact N-SD 3.22Å; T119-M122 VanDerWaalsContact O-CB 3.3Å; T119-M122 WeakPolarHBondContact O-CB 3.36Å; T119-M122 WeakPolarHBondContact O-CG 3.27Å; T119-M122 PolarHBondContact O-N 2.88Å; T119-M122 WeakPolarHBondContact OG1-CG 3.39Å; T119-M122 PolarHBondContact OG1-SD 3.48Å
120	R	94.8	Very high	96.9	Very high	168 Å²	168	60.2 Å²	60.2	63%	0.634	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	143.8	174.4	-178.2	178.2	173.3	-147.3	-2.3	110.3	I107 M122	I107-R120 VanDerWaalsContact O-CD 3.27Å; I107-R120 WeakPolarHBondContact O-CD 3.42Å; I107-R120 WeakPolarHBondContact O-CG 3.4Å; I107-R120 PolarHBondContact O-NE 3.14Å; R120-M122 VanDerWaalsContact C-N 3.25Å
121	N	93.6	Very high	96.9	Very high	127 Å²	127	60.3 Å²	60.3	68%	0.679	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	1.3	-171.8	-38.3	-75.1	0	0	0	115.5	I106	I106-N121 PolarHBondContact O-N 3.42Å
122	M	97.4	Very high	96.8	Very high	36 Å²	36	63 Å²	63	18%	0.177	32%	0.317	C	S	.	.			trans	-65.4	158.7	162.9	-71.3	-174.5	75.3	0	0	111.3	I106 V118 T119 R120 D126 A127 L130	I106-M122 WeakPolarHBondContact CB-O 3.5Å; I106-M122 HydrophobicContact CD1-CB 4.08Å; I106-M122 PolarHBondContact N-O 2.81Å; V118-M122 HydrophobicContact CG1-SD 4.38Å; T119-M122 PolarHBondContact N-SD 3.22Å; T119-M122 VanDerWaalsContact O-CB 3.3Å; T119-M122 WeakPolarHBondContact O-CB 3.36Å; T119-M122 WeakPolarHBondContact O-CG 3.27Å; T119-M122 PolarHBondContact O-N 2.88Å; T119-M122 WeakPolarHBondContact OG1-CG 3.39Å; T119-M122 PolarHBondContact OG1-SD 3.48Å; R120-M122 VanDerWaalsContact C-N 3.25Å; M122-D126 HydrophobicContact CE-CB 4.39Å; M122-A127 HydrophobicContact CE-CB 4.17Å; M122-L130 HydrophobicContact CE-CD1 3.77Å; M122-L130 HydrophobicContact SD-CD1 4.33Å
123	W	98.3	Very high	96.8	Very high	98 Å²	98	67.9 Å²	67.9	37%	0.371	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-86.3	145.3	166.1	-56.3	102.7	0	0	0	110	W101 K102 G104 D125 D126 A127	W101-W123 AromaticContact CD1-CE3 3.98Å; W101-W123 AromaticContact CD1-CH2 3.64Å; W101-W123 AromaticContact CD1-CZ3 3.57Å; W101-W123 AromaticContact NE1-CH2 3.94Å; W101-W123 AromaticContact NE1-CZ2 3.98Å; K102-W123 HydrophobicContact CB-CB 3.6Å; K102-W123 HydrophobicContact CB-CD2 3.86Å; K102-W123 HydrophobicContact CB-CE3 4Å; K102-W123 HydrophobicContact CB-CG 3.68Å; K102-W123 HydrophobicContact CD-CB 4.02Å; K102-W123 VanDerWaalsContact CD-CD1 3.48Å; K102-W123 HydrophobicContact CD-CD2 3.97Å; K102-W123 HydrophobicContact CD-CG 3.52Å; K102-W123 HydrophobicContact CG-CB 4.49Å; K102-W123 HydrophobicContact CG-CD2 4.44Å; K102-W123 HydrophobicContact CG-CG 4.25Å; G104-W123 WeakPolarHBondContact O-CA 3.45Å; W123-D125 VanDerWaalsContact C-N 3.28Å; W123-D125 PolarHBondContact O-N 2.67Å; W123-D126 HydrophobicContact CB-CB 4.35Å; W123-D126 PolarHBondContact O-N 3.32Å; W123-A127 PolarHBondContact O-N 3.32Å
124	V	98.1	Very high	96.8	Very high	4 Å²	4	67.9 Å²	67.9	2%	0.024	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-40.7	179.3	172.4	0	0	0	0	111.7	A96 K102 G103 G104 I106 D126 A127 K128 V136	A96-V124 HydrophobicContact CB-CG2 3.56Å; K102-V124 PolarHBondContact O-N 3.43Å; G103-V124 WeakPolarHBondContact O-CB 3.5Å; G103-V124 WeakPolarHBondContact O-CG2 3.49Å; G104-V124 PolarHBondContact O-N 3.3Å; I106-V124 HydrophobicContact CD1-CG2 4.22Å; I106-V124 HydrophobicContact CG1-CG2 3.77Å; V124-D126 PolarHBondContact O-N 3.06Å; V124-A127 PolarHBondContact O-N 3.33Å; V124-K128 WeakPolarHBondContact O-CB 3.18Å; V124-K128 PolarHBondContact O-N 3.34Å; V124-V136 HydrophobicContact CG1-CG1 4.18Å; V124-V136 HydrophobicContact CG1-CG2 3.79Å; V124-V136 HydrophobicContact CG2-CG1 3.87Å
125	D	97.9	Very high	96.9	Very high	81 Å²	81	67.3 Å²	67.3	43%	0.433	35%	0.345	S	S	.	.	H	α-helix	trans	-67.8	-21.6	178.6	-64.4	-7	0	0	0	113.1	K102 G103 W123 K129	K102-D125 WeakPolarHBondContact CA-OD2 3.44Å; K102-D125 HydrophobicContact CB-CB 4.5Å; K102-D125 PolarHBondContact O-N 3.47Å; G103-D125 VanDerWaalsContact CA-OD1 3.24Å; G103-D125 WeakPolarHBondContact CA-OD1 3.45Å; G103-D125 PolarHBondContact N-OD1 2.97Å; G103-D125 PolarHBondContact N-OD2 2.96Å; G103-D125 VanDerWaalsContact N-OD2 3.09Å; W123-D125 VanDerWaalsContact C-N 3.28Å; W123-D125 PolarHBondContact O-N 2.67Å; D125-K129 WeakPolarHBondContact O-CE 3.44Å
126	D	97.9	Very high	97	Very high	38 Å²	38	67.4 Å²	67.4	20%	0.203	34%	0.342	C	S	.	.	H	α-helix	trans	-90.2	-34.5	175	-65.7	-43.3	0	0	0	111.3	K102 M122 W123 V124 K129	K102-D126 IonicContact NZ-OD1 2.68Å; K102-D126 IonicContact NZ-OD2 2.68Å; K102-D126 PolarHBondContact NZ-OD2 3.04Å; M122-D126 HydrophobicContact CE-CB 4.39Å; W123-D126 HydrophobicContact CB-CB 4.35Å; W123-D126 PolarHBondContact O-N 3.32Å; V124-D126 PolarHBondContact O-N 3.06Å; D126-K129 WeakPolarHBondContact O-CB 3.46Å; D126-K129 PolarHBondContact O-N 3.07Å; D126-K129 IonicContact OD1-NZ 3.19Å; D126-K129 PolarHBondContact OD1-NZ 3.47Å
127	A	97.8	Very high	97.1	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.3	-36.5	174	0	0	0	0	0	112.8	I106 V118 M122 W123 V124 K129 L130 C131 L134	I106-A127 HydrophobicContact CD1-CB 3.47Å; I106-A127 VanDerWaalsContact CD1-CB 3.47Å; V118-A127 HydrophobicContact CG1-CB 3.72Å; V118-A127 HydrophobicContact CG2-CB 4.15Å; M122-A127 HydrophobicContact CE-CB 4.17Å; W123-A127 PolarHBondContact O-N 3.32Å; V124-A127 PolarHBondContact O-N 3.33Å; A127-K129 PolarHBondContact O-N 3.19Å; A127-K129 VanDerWaalsContact O-N 3.1Å; A127-L130 PolarHBondContact O-N 3.27Å; A127-C131 PolarHBondContact O-N 2.9Å; A127-C131 VanDerWaalsContact O-N 3.07Å; A127-L134 HydrophobicContact CB-CD2 3.59Å
128	K	97.9	Very high	97.1	Very high	83 Å²	83	65.3 Å²	65.3	36%	0.361	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-8.6	175.1	-87.4	-166.4	165.1	-60.7	0	115	V124 C131 P132 L134	V124-K128 WeakPolarHBondContact O-CB 3.18Å; V124-K128 PolarHBondContact O-N 3.34Å; K128-C131 WeakPolarHBondContact CA-O 3.32Å; K128-P132 PolarHBondContact NZ-O 3.5Å; K128-P132 WeakPolarHBondContact O-CA 3.36Å; K128-L134 WeakPolarHBondContact CE-O 3.16Å; K128-L134 HydrophobicContact CG-CB 4.2Å; K128-L134 HydrophobicContact CG-CD2 4.28Å; K128-L134 PolarHBondContact NZ-O 3.17Å
129	K	97.8	Very high	97.1	Very high	149 Å²	149	65.6 Å²	65.6	65%	0.648	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-21.7	170.8	-60.5	165.5	-173.1	161	0	112.6	D125 D126 A127	D125-K129 WeakPolarHBondContact O-CE 3.44Å; D126-K129 WeakPolarHBondContact O-CB 3.46Å; D126-K129 PolarHBondContact O-N 3.07Å; D126-K129 IonicContact OD1-NZ 3.19Å; D126-K129 PolarHBondContact OD1-NZ 3.47Å; A127-K129 PolarHBondContact O-N 3.19Å; A127-K129 VanDerWaalsContact O-N 3.1Å
130	L	97.2	Very high	97.1	Very high	86 Å²	86	69.3 Å²	69.3	45%	0.45	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-35.5	176.1	-52.4	-178.3	0	0	0	111.4	H116 V118 M122 A127	H116-L130 WeakPolarHBondContact O-CB 3.08Å; V118-L130 HydrophobicContact CG2-CB 4.49Å; M122-L130 HydrophobicContact CE-CD1 3.77Å; M122-L130 HydrophobicContact SD-CD1 4.33Å; A127-L130 PolarHBondContact O-N 3.27Å
131	C	96.8	Very high	97.2	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.02	32%	0.318	C	S	.	.			trans	-134.5	98.9	176.6	-178.1	0	0	0	0	109.1	H116 V118 A127 K128 D133 L134	H116-C131 HydrophobicContact CB-CB 3.81Å; V118-C131 HydrophobicContact CG2-CB 4.34Å; A127-C131 PolarHBondContact O-N 2.9Å; A127-C131 VanDerWaalsContact O-N 3.07Å; K128-C131 WeakPolarHBondContact CA-O 3.32Å; C131-D133 VanDerWaalsContact C-N 3.32Å; C131-D133 PolarHBondContact O-N 3.12Å; C131-L134 HydrophobicContact CB-CB 4.03Å; C131-L134 WeakPolarHBondContact O-CB 3.27Å; C131-L134 PolarHBondContact O-N 2.71Å
132	P	96.1	Very high	97.3	Very high	89 Å²	89	61.7 Å²	61.7	58%	0.578	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-43.9	-179.1	-26.8	36.6	0	0	0	112.8	K128 L134	K128-P132 PolarHBondContact NZ-O 3.5Å; K128-P132 WeakPolarHBondContact O-CA 3.36Å; P132-L134 PolarHBondContact O-N 2.9Å
133	D	96	Very high	97.2	Very high	119 Å²	119	62 Å²	62	64%	0.636	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	1.9	-175.8	-51.3	-69.5	0	0	0	114.1	C131 Q135	C131-D133 VanDerWaalsContact C-N 3.32Å; C131-D133 PolarHBondContact O-N 3.12Å; D133-Q135 PolarHBondContact O-N 3.21Å; D133-Q135 VanDerWaalsContact O-N 3.11Å; D133-Q135 PolarHBondContact O-NE2 3.25Å
134	L	97.8	Very high	96.9	Very high	1 Å²	1	59 Å²	59	1%	0.005	30%	0.298	C	S	.	.			trans	-50.4	114.8	-179.4	-177.1	70.7	0	0	0	112	P92 V94 A113 V118 A127 K128 C131 P132 V136	P92-L134 HydrophobicContact CB-CD1 4.34Å; P92-L134 WeakPolarHBondContact O-CA 3.16Å; V94-L134 HydrophobicContact CG1-CD1 4.06Å; V94-L134 HydrophobicContact CG2-CD1 4.07Å; V94-L134 HydrophobicContact CG2-CD2 3.89Å; V94-L134 HydrophobicContact CG2-CG 3.9Å; A113-L134 HydrophobicContact CB-CD1 3.76Å; V118-L134 HydrophobicContact CG2-CD1 4.43Å; V118-L134 HydrophobicContact CG2-CD2 4.45Å; A127-L134 HydrophobicContact CB-CD2 3.59Å; K128-L134 WeakPolarHBondContact CE-O 3.16Å; K128-L134 HydrophobicContact CG-CB 4.2Å; K128-L134 HydrophobicContact CG-CD2 4.28Å; K128-L134 PolarHBondContact NZ-O 3.17Å; C131-L134 HydrophobicContact CB-CB 4.03Å; C131-L134 WeakPolarHBondContact O-CB 3.27Å; C131-L134 PolarHBondContact O-N 2.71Å; P132-L134 PolarHBondContact O-N 2.9Å; L134-V136 HydrophobicContact CG-CG2 4.5Å
135	Q	98	Very high	96.9	Very high	86 Å²	86	59.3 Å²	59.3	40%	0.402	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	143.5	174.7	-59.1	-56	-34.3	0	0	110.5	L88 P92 C93 V94 D133	L88-Q135 HydrophobicContact CD2-CB 3.71Å; L88-Q135 HydrophobicContact CD2-CG 4.21Å; P92-Q135 PolarHBondContact O-N 3.28Å; C93-Q135 WeakPolarHBondContact CA-O 3.4Å; C93-Q135 HydrophobicContact CB-CB 4.3Å; V94-Q135 WeakPolarHBondContact CG2-O 3.5Å; V94-Q135 PolarHBondContact N-O 3.16Å; D133-Q135 PolarHBondContact O-N 3.21Å; D133-Q135 VanDerWaalsContact O-N 3.11Å; D133-Q135 PolarHBondContact O-NE2 3.25Å
136	V	97.8	Very high	96.8	Very high	32 Å²	32	55.8 Å²	55.8	19%	0.194	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	91	-170.4	-167.9	0	0	0	0	111.5	V94 A96 V124 L134 R138	V94-V136 HydrophobicContact CG2-CB 4.29Å; V94-V136 HydrophobicContact CG2-CG1 4.09Å; V94-V136 HydrophobicContact CG2-CG2 3.91Å; V94-V136 WeakPolarHBondContact O-CA 3.45Å; A96-V136 HydrophobicContact CB-CG1 3.91Å; V124-V136 HydrophobicContact CG1-CG1 4.18Å; V124-V136 HydrophobicContact CG1-CG2 3.79Å; V124-V136 HydrophobicContact CG2-CG1 3.87Å; L134-V136 HydrophobicContact CG-CG2 4.5Å; V136-R138 VanDerWaalsContact CG1-CZ 3.45Å
137	A	97.6	Very high	96.8	Very high	9 Å²	9	54.6 Å²	54.6	7%	0.074	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	149.2	168.5	0	0	0	0	0	111	E81 L88 V94 V95 A96	E81-A137 HydrophobicContact CB-CB 3.65Å; E81-A137 HydrophobicContact CG-CB 3.53Å; L88-A137 HydrophobicContact CD1-CB 4.1Å; V94-A137 PolarHBondContact O-N 3.25Å; V95-A137 HydrophobicContact CG2-CB 4.37Å; A96-A137 PolarHBondContact N-O 3.15Å
138	R	96.8	Very high	96.7	Very high	85 Å²	85	56.3 Å²	56.3	32%	0.321	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.2	-169.7	-63.7	-60.5	179	166.5	-5	111	Y98 G103 V136 R140	Y98-R138 PolarHBondContact O-NH1 3.08Å; G103-R138 VanDerWaalsContact O-CZ 3.25Å; G103-R138 PolarHBondContact O-NH1 3.31Å; G103-R138 PolarHBondContact O-NH2 3.3Å; V136-R138 VanDerWaalsContact CG1-CZ 3.45Å; R138-R140 PolarHBondContact O-N 3.19Å
139	V	97.4	Very high	96.7	Very high	6 Å²	6	54 Å²	54	4%	0.036	28%	0.277	C	S	.	.			trans	-55.1	127.2	169.9	-179.7	0	0	0	0	109	V95 A96 Q97 I107 A146 D147 L148 Y151	V95-V139 HydrophobicContact CG1-CG2 3.6Å; A96-V139 PolarHBondContact O-N 2.62Å; Q97-V139 HydrophobicContact CG-CB 3.93Å; Q97-V139 HydrophobicContact CG-CG1 4.18Å; Q97-V139 HydrophobicContact CG-CG2 3.62Å; I107-V139 HydrophobicContact CD1-CG2 3.65Å; I107-V139 HydrophobicContact CG1-CG2 4.44Å; V139-A146 HydrophobicContact CG1-CB 3.9Å; V139-D147 WeakPolarHBondContact CG1-O 3.08Å; V139-L148 HydrophobicContact CG1-CD2 3.71Å; V139-Y151 HydrophobicContact CG1-CE2 4.24Å; V139-Y151 HydrophobicContact CG2-CE2 4.18Å
140	R	96.3	Very high	96.6	Very high	155 Å²	155	49 Å²	49	59%	0.585	26%	0.255	S	S	*	.			trans	-50.3	139.6	176.8	-179.4	177.9	-179.5	172.5	-1.1	110.4	R138 A146 D147	R138-R140 PolarHBondContact O-N 3.19Å; R140-A146 CarbonylContact O-C 3.59Å; R140-A146 WeakPolarHBondContact O-CA 3.41Å; R140-D147 HydrophobicContact CB-CB 4.44Å; R140-D147 HydrophobicContact CG-CB 4.46Å; R140-D147 PolarHBondContact O-N 3.27Å
141	E	96.3	Very high	96.7	Very high	102 Å²	102	44.9 Å²	44.9	48%	0.477	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.9	167.8	-63.7	-163.1	-133.2	0	0	110.2	Y98 K145	Y98-E141 WeakPolarHBondContact CA-OE1 3.36Å; Y98-E141 VanDerWaalsContact CD1-CD 3.5Å; Y98-E141 WeakPolarHBondContact CD1-OE1 3.47Å; Y98-E141 VanDerWaalsContact CD1-OE2 3.24Å; Y98-E141 WeakPolarHBondContact CD1-OE2 3.23Å; Y98-E141 WeakPolarHBondContact CE1-OE2 3.33Å; E141-K145 CarbonylContact C-O 3.6Å; E141-K145 VanDerWaalsContact CA-O 3.28Å; E141-K145 WeakPolarHBondContact CA-O 3.43Å
142	S	96.1	Very high	96.7	Very high	34 Å²	34	47.2 Å²	47.2	24%	0.238	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	149.6	174.8	-168.8	0	0	0	0	108.8	G144 K145	S142-G144 PolarHBondContact O-N 3.36Å; S142-K145 PolarHBondContact N-O 2.85Å; S142-K145 WeakPolarHBondContact O-CG 3.31Å; S142-K145 PolarHBondContact O-N 3.24Å
143	H	95.3	Very high	96.7	Very high	41 Å²	41	46.5 Å²	46.5	19%	0.19	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	35.9	-175.3	-55.4	-52.8	0	0	0	113.4	K145 W406 Q409 E416	H143-K145 VanDerWaalsContact C-N 3.31Å; H143-K145 PolarHBondContact O-N 3.28Å; H143-W406 WeakPolarHBondContact O-CZ3 3.47Å; H143-Q409 HydrophobicContact CB-CB 4.16Å; H143-Q409 PolarHBondContact O-OE1 2.92Å; H143-E416 IonicContact CD2-OE1 2.69Å; H143-E416 IonicContact CE1-OE1 3.58Å; H143-E416 IonicContact NE2-OE1 3.98Å; H143-E416 PolarHBondContact NE2-OE1 3.24Å; H143-E416 IonicContact NE2-OE2 3.52Å
144	G	93.1	Very high	96.9	Very high	37 Å²	37	40.9 Å²	40.9	38%	0.381	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	20.2	-177.1	0	0	0	0	0	115.8	S142 K389 W406	S142-G144 PolarHBondContact O-N 3.36Å; G144-K389 PolarHBondContact O-NZ 3.25Å; G144-W406 VanDerWaalsContact O-CH2 3.3Å; G144-W406 WeakPolarHBondContact O-CH2 3.18Å
145	K	96.4	Very high	96.9	Very high	9 Å²	9	40.9 Å²	40.9	4%	0.039	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160.2	-178.8	58.9	174	-63.3	-61.6	0	112.7	E141 S142 H143 D147 S388 K389 L410 E413	E141-K145 CarbonylContact C-O 3.6Å; E141-K145 VanDerWaalsContact CA-O 3.28Å; E141-K145 WeakPolarHBondContact CA-O 3.43Å; S142-K145 PolarHBondContact N-O 2.85Å; S142-K145 WeakPolarHBondContact O-CG 3.31Å; S142-K145 PolarHBondContact O-N 3.24Å; H143-K145 VanDerWaalsContact C-N 3.31Å; H143-K145 PolarHBondContact O-N 3.28Å; K145-D147 PolarHBondContact O-N 3.45Å; K145-S388 WeakPolarHBondContact CE-O 3.41Å; K145-K389 HydrophobicContact CB-CD 4.19Å; K145-L410 HydrophobicContact CD-CD2 3.71Å; K145-E413 VanDerWaalsContact CE-OE2 3.23Å; K145-E413 WeakPolarHBondContact CE-OE2 3.31Å; K145-E413 IonicContact NZ-OE1 3.26Å; K145-E413 IonicContact NZ-OE2 2.7Å; K145-E413 PolarHBondContact NZ-OE2 2.82Å
146	A	96.8	Very high	96.8	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	123.3	169.7	0	0	0	0	0	111.1	Q97 Y98 V139 R140	Q97-A146 HydrophobicContact CB-CB 4.5Å; Q97-A146 HydrophobicContact CG-CB 4.03Å; Y98-A146 HydrophobicContact CE2-CB 4.27Å; Y98-A146 PolarHBondContact OH-N 2.94Å; Y98-A146 VanDerWaalsContact OH-N 3.14Å; V139-A146 HydrophobicContact CG1-CB 3.9Å; R140-A146 CarbonylContact O-C 3.59Å; R140-A146 WeakPolarHBondContact O-CA 3.41Å
147	D	96.9	Very high	96.8	Very high	13 Å²	13	41.2 Å²	41.2	7%	0.07	21%	0.205	C	C	.	.			trans	-100.8	141.1	170.7	176.1	28.1	0	0	0	109.3	V139 R140 K145 T149 R152	V139-D147 WeakPolarHBondContact CG1-O 3.08Å; R140-D147 HydrophobicContact CB-CB 4.44Å; R140-D147 HydrophobicContact CG-CB 4.46Å; R140-D147 PolarHBondContact O-N 3.27Å; K145-D147 PolarHBondContact O-N 3.45Å; D147-T149 WeakPolarHBondContact OD1-CB 3.44Å; D147-T149 PolarHBondContact OD1-N 3.04Å; D147-T149 PolarHBondContact OD1-OG1 3.37Å; D147-T149 PolarHBondContact OD2-OG1 2.83Å; D147-R152 IonicContact OD1-NH1 3.78Å; D147-R152 PolarHBondContact OD1-NH1 2.97Å
148	L	97.4	Very high	96.9	Very high	37 Å²	37	41.1 Å²	41.1	19%	0.194	20%	0.203	C	C	.	.			trans	-119.9	14.5	-175.7	-58.4	177.4	0	0	0	112.1	Y77 V139 H150 Y151 R152	Y77-L148 HydrophobicContact CE2-CD2 3.98Å; V139-L148 HydrophobicContact CG1-CD2 3.71Å; L148-H150 PolarHBondContact O-N 2.79Å; L148-Y151 HydrophobicContact CB-CD2 4.04Å; L148-Y151 HydrophobicContact CD2-CD2 3.75Å; L148-Y151 HydrophobicContact CD2-CE2 3.75Å; L148-Y151 PolarHBondContact O-N 3.07Å; L148-R152 WeakPolarHBondContact O-CG 3.31Å; L148-R152 PolarHBondContact O-N 3.01Å; L148-R152 VanDerWaalsContact O-N 3.1Å
149	T	96.9	Very high	96.9	Very high	35 Å²	35	37.9 Å²	37.9	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-43	-168.4	-64.3	0	0	0	0	113.2	D147 Y151 R152 E153	D147-T149 WeakPolarHBondContact OD1-CB 3.44Å; D147-T149 PolarHBondContact OD1-N 3.04Å; D147-T149 PolarHBondContact OD1-OG1 3.37Å; D147-T149 PolarHBondContact OD2-OG1 2.83Å; T149-Y151 PolarHBondContact O-N 2.73Å; T149-R152 WeakPolarHBondContact O-CA 3.26Å; T149-R152 WeakPolarHBondContact O-CB 3.29Å; T149-R152 PolarHBondContact O-N 3.17Å; T149-R152 PolarHBondContact OG1-NH1 3.36Å; T149-E153 HydrophobicContact CG2-CG 4.4Å; T149-E153 WeakPolarHBondContact CG2-OE1 3.4Å; T149-E153 WeakPolarHBondContact O-CG 3.31Å; T149-E153 PolarHBondContact O-N 2.75Å
150	H	95.6	Very high	96.8	Very high	42 Å²	42	43.1 Å²	43.1	19%	0.194	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-34.4	178.7	64.3	-74.4	0	0	0	113.4	E81 L148 R152 E153 A154	E81-H150 IonicContact OE1-CD2 2.78Å; E81-H150 IonicContact OE1-CE1 3.71Å; E81-H150 IonicContact OE1-NE2 3.91Å; E81-H150 PolarHBondContact OE1-NE2 3.02Å; L148-H150 PolarHBondContact O-N 2.79Å; H150-R152 VanDerWaalsContact C-N 3.32Å; H150-R152 PolarHBondContact O-N 3.35Å; H150-E153 PolarHBondContact O-N 2.91Å; H150-A154 WeakPolarHBondContact O-CB 3.49Å; H150-A154 PolarHBondContact O-N 3.22Å
151	Y	98.3	Very high	96.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.4	-30.6	171	-44.2	-66.1	0	0	0	112.6	Y77 V80 E81 V95 V139 L148 T149 E153 S155	Y77-Y151 AromaticContact CD1-CD1 3.75Å; Y77-Y151 HydrophobicContact CD1-CD1 3.75Å; Y77-Y151 HydrophobicContact CD1-CD2 4.44Å; Y77-Y151 HydrophobicContact CD1-CE1 4.44Å; Y77-Y151 AromaticContact CD1-CG 3.77Å; Y77-Y151 HydrophobicContact CD1-CG 3.77Å; Y77-Y151 AromaticContact CD2-CD1 3.84Å; Y77-Y151 HydrophobicContact CD2-CD1 3.84Å; Y77-Y151 AromaticContact CD2-CD2 3.69Å; Y77-Y151 HydrophobicContact CD2-CD2 3.69Å; Y77-Y151 AromaticContact CD2-CE1 3.84Å; Y77-Y151 HydrophobicContact CD2-CE1 3.84Å; Y77-Y151 AromaticContact CD2-CE2 3.67Å; Y77-Y151 HydrophobicContact CD2-CE2 3.67Å; Y77-Y151 AromaticContact CD2-CG 3.79Å; Y77-Y151 HydrophobicContact CD2-CG 3.79Å; Y77-Y151 AromaticContact CD2-CZ 3.77Å; Y77-Y151 HydrophobicContact CE1-CD1 4.25Å; Y77-Y151 HydrophobicContact CE1-CD2 4.25Å; Y77-Y151 AromaticContact CE1-CG 3.78Å; Y77-Y151 HydrophobicContact CE1-CG 3.78Å; Y77-Y151 HydrophobicContact CE2-CD1 4.33Å; Y77-Y151 AromaticContact CE2-CD2 3.46Å; Y77-Y151 HydrophobicContact CE2-CD2 3.46Å; Y77-Y151 VanDerWaalsContact CE2-CD2 3.46Å; Y77-Y151 AromaticContact CE2-CE2 3.75Å; Y77-Y151 HydrophobicContact CE2-CE2 3.75Å; Y77-Y151 AromaticContact CE2-CG 3.8Å; Y77-Y151 HydrophobicContact CE2-CG 3.8Å; Y77-Y151 AromaticContact CG-CD1 3.53Å; Y77-Y151 HydrophobicContact CG-CD1 3.53Å; Y77-Y151 HydrophobicContact CG-CD2 4.2Å; Y77-Y151 AromaticContact CG-CE1 3.76Å; Y77-Y151 HydrophobicContact CG-CE1 3.76Å; Y77-Y151 HydrophobicContact CG-CE2 4.37Å; Y77-Y151 AromaticContact CG-CG 3.79Å; Y77-Y151 HydrophobicContact CG-CG 3.79Å; Y77-Y151 AromaticContact CZ-CD2 3.76Å; Y77-Y151 AromaticContact CZ-CG 3.79Å; V80-Y151 HydrophobicContact CB-CD1 3.9Å; V80-Y151 HydrophobicContact CB-CE1 4.23Å; V80-Y151 HydrophobicContact CG1-CD1 3.84Å; V80-Y151 HydrophobicContact CG1-CE1 4.2Å; V80-Y151 HydrophobicContact CG2-CD1 4.18Å; E81-Y151 HydrophobicContact CG-CE1 4.31Å; E81-Y151 VanDerWaalsContact OE1-CE1 3.22Å; E81-Y151 WeakPolarHBondContact OE1-CE1 3.44Å; E81-Y151 VanDerWaalsContact OE1-CZ 3.23Å; E81-Y151 PolarHBondContact OE1-OH 2.83Å; V95-Y151 WeakPolarHBondContact CG1-OH 3.42Å; V139-Y151 HydrophobicContact CG1-CE2 4.24Å; V139-Y151 HydrophobicContact CG2-CE2 4.18Å; L148-Y151 HydrophobicContact CB-CD2 4.04Å; L148-Y151 HydrophobicContact CD2-CD2 3.75Å; L148-Y151 HydrophobicContact CD2-CE2 3.75Å; L148-Y151 PolarHBondContact O-N 3.07Å; T149-Y151 PolarHBondContact O-N 2.73Å; Y151-E153 VanDerWaalsContact C-N 3.35Å; Y151-S155 WeakPolarHBondContact O-CB 3.26Å; Y151-S155 PolarHBondContact O-N 3.36Å; Y151-S155 VanDerWaalsContact O-N 3.07Å
152	R	97.7	Very high	96.9	Very high	52 Å²	52	31.2 Å²	31.2	20%	0.196	17%	0.168	C	C	.	.	H	α-helix	trans	-72.2	-31.6	175	-62.7	166.3	-166.8	139	-9.4	111.4	D147 L148 T149 H150 S155 V156 I173 E413 R417	D147-R152 IonicContact OD1-NH1 3.78Å; D147-R152 PolarHBondContact OD1-NH1 2.97Å; L148-R152 WeakPolarHBondContact O-CG 3.31Å; L148-R152 PolarHBondContact O-N 3.01Å; L148-R152 VanDerWaalsContact O-N 3.1Å; T149-R152 WeakPolarHBondContact O-CA 3.26Å; T149-R152 WeakPolarHBondContact O-CB 3.29Å; T149-R152 PolarHBondContact O-N 3.17Å; T149-R152 PolarHBondContact OG1-NH1 3.36Å; H150-R152 VanDerWaalsContact C-N 3.32Å; H150-R152 PolarHBondContact O-N 3.35Å; R152-S155 WeakPolarHBondContact O-CB 3.39Å; R152-V156 WeakPolarHBondContact O-CG2 3.37Å; R152-V156 PolarHBondContact O-N 3.4Å; R152-I173 HydrophobicContact CG-CD1 3.95Å; R152-E413 IonicContact CZ-OE1 3.78Å; R152-E413 IonicContact NH1-OE1 2.62Å; R152-E413 IonicContact NH2-OE1 3.64Å; R152-E413 PolarHBondContact NH2-OE1 2.87Å; R152-R417 VanDerWaalsContact NH2-NH1 3.16Å
153	E	97.2	Very high	96.9	Very high	75 Å²	75	31.3 Å²	31.3	35%	0.35	17%	0.168	S	C	.	.	H	α-helix	trans	-75.6	-48.9	177.6	-70.9	163.5	156.3	0	0	110.5	T149 H150 Y151 S155 V156 E157 K420	T149-E153 HydrophobicContact CG2-CG 4.4Å; T149-E153 WeakPolarHBondContact CG2-OE1 3.4Å; T149-E153 WeakPolarHBondContact O-CG 3.31Å; T149-E153 PolarHBondContact O-N 2.75Å; H150-E153 PolarHBondContact O-N 2.91Å; Y151-E153 VanDerWaalsContact C-N 3.35Å; E153-S155 PolarHBondContact O-N 2.92Å; E153-S155 VanDerWaalsContact O-N 3.14Å; E153-V156 WeakPolarHBondContact O-CA 3.24Å; E153-V156 WeakPolarHBondContact O-CB 3.28Å; E153-V156 PolarHBondContact O-N 2.98Å; E153-E157 PolarHBondContact O-N 2.78Å; E153-E157 VanDerWaalsContact O-N 3.1Å; E153-K420 IonicContact OE1-NZ 3.36Å; E153-K420 PolarHBondContact OE1-NZ 3.14Å
154	A	98.3	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-53.5	-34.2	169	0	0	0	0	0	113.1	F76 V80 H150 E157 V158 F276	F76-A154 HydrophobicContact CE2-CB 4.28Å; F76-A154 HydrophobicContact CZ-CB 3.82Å; V80-A154 HydrophobicContact CG1-CB 4.24Å; V80-A154 HydrophobicContact CG2-CB 3.72Å; H150-A154 WeakPolarHBondContact O-CB 3.49Å; H150-A154 PolarHBondContact O-N 3.22Å; A154-E157 WeakPolarHBondContact CA-OE1 3.49Å; A154-V158 PolarHBondContact O-N 2.9Å; A154-F276 HydrophobicContact CB-CE2 3.78Å; A154-F276 HydrophobicContact CB-CZ 3.91Å
155	S	98.1	Very high	97.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-33.3	174.7	179.5	0	0	0	0	113	Y151 R152 E153 I159 R170 I173	Y151-S155 WeakPolarHBondContact O-CB 3.26Å; Y151-S155 PolarHBondContact O-N 3.36Å; Y151-S155 VanDerWaalsContact O-N 3.07Å; R152-S155 WeakPolarHBondContact O-CB 3.39Å; E153-S155 PolarHBondContact O-N 2.92Å; E153-S155 VanDerWaalsContact O-N 3.14Å; S155-I159 VanDerWaalsContact O-CB 3.31Å; S155-I159 WeakPolarHBondContact O-CB 3.49Å; S155-I159 WeakPolarHBondContact O-CG1 3.35Å; S155-I159 PolarHBondContact O-N 3.01Å; S155-I159 VanDerWaalsContact O-N 3.14Å; S155-R170 PolarHBondContact OG-NH2 3.47Å; S155-I173 WeakPolarHBondContact CB-O 3.34Å; S155-I173 PolarHBondContact OG-O 3.31Å
156	V	96.9	Very high	97.1	Very high	61 Å²	61	37.9 Å²	37.9	37%	0.37	19%	0.185	S	C	.	.	H	α-helix	trans	-69.1	-43.7	174	170	0	0	0	0	110.4	R152 E153 V158 I159 E160	R152-V156 WeakPolarHBondContact O-CG2 3.37Å; R152-V156 PolarHBondContact O-N 3.4Å; E153-V156 WeakPolarHBondContact O-CA 3.24Å; E153-V156 WeakPolarHBondContact O-CB 3.28Å; E153-V156 PolarHBondContact O-N 2.98Å; V156-V158 VanDerWaalsContact C-N 3.32Å; V156-V158 PolarHBondContact O-N 2.86Å; V156-I159 PolarHBondContact O-N 3.21Å; V156-I159 VanDerWaalsContact O-N 3.11Å; V156-E160 HydrophobicContact CG1-CG 4.12Å; V156-E160 VanDerWaalsContact CG1-OE1 3.24Å; V156-E160 WeakPolarHBondContact CG1-OE1 3.27Å; V156-E160 WeakPolarHBondContact O-CB 3.3Å; V156-E160 WeakPolarHBondContact O-CG 3.44Å; V156-E160 PolarHBondContact O-N 2.87Å
157	E	98	Very high	97	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-53	-47.5	176.4	-60.3	170.4	-132.1	0	0	112.3	R83 E153 A154 V161 T274	R83-E157 IonicContact CZ-OE1 3.43Å; R83-E157 IonicContact CZ-OE2 3.38Å; R83-E157 IonicContact NH1-OE1 3.6Å; R83-E157 IonicContact NH1-OE2 3.26Å; R83-E157 PolarHBondContact NH1-OE2 3.07Å; R83-E157 IonicContact NH2-OE1 2.76Å; R83-E157 PolarHBondContact NH2-OE1 3.05Å; R83-E157 IonicContact NH2-OE2 3.22Å; R83-E157 PolarHBondContact NH2-OE2 2.79Å; E153-E157 PolarHBondContact O-N 2.78Å; E153-E157 VanDerWaalsContact O-N 3.1Å; A154-E157 WeakPolarHBondContact CA-OE1 3.49Å; E157-V161 WeakPolarHBondContact O-CG2 3.43Å; E157-V161 PolarHBondContact O-N 2.99Å; E157-T274 HydrophobicContact CB-CG2 3.99Å
158	V	98.1	Very high	96.9	Very high	7 Å²	7	41 Å²	41	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-47.9	176.7	172.5	0	0	0	0	111.2	M73 A154 V156 E160 V161 M162 V270 T274 F276	M73-V158 HydrophobicContact CE-CG1 4.46Å; M73-V158 HydrophobicContact CE-CG2 3.88Å; M73-V158 HydrophobicContact CG-CG1 4.29Å; M73-V158 HydrophobicContact CG-CG2 4.41Å; M73-V158 HydrophobicContact SD-CB 4.46Å; M73-V158 HydrophobicContact SD-CG1 3.59Å; M73-V158 VanDerWaalsContact SD-CG1 3.59Å; M73-V158 HydrophobicContact SD-CG2 4.01Å; A154-V158 PolarHBondContact O-N 2.9Å; V156-V158 VanDerWaalsContact C-N 3.32Å; V156-V158 PolarHBondContact O-N 2.86Å; V158-E160 VanDerWaalsContact C-N 3.3Å; V158-E160 PolarHBondContact O-N 2.79Å; V158-V161 PolarHBondContact O-N 3.44Å; V158-V161 VanDerWaalsContact O-N 3.11Å; V158-M162 HydrophobicContact CG1-CG 4.26Å; V158-M162 HydrophobicContact CG1-SD 3.98Å; V158-M162 WeakPolarHBondContact O-CG 3.48Å; V158-M162 PolarHBondContact O-N 3.32Å; V158-V270 HydrophobicContact CG1-CG1 4.25Å; V158-V270 HydrophobicContact CG2-CG1 4.22Å; V158-T274 HydrophobicContact CG2-CG2 4.22Å; V158-F276 HydrophobicContact CG2-CD2 3.94Å
159	I	97.1	Very high	97	Very high	17 Å²	17	40 Å²	40	9%	0.087	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-35.4	-178.1	-74.8	-70.4	0	0	0	111.7	S155 V156 S163 I168 R170 A176 Q380	S155-I159 VanDerWaalsContact O-CB 3.31Å; S155-I159 WeakPolarHBondContact O-CB 3.49Å; S155-I159 WeakPolarHBondContact O-CG1 3.35Å; S155-I159 PolarHBondContact O-N 3.01Å; S155-I159 VanDerWaalsContact O-N 3.14Å; V156-I159 PolarHBondContact O-N 3.21Å; V156-I159 VanDerWaalsContact O-N 3.11Å; I159-S163 VanDerWaalsContact O-CB 3.3Å; I159-S163 WeakPolarHBondContact O-CB 3.49Å; I159-S163 PolarHBondContact O-N 2.89Å; I159-S163 PolarHBondContact O-OG 2.94Å; I159-I168 HydrophobicContact CD1-CD1 3.83Å; I159-I168 HydrophobicContact CG2-CD1 4.16Å; I159-R170 HydrophobicContact CD1-CB 4.01Å; I159-R170 HydrophobicContact CD1-CG 3.95Å; I159-A176 HydrophobicContact CD1-CB 3.87Å; I159-Q380 HydrophobicContact CG2-CB 3.95Å; I159-Q380 HydrophobicContact CG2-CG 4.12Å
160	E	96.1	Very high	96.9	Very high	116 Å²	116	39.7 Å²	39.7	54%	0.542	19%	0.193	S	C	.	.	H	α-helix	trans	-68.4	-32.2	173.6	-75.8	179	-170.4	0	0	113.4	V156 V158 R164	V156-E160 HydrophobicContact CG1-CG 4.12Å; V156-E160 VanDerWaalsContact CG1-OE1 3.24Å; V156-E160 WeakPolarHBondContact CG1-OE1 3.27Å; V156-E160 WeakPolarHBondContact O-CB 3.3Å; V156-E160 WeakPolarHBondContact O-CG 3.44Å; V156-E160 PolarHBondContact O-N 2.87Å; V158-E160 VanDerWaalsContact C-N 3.3Å; V158-E160 PolarHBondContact O-N 2.79Å; E160-R164 WeakPolarHBondContact O-CG 3.48Å; E160-R164 PolarHBondContact O-NE 2.97Å
161	V	97.6	Very high	96.9	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-74.7	-48.1	173.8	176.6	0	0	0	0	110.7	E157 V158 S163 R164 A269 V270 H273	E157-V161 WeakPolarHBondContact O-CG2 3.43Å; E157-V161 PolarHBondContact O-N 2.99Å; V158-V161 PolarHBondContact O-N 3.44Å; V158-V161 VanDerWaalsContact O-N 3.11Å; V161-S163 VanDerWaalsContact C-N 3.27Å; V161-S163 PolarHBondContact O-N 3.26Å; V161-R164 WeakPolarHBondContact O-CB 3.41Å; V161-R164 WeakPolarHBondContact O-CG 3.21Å; V161-R164 PolarHBondContact O-N 2.89Å; V161-A269 HydrophobicContact CG1-CB 3.97Å; V161-V270 HydrophobicContact CB-CG2 4.14Å; V161-V270 HydrophobicContact CG1-CG2 3.75Å; V161-H273 HydrophobicContact CG2-CB 3.77Å
162	M	97.1	Very high	96.8	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.02	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-38.9	178.5	-69.2	-176.3	66.6	0	0	112.7	V71 V158 R164 F165 I168 A176 M178 M266 V270	V71-M162 HydrophobicContact CB-CE 3.63Å; V71-M162 HydrophobicContact CB-SD 4.26Å; V71-M162 HydrophobicContact CG1-CE 4.37Å; V71-M162 HydrophobicContact CG1-SD 4.45Å; V71-M162 HydrophobicContact CG2-CE 3.68Å; V158-M162 HydrophobicContact CG1-CG 4.26Å; V158-M162 HydrophobicContact CG1-SD 3.98Å; V158-M162 WeakPolarHBondContact O-CG 3.48Å; V158-M162 PolarHBondContact O-N 3.32Å; M162-R164 PolarHBondContact O-N 3.19Å; M162-R164 VanDerWaalsContact O-N 3.08Å; M162-F165 PolarHBondContact O-N 2.82Å; M162-F165 VanDerWaalsContact O-N 3.15Å; M162-I168 HydrophobicContact CB-CD1 4Å; M162-A176 HydrophobicContact CE-CB 3.81Å; M162-A176 HydrophobicContact SD-CB 4.19Å; M162-M178 HydrophobicContact CB-CE 4.4Å; M162-M178 HydrophobicContact CE-CE 4.38Å; M162-M178 HydrophobicContact CE-CG 3.72Å; M162-M178 HydrophobicContact CE-SD 3.53Å; M162-M178 VanDerWaalsContact CE-SD 3.53Å; M162-M178 WeakPolarHBondContact O-CE 3.5Å; M162-M266 HydrophobicContact CB-SD 4.4Å; M162-M266 HydrophobicContact CE-SD 4.21Å; M162-M266 HydrophobicContact CG-SD 3.83Å; M162-V270 HydrophobicContact CG-CG2 4.27Å
163	S	96.1	Very high	96.7	Very high	35 Å²	35	40.8 Å²	40.8	25%	0.245	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.9	-178.4	-62.6	0	0	0	0	114.6	I159 V161 F165 I168 Q380	I159-S163 VanDerWaalsContact O-CB 3.3Å; I159-S163 WeakPolarHBondContact O-CB 3.49Å; I159-S163 PolarHBondContact O-N 2.89Å; I159-S163 PolarHBondContact O-OG 2.94Å; V161-S163 VanDerWaalsContact C-N 3.27Å; V161-S163 PolarHBondContact O-N 3.26Å; S163-F165 VanDerWaalsContact C-N 3.34Å; S163-I168 VanDerWaalsContact OG-CD1 3.28Å; S163-I168 WeakPolarHBondContact OG-CD1 3.46Å; S163-Q380 VanDerWaalsContact CB-NE2 3.32Å; S163-Q380 PolarHBondContact OG-NE2 2.99Å
164	R	96.7	Very high	96.7	Very high	149 Å²	149	39.8 Å²	39.8	56%	0.562	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.5	176.2	-55.5	173.6	-164.4	177.4	4	112.7	E160 V161 M162 H273	E160-R164 WeakPolarHBondContact O-CG 3.48Å; E160-R164 PolarHBondContact O-NE 2.97Å; V161-R164 WeakPolarHBondContact O-CB 3.41Å; V161-R164 WeakPolarHBondContact O-CG 3.21Å; V161-R164 PolarHBondContact O-N 2.89Å; M162-R164 PolarHBondContact O-N 3.19Å; M162-R164 VanDerWaalsContact O-N 3.08Å; R164-H273 PolarHBondContact NH1-CE1 3.41Å; R164-H273 PolarHBondContact NH1-NE2 3.1Å
165	F	96.3	Very high	96.7	Very high	57 Å²	57	41.8 Å²	41.8	25%	0.25	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-36	-173.9	-67.8	-96	0	0	0	113	M162 S163 M178 I262 E265 M266 A269	M162-F165 PolarHBondContact O-N 2.82Å; M162-F165 VanDerWaalsContact O-N 3.15Å; S163-F165 VanDerWaalsContact C-N 3.34Å; F165-M178 HydrophobicContact CB-CE 3.98Å; F165-I262 HydrophobicContact CD1-CG2 4.26Å; F165-E265 HydrophobicContact CE1-CB 4.08Å; F165-M266 HydrophobicContact CB-CG 4.42Å; F165-M266 HydrophobicContact CD1-CB 3.9Å; F165-M266 HydrophobicContact CD1-CG 4.41Å; F165-M266 HydrophobicContact CD2-CB 3.84Å; F165-M266 HydrophobicContact CD2-CG 3.48Å; F165-M266 VanDerWaalsContact CD2-CG 3.48Å; F165-M266 HydrophobicContact CE1-CB 3.92Å; F165-M266 HydrophobicContact CE2-CB 3.87Å; F165-M266 HydrophobicContact CE2-CG 3.74Å; F165-M266 HydrophobicContact CG-CB 3.86Å; F165-M266 HydrophobicContact CG-CG 3.86Å; F165-M266 HydrophobicContact CZ-CB 3.91Å; F165-M266 HydrophobicContact CZ-CG 4.32Å; F165-A269 HydrophobicContact CE2-CB 3.97Å; F165-A269 HydrophobicContact CZ-CB 3.82Å
166	A	95.6	Very high	96.7	Very high	20 Å²	20	41.7 Å²	41.7	17%	0.165	22%	0.218	C	C	.	.	S	Bend	trans	-161.6	173	-176.2	0	0	0	0	0	113.4	M178 D179 L180	A166-M178 HydrophobicContact CB-CB 4.34Å; A166-M178 HydrophobicContact CB-CE 4.02Å; A166-D179 WeakPolarHBondContact CB-O 3.47Å; A166-L180 HydrophobicContact CB-CD2 3.71Å
167	V	94.5	Very high	96.8	Very high	81 Å²	81	39 Å²	39	49%	0.491	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	129	165.2	174.2	0	0	0	0	109.5	M178 D179 P378	V167-M178 WeakPolarHBondContact O-CA 3.13Å; V167-D179 PolarHBondContact O-N 2.83Å; V167-D179 VanDerWaalsContact O-N 3.13Å; V167-P378 HydrophobicContact CG1-CB 3.68Å
168	I	96.5	Very high	96.8	Very high	3 Å²	3	36 Å²	36	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.9	-177	71.3	175.9	0	0	0	114.4	I159 M162 S163 Y177 M178 R379 Q380	I159-I168 HydrophobicContact CD1-CD1 3.83Å; I159-I168 HydrophobicContact CG2-CD1 4.16Å; M162-I168 HydrophobicContact CB-CD1 4Å; S163-I168 VanDerWaalsContact OG-CD1 3.28Å; S163-I168 WeakPolarHBondContact OG-CD1 3.46Å; I168-Y177 CarbonylContact C-O 3.6Å; I168-Y177 WeakPolarHBondContact CA-O 3.29Å; I168-Y177 VanDerWaalsContact CB-O 3.31Å; I168-Y177 WeakPolarHBondContact CB-O 3.48Å; I168-M178 HydrophobicContact CG2-CB 4.15Å; I168-M178 HydrophobicContact CG2-CE 3.94Å; I168-M178 HydrophobicContact CG2-CG 3.73Å; I168-R379 CarbonylContact O-C 3.4Å; I168-R379 PolarHBondContact O-N 3.35Å; I168-Q380 HydrophobicContact CD1-CG 4.09Å; I168-Q380 HydrophobicContact CG1-CG 3.83Å
169	E	97.8	Very high	96.8	Very high	17 Å²	17	37.8 Å²	37.8	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	107	165.9	-172.9	173.1	-174.4	0	0	110.2	A171 A176 Y177 K286 V376 K377 R379	E169-A171 PolarHBondContact O-N 3.48Å; E169-A171 VanDerWaalsContact O-N 3.16Å; E169-A176 CarbonylContact O-C 3.46Å; E169-A176 VanDerWaalsContact O-CA 3.32Å; E169-A176 WeakPolarHBondContact O-CA 3.32Å; E169-Y177 PolarHBondContact N-O 2.67Å; E169-Y177 PolarHBondContact O-N 2.59Å; E169-K286 IonicContact OE2-NZ 2.89Å; E169-K286 PolarHBondContact OE2-NZ 3.26Å; E169-V376 HydrophobicContact CB-CG1 3.71Å; E169-K377 WeakPolarHBondContact CA-O 3.33Å; E169-K377 WeakPolarHBondContact CB-O 3.3Å; E169-K377 HydrophobicContact CG-CB 4.32Å; E169-K377 WeakPolarHBondContact CG-O 3.36Å; E169-K377 PolarHBondContact OE2-N 3.02Å; E169-K377 VanDerWaalsContact OE2-N 3.08Å; E169-R379 IonicContact OE1-CZ 3.85Å; E169-R379 IonicContact OE1-NE 3.97Å; E169-R379 IonicContact OE1-NH2 3.32Å; E169-R379 PolarHBondContact OE1-NH2 2.96Å
170	R	96.3	Very high	96.9	Very high	29 Å²	29	37 Å²	37	11%	0.109	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	111.1	173.1	-178.2	-178.3	179.3	-176.1	9	110.3	S155 I159 S172 R379 Q380	S155-R170 PolarHBondContact OG-NH2 3.47Å; I159-R170 HydrophobicContact CD1-CB 4.01Å; I159-R170 HydrophobicContact CD1-CG 3.95Å; R170-S172 VanDerWaalsContact CG-O 3.22Å; R170-S172 WeakPolarHBondContact CG-O 3.47Å; R170-S172 PolarHBondContact NE-O 3.45Å; R170-R379 PolarHBondContact N-O 2.8Å; R170-R379 PolarHBondContact O-NH1 3.19Å; R170-R379 PolarHBondContact O-NH2 2.96Å; R170-Q380 WeakPolarHBondContact CB-O 3.24Å; R170-Q380 WeakPolarHBondContact CD-O 3.41Å
171	A	94.8	Very high	96.9	Very high	44 Å²	44	32.2 Å²	32.2	36%	0.364	17%	0.172	S	C	.	.			trans	-91.8	-35	-176.6	0	0	0	0	0	112.5	E169 E175 Y177	E169-A171 PolarHBondContact O-N 3.48Å; E169-A171 VanDerWaalsContact O-N 3.16Å; A171-E175 HydrophobicContact CB-CG 3.64Å; A171-E175 PolarHBondContact N-O 3.19Å; A171-Y177 HydrophobicContact CB-CD2 4.1Å; A171-Y177 HydrophobicContact CB-CE2 4.08Å
172	S	95.9	Very high	96.7	Very high	34 Å²	34	35.5 Å²	35.5	24%	0.238	20%	0.199	C	C	.	.	S	Bend	trans	-132.9	-153.1	177.8	74.7	0	0	0	0	112.1	R170 D174 E175	R170-S172 VanDerWaalsContact CG-O 3.22Å; R170-S172 WeakPolarHBondContact CG-O 3.47Å; R170-S172 PolarHBondContact NE-O 3.45Å; S172-D174 WeakPolarHBondContact CB-OD1 3.05Å; S172-D174 PolarHBondContact OG-N 2.76Å; S172-D174 PolarHBondContact OG-OD1 2.77Å; S172-E175 PolarHBondContact N-O 2.68Å; S172-E175 WeakPolarHBondContact OG-CB 3.3Å; S172-E175 VanDerWaalsContact OG-CG 3.3Å; S172-E175 WeakPolarHBondContact OG-CG 3.46Å; S172-E175 PolarHBondContact OG-N 3.01Å
173	I	96.5	Very high	96.6	Very high	39 Å²	39	36.6 Å²	36.6	20%	0.2	21%	0.209	C	C	.	.	S	Bend	trans	-87.5	-24	167.6	-162.9	170	0	0	0	111.8	F76 Y77 R152 S155	F76-I173 HydrophobicContact CD1-CG2 4.42Å; F76-I173 HydrophobicContact CE1-CG1 4.29Å; Y77-I173 HydrophobicContact CE1-CD1 4.09Å; Y77-I173 HydrophobicContact CE1-CG2 3.86Å; R152-I173 HydrophobicContact CG-CD1 3.95Å; S155-I173 WeakPolarHBondContact CB-O 3.34Å; S155-I173 PolarHBondContact OG-O 3.31Å
174	D	97.7	Very high	96.6	Very high	54 Å²	54	35 Å²	35	29%	0.289	20%	0.197	S	C	.	.	S	Bend	trans	-116.8	-7.5	-172.7	35.9	12.4	0	0	0	113.6	D72 M73 F76 S172	D72-D174 WeakPolarHBondContact CA-O 3.31Å; M73-D174 HydrophobicContact CB-CB 4.2Å; M73-D174 WeakPolarHBondContact CG-O 3.36Å; M73-D174 PolarHBondContact N-O 3Å; F76-D174 HydrophobicContact CB-CB 3.7Å; F76-D174 HydrophobicContact CD1-CB 3.74Å; F76-D174 HydrophobicContact CG-CB 3.85Å; S172-D174 WeakPolarHBondContact CB-OD1 3.05Å; S172-D174 PolarHBondContact OG-N 2.76Å; S172-D174 PolarHBondContact OG-OD1 2.77Å
175	E	97.5	Very high	96.4	Very high	41 Å²	41	32.4 Å²	32.4	19%	0.192	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.6	-174.4	100.2	-162.8	144.9	0	0	113.5	L70 V71 D72 A171 S172 K290	L70-E175 HydrophobicContact CD1-CG 4.28Å; V71-E175 WeakPolarHBondContact O-CA 3.25Å; D72-E175 HydrophobicContact CB-CB 4Å; A171-E175 HydrophobicContact CB-CG 3.64Å; A171-E175 PolarHBondContact N-O 3.19Å; S172-E175 PolarHBondContact N-O 2.68Å; S172-E175 WeakPolarHBondContact OG-CB 3.3Å; S172-E175 VanDerWaalsContact OG-CG 3.3Å; S172-E175 WeakPolarHBondContact OG-CG 3.46Å; S172-E175 PolarHBondContact OG-N 3.01Å; E175-K290 WeakPolarHBondContact OE2-CE 3.43Å; E175-K290 IonicContact OE2-NZ 3.98Å; E175-K290 PolarHBondContact OE2-NZ 3.13Å
176	A	98.3	Very high	96.2	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.7	171.2	0	0	0	0	0	112	L70 V71 I159 M162 E169	L70-A176 WeakPolarHBondContact CA-O 3.34Å; V71-A176 PolarHBondContact N-O 2.76Å; V71-A176 PolarHBondContact O-N 3.04Å; I159-A176 HydrophobicContact CD1-CB 3.87Å; M162-A176 HydrophobicContact CE-CB 3.81Å; M162-A176 HydrophobicContact SD-CB 4.19Å; E169-A176 CarbonylContact O-C 3.46Å; E169-A176 VanDerWaalsContact O-CA 3.32Å; E169-A176 WeakPolarHBondContact O-CA 3.32Å
177	Y	98.6	Very high	95.9	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	150.4	168	-70.6	-78.3	0	0	0	110.7	V68 A69 L70 I168 E169 A171 K286 R322	V68-Y177 HydrophobicContact CG1-CD1 4.18Å; A69-Y177 CarbonylContact O-C 3.55Å; A69-Y177 VanDerWaalsContact O-CA 3.3Å; A69-Y177 WeakPolarHBondContact O-CA 3.49Å; L70-Y177 HydrophobicContact CB-CD1 3.78Å; L70-Y177 HydrophobicContact CB-CE1 3.8Å; L70-Y177 HydrophobicContact CD1-CD1 3.8Å; L70-Y177 HydrophobicContact CD1-CD2 4.14Å; L70-Y177 HydrophobicContact CD1-CE1 3.36Å; L70-Y177 HydrophobicContact CD1-CE2 3.76Å; L70-Y177 HydrophobicContact CD1-CG 4.17Å; L70-Y177 HydrophobicContact CG-CD1 4.29Å; L70-Y177 HydrophobicContact CG-CE1 4.18Å; I168-Y177 CarbonylContact C-O 3.6Å; I168-Y177 WeakPolarHBondContact CA-O 3.29Å; I168-Y177 VanDerWaalsContact CB-O 3.31Å; I168-Y177 WeakPolarHBondContact CB-O 3.48Å; E169-Y177 PolarHBondContact N-O 2.67Å; E169-Y177 PolarHBondContact O-N 2.59Å; A171-Y177 HydrophobicContact CB-CD2 4.1Å; A171-Y177 HydrophobicContact CB-CE2 4.08Å; Y177-K286 HydrophobicContact CD1-CB 3.95Å; Y177-K286 HydrophobicContact CD1-CG 3.8Å; Y177-K286 VanDerWaalsContact CE1-CA 3.49Å; Y177-K286 HydrophobicContact CE1-CB 3.51Å; Y177-K286 HydrophobicContact CE1-CG 3.92Å; Y177-K286 WeakPolarHBondContact CE1-O 3.26Å; Y177-K286 HydrophobicContact CE2-CB 4.5Å; Y177-K286 HydrophobicContact CG-CG 4.2Å; Y177-K286 VanDerWaalsContact CZ-O 3.27Å; Y177-K286 PolarHBondContact OH-O 3.49Å; Y177-R322 PolarHBondContact OH-NH1 3.11Å
178	M	98.2	Very high	95.6	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.4	175.1	-42.7	-179.1	68.6	0	0	109.2	V68 A69 V71 M162 F165 A166 V167 I168 L180 M266	V68-M178 WeakPolarHBondContact CA-O 3.45Å; A69-M178 HydrophobicContact CB-CB 4.29Å; A69-M178 PolarHBondContact N-O 2.9Å; A69-M178 PolarHBondContact O-N 3.42Å; V71-M178 HydrophobicContact CG2-SD 3.9Å; M162-M178 HydrophobicContact CB-CE 4.4Å; M162-M178 HydrophobicContact CE-CE 4.38Å; M162-M178 HydrophobicContact CE-CG 3.72Å; M162-M178 HydrophobicContact CE-SD 3.53Å; M162-M178 VanDerWaalsContact CE-SD 3.53Å; M162-M178 WeakPolarHBondContact O-CE 3.5Å; F165-M178 HydrophobicContact CB-CE 3.98Å; A166-M178 HydrophobicContact CB-CB 4.34Å; A166-M178 HydrophobicContact CB-CE 4.02Å; V167-M178 WeakPolarHBondContact O-CA 3.13Å; I168-M178 HydrophobicContact CG2-CB 4.15Å; I168-M178 HydrophobicContact CG2-CE 3.94Å; I168-M178 HydrophobicContact CG2-CG 3.73Å; M178-L180 HydrophobicContact CB-CD2 3.86Å; M178-L180 HydrophobicContact CB-CG 4.36Å; M178-L180 HydrophobicContact CE-CD2 4.26Å; M178-L180 HydrophobicContact SD-CD2 4.49Å; M178-M266 HydrophobicContact CE-CG 4.33Å; M178-M266 HydrophobicContact CE-SD 3.84Å; M178-M266 HydrophobicContact SD-SD 3.49Å
179	D	98	Very high	95	Very high	45 Å²	45	42.6 Å²	42.6	24%	0.241	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	105.1	167.5	-153.8	-54.1	0	0	0	108.7	A166 V167 T181 V376	A166-D179 WeakPolarHBondContact CB-O 3.47Å; V167-D179 PolarHBondContact O-N 2.83Å; V167-D179 VanDerWaalsContact O-N 3.13Å; D179-T181 VanDerWaalsContact OD1-CB 3.27Å; D179-T181 WeakPolarHBondContact OD1-CB 3.45Å; D179-T181 PolarHBondContact OD1-N 3.11Å; D179-T181 PolarHBondContact OD1-OG1 2.84Å; D179-V376 HydrophobicContact CB-CB 4.02Å; D179-V376 HydrophobicContact CB-CG2 4.03Å
180	L	98.1	Very high	94.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.			trans	-91.4	-5.4	-175.6	-56	-177.2	0	0	0	112.3	V67 A69 A166 M178 A182 A183 V184 I262 V263	V67-L180 HydrophobicContact CB-CB 4.36Å; V67-L180 HydrophobicContact CG1-CB 4.11Å; V67-L180 HydrophobicContact CG1-CD1 4.44Å; V67-L180 PolarHBondContact O-N 3.1Å; A69-L180 HydrophobicContact CB-CD1 3.79Å; A69-L180 HydrophobicContact CB-CG 4.26Å; A166-L180 HydrophobicContact CB-CD2 3.71Å; M178-L180 HydrophobicContact CB-CD2 3.86Å; M178-L180 HydrophobicContact CB-CG 4.36Å; M178-L180 HydrophobicContact CE-CD2 4.26Å; M178-L180 HydrophobicContact SD-CD2 4.49Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.31Å; L180-A182 VanDerWaalsContact O-N 3.15Å; L180-A183 PolarHBondContact O-N 3.25Å; L180-V184 HydrophobicContact CB-CG2 4.12Å; L180-V184 WeakPolarHBondContact O-CG2 3.39Å; L180-V184 PolarHBondContact O-N 3.38Å; L180-I262 HydrophobicContact CD2-CG2 4.37Å; L180-V263 HydrophobicContact CD1-CG2 3.61Å
181	T	96.2	Very high	93.3	Very high	16 Å²	16	46.7 Å²	46.7	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-51.4	-45.2	-167.9	-47.5	0	0	0	0	112.9	R66 V67 D179 Q185	R66-T181 WeakPolarHBondContact CA-OG1 3.39Å; V67-T181 PolarHBondContact N-OG1 2.85Å; V67-T181 PolarHBondContact O-N 3.07Å; D179-T181 VanDerWaalsContact OD1-CB 3.27Å; D179-T181 WeakPolarHBondContact OD1-CB 3.45Å; D179-T181 PolarHBondContact OD1-N 3.11Å; D179-T181 PolarHBondContact OD1-OG1 2.84Å; T181-Q185 WeakPolarHBondContact O-CB 3.42Å; T181-Q185 VanDerWaalsContact O-CG 3.23Å; T181-Q185 WeakPolarHBondContact O-CG 3.17Å; T181-Q185 PolarHBondContact O-N 2.94Å
182	A	94.7	Very high	91.7	Very high	72 Å²	72	47.4 Å²	47.4	60%	0.595	25%	0.251	S	S	*	.	H	α-helix	trans	-70.2	-38	177.7	0	0	0	0	0	113.6	L180 Q185 Q186	L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.31Å; L180-A182 VanDerWaalsContact O-N 3.15Å; A182-Q185 PolarHBondContact O-N 3.11Å; A182-Q186 PolarHBondContact O-N 3.5Å
183	A	95.6	Very high	90	Very high	28 Å²	28	53.8 Å²	53.8	23%	0.231	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-36.6	178.6	0	0	0	0	0	111.7	L180 Q186 R187 I262	L180-A183 PolarHBondContact O-N 3.25Å; A183-Q186 PolarHBondContact O-N 3.46Å; A183-R187 PolarHBondContact O-N 2.86Å; A183-I262 HydrophobicContact CB-CD1 4.04Å
184	V	95.1	Very high	88.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-50.8	170.5	170.2	0	0	0	0	110.6	V67 L180 Q186 R187 C188 Q255 V258 I262	V67-V184 HydrophobicContact CB-CG2 4.21Å; V67-V184 HydrophobicContact CG1-CG2 4.17Å; V67-V184 HydrophobicContact CG2-CG1 4.32Å; V67-V184 HydrophobicContact CG2-CG2 4.28Å; L180-V184 HydrophobicContact CB-CG2 4.12Å; L180-V184 WeakPolarHBondContact O-CG2 3.39Å; L180-V184 PolarHBondContact O-N 3.38Å; V184-Q186 PolarHBondContact O-N 2.65Å; V184-Q186 VanDerWaalsContact O-N 3.13Å; V184-R187 PolarHBondContact O-N 3.05Å; V184-R187 VanDerWaalsContact O-N 3.12Å; V184-C188 WeakPolarHBondContact O-CB 3.46Å; V184-C188 PolarHBondContact O-N 3.48Å; V184-C188 PolarHBondContact O-SG 2.76Å; V184-Q255 HydrophobicContact CG1-CB 3.8Å; V184-Q255 HydrophobicContact CG1-CG 3.97Å; V184-Q255 WeakPolarHBondContact CG1-O 3.46Å; V184-V258 HydrophobicContact CG1-CB 4.25Å; V184-V258 HydrophobicContact CG1-CG1 4.24Å; V184-V258 HydrophobicContact CG2-CG1 4.43Å; V184-I262 HydrophobicContact CG2-CD1 3.98Å
185	Q	92.1	Very high	87.6	Confident	95 Å²	95	65.3 Å²	65.3	44%	0.444	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-21.8	176.5	-74	172.4	4	0	0	113.8	T181 A182 R189	T181-Q185 WeakPolarHBondContact O-CB 3.42Å; T181-Q185 VanDerWaalsContact O-CG 3.23Å; T181-Q185 WeakPolarHBondContact O-CG 3.17Å; T181-Q185 PolarHBondContact O-N 2.94Å; A182-Q185 PolarHBondContact O-N 3.11Å; Q185-R189 PolarHBondContact O-NE 2.88Å; Q185-R189 PolarHBondContact O-NH2 3Å
186	Q	91.4	Very high	87.1	Confident	118 Å²	118	64.6 Å²	64.6	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-75.8	-61.6	166	-174.4	170.5	-13	0	0	110.8	A182 A183 V184 C188 R189	A182-Q186 PolarHBondContact O-N 3.5Å; A183-Q186 PolarHBondContact O-N 3.46Å; V184-Q186 PolarHBondContact O-N 2.65Å; V184-Q186 VanDerWaalsContact O-N 3.13Å; Q186-C188 VanDerWaalsContact C-N 3.29Å; Q186-C188 PolarHBondContact O-N 2.86Å; Q186-R189 WeakPolarHBondContact O-CB 3.36Å; Q186-R189 PolarHBondContact O-N 3.15Å
187	R	91.1	Very high	86.7	Confident	79 Å²	79	67.1 Å²	67.1	30%	0.298	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-30.4	-173.1	-166.5	74.4	75.5	87.7	7.5	113.8	A183 V184 R189 D190 I191 V258 E265	A183-R187 PolarHBondContact O-N 2.86Å; V184-R187 PolarHBondContact O-N 3.05Å; V184-R187 VanDerWaalsContact O-N 3.12Å; R187-R189 VanDerWaalsContact C-N 3.26Å; R187-R189 PolarHBondContact O-N 2.84Å; R187-D190 WeakPolarHBondContact CA-OD2 3.16Å; R187-D190 PolarHBondContact O-N 3.31Å; R187-D190 VanDerWaalsContact O-N 3.11Å; R187-I191 HydrophobicContact CG-CD1 3.72Å; R187-I191 HydrophobicContact CG-CG1 4.32Å; R187-I191 WeakPolarHBondContact O-CB 3.44Å; R187-I191 WeakPolarHBondContact O-CG1 3.21Å; R187-I191 PolarHBondContact O-N 2.61Å; R187-V258 HydrophobicContact CB-CG1 3.73Å; R187-V258 HydrophobicContact CG-CG1 3.93Å; R187-E265 IonicContact CZ-OE1 3.41Å; R187-E265 IonicContact CZ-OE2 2.76Å; R187-E265 IonicContact NH1-OE1 2.62Å; R187-E265 PolarHBondContact NH1-OE1 2.56Å; R187-E265 IonicContact NH1-OE2 3.58Å; R187-E265 IonicContact NH2-OE1 2.75Å; R187-E265 PolarHBondContact NH2-OE1 2.93Å; R187-E265 VanDerWaalsContact NH2-OE1 3.15Å; R187-E265 IonicContact NH2-OE2 2.74Å; R187-E265 PolarHBondContact NH2-OE2 3.17Å
188	C	88.3	Confident	86.3	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.02	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-29.3	172.8	-68.9	0	0	0	0	113.2	V184 Q186 D190 I191 A192	V184-C188 WeakPolarHBondContact O-CB 3.46Å; V184-C188 PolarHBondContact O-N 3.48Å; V184-C188 PolarHBondContact O-SG 2.76Å; Q186-C188 VanDerWaalsContact C-N 3.29Å; Q186-C188 PolarHBondContact O-N 2.86Å; C188-D190 VanDerWaalsContact C-N 3.35Å; C188-I191 PolarHBondContact O-N 2.96Å; C188-A192 PolarHBondContact O-N 2.98Å
189	R	83.4	Confident	85.9	Confident	176 Å²	176	77.7 Å²	77.7	66%	0.664	39%	0.387	S	S	*	.	H	α-helix	trans	-74.1	-28.4	173.8	-72.3	176.9	-79.2	156.4	-4.1	112.1	Q185 Q186 R187	Q185-R189 PolarHBondContact O-NE 2.88Å; Q185-R189 PolarHBondContact O-NH2 3Å; Q186-R189 WeakPolarHBondContact O-CB 3.36Å; Q186-R189 PolarHBondContact O-N 3.15Å; R187-R189 VanDerWaalsContact C-N 3.26Å; R187-R189 PolarHBondContact O-N 2.84Å
190	D	79.5	Confident	85.7	Confident	103 Å²	103	80.1 Å²	80.1	55%	0.551	40%	0.399	S	S	*	.	H	α-helix	trans	-79.3	-21.6	175.5	-48.1	-39.9	0	0	0	112.3	R187 C188	R187-D190 WeakPolarHBondContact CA-OD2 3.16Å; R187-D190 PolarHBondContact O-N 3.31Å; R187-D190 VanDerWaalsContact O-N 3.11Å; C188-D190 VanDerWaalsContact C-N 3.35Å
191	I	78.2	Confident	85.6	Confident	29 Å²	29	80.1 Å²	80.1	15%	0.149	40%	0.399	C	S	.	.	H	α-helix	trans	-95.2	-9.4	-175.8	-75.1	174.2	0	0	0	113.3	R187 C188 D193 Q194 I196 V258 L261	R187-I191 HydrophobicContact CG-CD1 3.72Å; R187-I191 HydrophobicContact CG-CG1 4.32Å; R187-I191 WeakPolarHBondContact O-CB 3.44Å; R187-I191 WeakPolarHBondContact O-CG1 3.21Å; R187-I191 PolarHBondContact O-N 2.61Å; C188-I191 PolarHBondContact O-N 2.96Å; I191-D193 PolarHBondContact O-N 2.94Å; I191-Q194 PolarHBondContact O-N 2.86Å; I191-I196 HydrophobicContact CG2-CD1 4.45Å; I191-I196 HydrophobicContact CG2-CG1 4.15Å; I191-V258 HydrophobicContact CD1-CG1 4.36Å; I191-V258 HydrophobicContact CD1-CG2 3.89Å; I191-L261 HydrophobicContact CD1-CD1 4.08Å
192	A	60.8	Low	85.5	Confident	58 Å²	58	86 Å²	86	48%	0.479	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-37	-164.7	0	0	0	0	0	116.5	C188	C188-A192 PolarHBondContact O-N 2.98Å
193	D	60.1	Low	85.7	Confident	168 Å²	168	83.9 Å²	83.9	90%	0.898	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	4.5	-178.7	-54.9	-55.4	0	0	0	114.6	I191	I191-D193 PolarHBondContact O-N 2.94Å
194	Q	67.1	Low	85.8	Confident	145 Å²	145	82.6 Å²	82.6	68%	0.678	39%	0.388	S	S	*	.	S	Bend	trans	-121.5	128.8	-169.9	-63.4	-172.1	13.2	0	0	113.3	I191 I196	I191-Q194 PolarHBondContact O-N 2.86Å; Q194-I196 PolarHBondContact O-N 3.38Å
195	Q	78.3	Confident	86	Confident	190 Å²	190	83.7 Å²	83.7	89%	0.888	39%	0.393	S	S	*	.			trans	-65.1	132.5	168.4	-70.2	-174.4	-13.5	0	0	110.6	D197	Q195-D197 PolarHBondContact O-N 3.11Å
196	I	86.8	Confident	86.2	Confident	27 Å²	27	79.5 Å²	79.5	14%	0.138	37%	0.374	C	S	.	.			trans	-71.4	111.7	177	-64.2	174.6	0	0	0	109.2	I191 Q194 Q198 L201 L238 L254 T257 V258 L261	I191-I196 HydrophobicContact CG2-CD1 4.45Å; I191-I196 HydrophobicContact CG2-CG1 4.15Å; Q194-I196 PolarHBondContact O-N 3.38Å; I196-Q198 PolarHBondContact O-N 2.85Å; I196-L201 HydrophobicContact CG2-CD1 4.29Å; I196-L238 HydrophobicContact CB-CD2 4.09Å; I196-L238 HydrophobicContact CG2-CD2 4.05Å; I196-L254 HydrophobicContact CD1-CD1 3.73Å; I196-T257 HydrophobicContact CD1-CG2 3.76Å; I196-T257 HydrophobicContact CG2-CG2 4.31Å; I196-V258 HydrophobicContact CD1-CG2 3.9Å; I196-L261 HydrophobicContact CD1-CD1 4.22Å; I196-L261 HydrophobicContact CG1-CD1 4.4Å; I196-L261 HydrophobicContact CG2-CD1 4Å; I196-L261 HydrophobicContact CG2-CD2 4.1Å; I196-L261 HydrophobicContact CG2-CG 4.43Å
197	D	88.5	Confident	86.4	Confident	54 Å²	54	76.2 Å²	76.2	29%	0.289	36%	0.358	S	S	.	.			trans	-65.5	123	177.9	-177.1	-10.3	0	0	0	111.2	Q195 R199 L200	Q195-D197 PolarHBondContact O-N 3.11Å; D197-R199 PolarHBondContact O-N 3.19Å; D197-R199 WeakPolarHBondContact OD1-CB 3.29Å; D197-R199 VanDerWaalsContact OD1-CG 3.25Å; D197-R199 WeakPolarHBondContact OD1-CG 3.48Å; D197-R199 PolarHBondContact OD1-N 2.82Å; D197-R199 IonicContact OD1-NE 3.2Å; D197-R199 PolarHBondContact OD1-NE 3.08Å; D197-R199 IonicContact OD2-CZ 3.17Å; D197-R199 IonicContact OD2-NE 2.82Å; D197-R199 PolarHBondContact OD2-NE 2.88Å; D197-R199 IonicContact OD2-NH2 2.69Å; D197-R199 PolarHBondContact OD2-NH2 2.84Å; D197-L200 HydrophobicContact CB-CD1 4.29Å; D197-L200 HydrophobicContact CB-CG 4.21Å; D197-L200 WeakPolarHBondContact O-CB 3.38Å; D197-L200 PolarHBondContact O-N 3Å
198	Q	90.3	Very high	86.4	Confident	57 Å²	57	73.2 Å²	73.2	27%	0.266	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-50.7	-31.5	174.6	-168.1	-165.8	20.6	0	0	112.5	I196 L200 L201 S231 V234 L238	I196-Q198 PolarHBondContact O-N 2.85Å; Q198-L200 PolarHBondContact O-N 2.84Å; Q198-L200 VanDerWaalsContact O-N 3.13Å; Q198-L201 PolarHBondContact O-N 3.31Å; Q198-S231 PolarHBondContact NE2-O 3.27Å; Q198-S231 PolarHBondContact NE2-OG 2.88Å; Q198-S231 VanDerWaalsContact NE2-OG 3.07Å; Q198-V234 HydrophobicContact CG-CG1 3.99Å; Q198-L238 HydrophobicContact CB-CD1 3.94Å; Q198-L238 HydrophobicContact CG-CD1 4.31Å
199	R	91.1	Very high	86.6	Confident	169 Å²	169	75.2 Å²	75.2	64%	0.638	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-69.2	-1.7	177.1	-56.4	176.7	-61.1	178.6	2.3	113.7	D197 R202	D197-R199 PolarHBondContact O-N 3.19Å; D197-R199 WeakPolarHBondContact OD1-CB 3.29Å; D197-R199 VanDerWaalsContact OD1-CG 3.25Å; D197-R199 WeakPolarHBondContact OD1-CG 3.48Å; D197-R199 PolarHBondContact OD1-N 2.82Å; D197-R199 IonicContact OD1-NE 3.2Å; D197-R199 PolarHBondContact OD1-NE 3.08Å; D197-R199 IonicContact OD2-CZ 3.17Å; D197-R199 IonicContact OD2-NE 2.82Å; D197-R199 PolarHBondContact OD2-NE 2.88Å; D197-R199 IonicContact OD2-NH2 2.69Å; D197-R199 PolarHBondContact OD2-NH2 2.84Å; R199-R202 VanDerWaalsContact O-CG 3.25Å; R199-R202 WeakPolarHBondContact O-CG 3.42Å; R199-R202 PolarHBondContact O-NE 3.37Å; R199-R202 PolarHBondContact O-NH2 2.91Å
200	L	93.7	Very high	86.9	Confident	96 Å²	96	67.7 Å²	67.7	50%	0.503	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-92.5	-26.2	168.4	-57.8	174.7	0	0	0	112.1	D197 Q198 R202 L261	D197-L200 HydrophobicContact CB-CD1 4.29Å; D197-L200 HydrophobicContact CB-CG 4.21Å; D197-L200 WeakPolarHBondContact O-CB 3.38Å; D197-L200 PolarHBondContact O-N 3Å; Q198-L200 PolarHBondContact O-N 2.84Å; Q198-L200 VanDerWaalsContact O-N 3.13Å; L200-R202 PolarHBondContact O-N 3.26Å; L200-L261 HydrophobicContact CB-CD2 3.45Å; L200-L261 VanDerWaalsContact CB-CD2 3.45Å; L200-L261 HydrophobicContact CD1-CD2 4.12Å; L200-L261 HydrophobicContact CG-CD2 4.44Å
201	L	95.9	Very high	86.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.33	C	S	.	.			trans	-97.9	46.9	-177.6	-66.9	172.8	0	0	0	111.6	I196 Q198 T203 T204 R230 V234 L238 T257 A260 L261 E264	I196-L201 HydrophobicContact CG2-CD1 4.29Å; Q198-L201 PolarHBondContact O-N 3.31Å; L201-T203 VanDerWaalsContact C-N 3.33Å; L201-T203 PolarHBondContact O-N 2.62Å; L201-T204 HydrophobicContact CD2-CG2 4.36Å; L201-T204 PolarHBondContact O-N 3.03Å; L201-R230 PolarHBondContact O-NH1 3.25Å; L201-V234 HydrophobicContact CB-CG1 4.08Å; L201-V234 HydrophobicContact CD1-CG1 4.04Å; L201-L238 HydrophobicContact CD1-CD1 4.44Å; L201-L238 HydrophobicContact CD1-CD2 4.15Å; L201-T257 HydrophobicContact CD1-CG2 3.89Å; L201-A260 HydrophobicContact CD2-CB 3.82Å; L201-L261 HydrophobicContact CD2-CD2 3.68Å; L201-L261 HydrophobicContact CD2-CG 4.16Å; L201-L261 HydrophobicContact CG-CD2 3.86Å; L201-E264 VanDerWaalsContact C-OE1 3.29Å
202	R	94.3	Very high	86.3	Confident	139 Å²	139	70.9 Å²	70.9	53%	0.525	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-25.9	-167.5	-60.9	-172.6	-172.8	179.4	1.5	115.1	R199 L200 R230 E264	R199-R202 VanDerWaalsContact O-CG 3.25Å; R199-R202 WeakPolarHBondContact O-CG 3.42Å; R199-R202 PolarHBondContact O-NE 3.37Å; R199-R202 PolarHBondContact O-NH2 2.91Å; L200-R202 PolarHBondContact O-N 3.26Å; R202-R230 PolarHBondContact O-NE 2.75Å; R202-R230 PolarHBondContact O-NH2 3.31Å; R202-R230 VanDerWaalsContact O-NH2 3.12Å; R202-E264 PolarHBondContact N-OE1 2.86Å
203	T	97.4	Very high	86.1	Confident	28 Å²	28	76.1 Å²	76.1	17%	0.172	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	5.4	-178.7	77.3	0	0	0	0	112.2	L201 E264 R267 R300 Q301	L201-T203 VanDerWaalsContact C-N 3.33Å; L201-T203 PolarHBondContact O-N 2.62Å; T203-E264 PolarHBondContact N-OE1 2.83Å; T203-E264 VanDerWaalsContact OG1-CD 3.31Å; T203-E264 PolarHBondContact OG1-OE1 2.91Å; T203-E264 PolarHBondContact OG1-OE2 3.14Å; T203-R267 PolarHBondContact OG1-NH1 3.36Å; T203-R267 PolarHBondContact OG1-NH2 3.03Å; T203-R300 WeakPolarHBondContact O-CB 3.45Å; T203-R300 WeakPolarHBondContact O-CD 3.47Å; T203-Q301 PolarHBondContact O-N 3.26Å
204	T	98.5	Very high	85.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.7	-179.2	-61.7	0	0	0	0	111.5	L201 I206 R230 V234 A260 E264 Q301 I303	L201-T204 HydrophobicContact CD2-CG2 4.36Å; L201-T204 PolarHBondContact O-N 3.03Å; T204-I206 HydrophobicContact CG2-CD1 3.95Å; T204-R230 VanDerWaalsContact O-CD 3.27Å; T204-R230 WeakPolarHBondContact O-CD 3.22Å; T204-R230 WeakPolarHBondContact O-CG 3.32Å; T204-R230 PolarHBondContact O-NH1 3.33Å; T204-V234 VanDerWaalsContact O-CG2 3.23Å; T204-V234 WeakPolarHBondContact O-CG2 3.31Å; T204-A260 HydrophobicContact CG2-CB 4.29Å; T204-E264 PolarHBondContact N-OE1 3.27Å; T204-E264 PolarHBondContact OG1-OE1 3.11Å; T204-Q301 CarbonylContact C-O 3.59Å; T204-Q301 WeakPolarHBondContact CA-O 3.12Å; T204-Q301 HydrophobicContact CG2-CG 4.44Å; T204-Q301 VanDerWaalsContact OG1-CG 3.26Å; T204-Q301 WeakPolarHBondContact OG1-CG 3.4Å; T204-Q301 PolarHBondContact OG1-NE2 2.76Å; T204-I303 HydrophobicContact CG2-CD1 4.15Å; T204-I303 HydrophobicContact CG2-CG1 3.89Å
205	H	98.3	Very high	84.7	Confident	23 Å²	23	72.4 Å²	72.4	11%	0.106	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	154.4	165.8	-65.4	64.5	0	0	0	108.8	R230 N296 Q301 T302 I303	H205-R230 HydrophobicContact CB-CG 4.48Å; H205-R230 WeakPolarHBondContact CE1-CD 3.23Å; H205-N296 WeakPolarHBondContact CB-ND2 3.31Å; H205-N296 VanDerWaalsContact CD2-CG 3.48Å; H205-N296 PolarHBondContact CD2-OD1 3.42Å; H205-Q301 PolarHBondContact N-O 2.87Å; H205-T302 HydrophobicContact CB-CG2 4.14Å; H205-T302 CarbonylContact O-C 3.59Å; H205-T302 WeakPolarHBondContact O-CA 3.46Å; H205-I303 PolarHBondContact O-N 3.09Å
206	I	97.5	Very high	83.4	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.9	174.2	-43.5	-66.6	0	0	0	107.4	T204 G208 Y209 V234 W237 I303 P305	T204-I206 HydrophobicContact CG2-CD1 3.95Å; I206-G208 PolarHBondContact O-N 3.08Å; I206-Y209 HydrophobicContact CB-CD2 4.2Å; I206-Y209 HydrophobicContact CB-CG 4.35Å; I206-Y209 HydrophobicContact CG2-CD2 3.56Å; I206-Y209 HydrophobicContact CG2-CE2 4.11Å; I206-Y209 HydrophobicContact CG2-CG 4.14Å; I206-Y209 PolarHBondContact O-N 3.2Å; I206-V234 HydrophobicContact CD1-CG2 4.38Å; I206-V234 HydrophobicContact CG1-CG2 4.02Å; I206-W237 HydrophobicContact CB-CB 4.38Å; I206-W237 HydrophobicContact CB-CG 4.44Å; I206-W237 HydrophobicContact CD1-CB 4.38Å; I206-W237 HydrophobicContact CD1-CD2 4.36Å; I206-W237 HydrophobicContact CD1-CG 3.9Å; I206-W237 HydrophobicContact CG1-CB 3.8Å; I206-W237 HydrophobicContact CG1-CD2 4.42Å; I206-W237 HydrophobicContact CG1-CG 3.82Å; I206-W237 HydrophobicContact CG2-CB 4.18Å; I206-W237 HydrophobicContact CG2-CD2 3.66Å; I206-W237 HydrophobicContact CG2-CE3 3.65Å; I206-W237 HydrophobicContact CG2-CG 3.92Å; I206-W237 HydrophobicContact CG2-CZ3 4.24Å; I206-I303 HydrophobicContact CD1-CB 3.93Å; I206-I303 HydrophobicContact CD1-CD1 3.6Å; I206-I303 HydrophobicContact CD1-CG1 3.87Å; I206-P305 HydrophobicContact CG2-CG 4.27Å
207	Q	96.1	Very high	81.7	Confident	49 Å²	49	69 Å²	69	23%	0.229	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	131.5	-178.6	-177.2	55.9	41.5	0	0	111	L295 T302 I303 L304 S308 L312	Q207-L295 HydrophobicContact CG-CD1 4.33Å; Q207-T302 HydrophobicContact CB-CG2 4.4Å; Q207-I303 PolarHBondContact N-O 3.32Å; Q207-L304 HydrophobicContact CB-CD1 3.89Å; Q207-L304 HydrophobicContact CG-CD1 3.87Å; Q207-S308 VanDerWaalsContact O-CB 3.29Å; Q207-S308 WeakPolarHBondContact O-CB 3.22Å; Q207-S308 PolarHBondContact O-OG 3.24Å; Q207-L312 HydrophobicContact CG-CD2 4.31Å
208	G	91.5	Very high	79.8	Confident	16 Å²	16	76.1 Å²	76.1	17%	0.165	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	2.9	-173.3	0	0	0	0	0	114.3	I206	I206-G208 PolarHBondContact O-N 3.08Å
209	Y	91.9	Very high	78.2	Confident	45 Å²	45	77.3 Å²	77.3	18%	0.176	39%	0.394	C	S	.	.			trans	-127.5	144.7	-179.6	-69.4	-104.7	0	0	0	111.6	I206 F211 Q236 W237	I206-Y209 HydrophobicContact CB-CD2 4.2Å; I206-Y209 HydrophobicContact CB-CG 4.35Å; I206-Y209 HydrophobicContact CG2-CD2 3.56Å; I206-Y209 HydrophobicContact CG2-CE2 4.11Å; I206-Y209 HydrophobicContact CG2-CG 4.14Å; I206-Y209 PolarHBondContact O-N 3.2Å; Y209-F211 HydrophobicContact CD1-CD2 4.37Å; Y209-F211 HydrophobicContact CD1-CE2 4.15Å; Y209-F211 HydrophobicContact CD1-CZ 4.33Å; Y209-F211 HydrophobicContact CE1-CD2 4.08Å; Y209-F211 HydrophobicContact CE1-CE1 4.19Å; Y209-F211 AromaticContact CE1-CE2 3.43Å; Y209-F211 HydrophobicContact CE1-CE2 3.43Å; Y209-F211 VanDerWaalsContact CE1-CE2 3.43Å; Y209-F211 AromaticContact CE1-CZ 3.5Å; Y209-F211 HydrophobicContact CE1-CZ 3.5Å; Y209-F211 HydrophobicContact CE2-CE1 4.31Å; Y209-F211 HydrophobicContact CE2-CZ 4.17Å; Y209-F211 AromaticContact CZ-CE1 3.97Å; Y209-F211 AromaticContact CZ-CE2 3.84Å; Y209-F211 AromaticContact CZ-CZ 3.39Å; Y209-F211 VanDerWaalsContact OH-CZ 3.31Å; Y209-F211 WeakPolarHBondContact OH-CZ 3.27Å; Y209-Q236 HydrophobicContact CD1-CB 3.96Å; Y209-Q236 HydrophobicContact CE1-CB 4.42Å; Y209-W237 HydrophobicContact CD1-CB 4.29Å; Y209-W237 HydrophobicContact CD2-CE3 4.27Å; Y209-W237 HydrophobicContact CE1-CB 4.36Å; Y209-W237 HydrophobicContact CE1-CE3 4.36Å; Y209-W237 AromaticContact CE2-CE3 3.6Å; Y209-W237 HydrophobicContact CE2-CE3 3.6Å; Y209-W237 HydrophobicContact CE2-CZ3 4.04Å; Y209-W237 AromaticContact CZ-CE3 3.66Å
210	P	88.6	Confident	76.5	Confident	19 Å²	19	74.2 Å²	74.2	12%	0.123	39%	0.39	C	S	.	.	S	Bend	cis	-66.2	155.1	-3.6	30.5	-36.3	0	0	0	112.5	A212 R229 R232	P210-A212 PolarHBondContact O-N 3.04Å; P210-R229 HydrophobicContact CG-CG 3.88Å; P210-R232 HydrophobicContact CB-CG 4.01Å
211	F	80.9	Confident	74.6	Confident	106 Å²	106	71.2 Å²	71.2	47%	0.465	38%	0.375	S	S	.	.			trans	-68.5	125	179.5	-70.7	-59.5	0	0	0	111	Y209 H213 D214 Q236	Y209-F211 HydrophobicContact CD1-CD2 4.37Å; Y209-F211 HydrophobicContact CD1-CE2 4.15Å; Y209-F211 HydrophobicContact CD1-CZ 4.33Å; Y209-F211 HydrophobicContact CE1-CD2 4.08Å; Y209-F211 HydrophobicContact CE1-CE1 4.19Å; Y209-F211 AromaticContact CE1-CE2 3.43Å; Y209-F211 HydrophobicContact CE1-CE2 3.43Å; Y209-F211 VanDerWaalsContact CE1-CE2 3.43Å; Y209-F211 AromaticContact CE1-CZ 3.5Å; Y209-F211 HydrophobicContact CE1-CZ 3.5Å; Y209-F211 HydrophobicContact CE2-CE1 4.31Å; Y209-F211 HydrophobicContact CE2-CZ 4.17Å; Y209-F211 AromaticContact CZ-CE1 3.97Å; Y209-F211 AromaticContact CZ-CE2 3.84Å; Y209-F211 AromaticContact CZ-CZ 3.39Å; Y209-F211 VanDerWaalsContact OH-CZ 3.31Å; Y209-F211 WeakPolarHBondContact OH-CZ 3.27Å; F211-H213 PolarHBondContact O-N 2.74Å; F211-D214 PolarHBondContact O-N 2.91Å; F211-Q236 VanDerWaalsContact N-OE1 3.13Å
212	A	65.5	Low	72.7	Confident	92 Å²	92	75.6 Å²	75.6	76%	0.76	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-0.6	-179.1	0	0	0	0	0	115.6	P210	P210-A212 PolarHBondContact O-N 3.04Å
213	H	54.8	Low	71.2	Confident	169 Å²	169	72.9 Å²	72.9	78%	0.782	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	28.7	-176.4	-83	-69.1	0	0	0	113.5	F211 E215	F211-H213 PolarHBondContact O-N 2.74Å; H213-E215 VanDerWaalsContact C-N 3.27Å; H213-E215 PolarHBondContact O-N 2.7Å
214	D	51	Low	70	Confident	51 Å²	51	73.3 Å²	73.3	27%	0.273	41%	0.413	S	S	.	.			trans	-78.9	69.8	173.5	-168.5	0.3	0	0	0	111.9	F211 S216 S217 R232 Q236	F211-D214 PolarHBondContact O-N 2.91Å; D214-S216 PolarHBondContact O-N 3.01Å; D214-S216 WeakPolarHBondContact OD1-CB 3.34Å; D214-S216 PolarHBondContact OD1-OG 2.8Å; D214-S217 PolarHBondContact O-N 3.22Å; D214-S217 PolarHBondContact O-OG 3.48Å; D214-R232 IonicContact OD2-CZ 3.02Å; D214-R232 IonicContact OD2-NH2 3.54Å; D214-R232 PolarHBondContact OD2-NH2 2.62Å; D214-Q236 PolarHBondContact OD2-NE2 2.69Å
215	E	47.8	Very low	69.4	Low	184 Å²	184	77.5 Å²	77.5	86%	0.86	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.9	178.9	-68.7	-166.3	161.4	0	0	113.8	H213 S217	H213-E215 VanDerWaalsContact C-N 3.27Å; H213-E215 PolarHBondContact O-N 2.7Å; E215-S217 PolarHBondContact O-N 3.19Å
216	S	51.3	Low	68.9	Low	107 Å²	107	80 Å²	80	75%	0.748	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.2	174.5	83.3	0	0	0	0	113.4	D214	D214-S216 PolarHBondContact O-N 3.01Å; D214-S216 WeakPolarHBondContact OD1-CB 3.34Å; D214-S216 PolarHBondContact OD1-OG 2.8Å
217	S	51	Low	68.6	Low	37 Å²	37	82.8 Å²	82.8	26%	0.259	46%	0.459	S	S	.	.			trans	-112.5	110.9	-170.7	64.2	0	0	0	0	112.5	D214 E215 V219 R232	D214-S217 PolarHBondContact O-N 3.22Å; D214-S217 PolarHBondContact O-OG 3.48Å; E215-S217 PolarHBondContact O-N 3.19Å; S217-V219 PolarHBondContact O-N 2.89Å; S217-R232 PolarHBondContact OG-NH2 3.44Å
218	Q	48.5	Very low	68.4	Low	205 Å²	205	85.5 Å²	85.5	96%	0.958	47%	0.472	S	S	*	.			trans	-74.9	27.7	178.8	-62.5	-173.7	-15	0	0	113.9
219	V	55.5	Low	68.4	Low	82 Å²	82	88.2 Å²	88.2	50%	0.497	48%	0.477	S	S	.	.	S	Bend	trans	-115.2	116.6	-178	-176.4	0	0	0	0	108.3	S217 D221 L224	S217-V219 PolarHBondContact O-N 2.89Å; V219-D221 PolarHBondContact O-N 2.8Å; V219-L224 HydrophobicContact CG1-CD2 3.98Å; V219-L224 HydrophobicContact CG1-CG 4.42Å
220	D	56.3	Low	68.5	Low	103 Å²	103	87 Å²	87	55%	0.551	47%	0.472	S	S	*	.			trans	-61	107.9	174.2	-177.6	-13.5	0	0	0	109.9	S222 A223	D220-S222 PolarHBondContact O-N 3.35Å; D220-S222 VanDerWaalsContact O-N 3.09Å; D220-S222 WeakPolarHBondContact OD1-CA 3.48Å; D220-S222 WeakPolarHBondContact OD1-CB 3.31Å; D220-S222 PolarHBondContact OD1-N 3.2Å; D220-S222 PolarHBondContact OD1-OG 3.33Å; D220-S222 PolarHBondContact OD2-OG 3.39Å; D220-A223 HydrophobicContact CB-CB 4.26Å; D220-A223 WeakPolarHBondContact O-CB 3.15Å; D220-A223 PolarHBondContact O-N 2.99Å
221	D	54.1	Low	68.8	Low	34 Å²	34	88 Å²	88	18%	0.182	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.8	-179.8	-102.9	-21	0	0	0	112.9	V219 L224 R229 R232	V219-D221 PolarHBondContact O-N 2.8Å; D221-L224 WeakPolarHBondContact OD1-CD1 3.3Å; D221-R229 VanDerWaalsContact O-CZ 3.27Å; D221-R229 PolarHBondContact O-NE 2.94Å; D221-R229 PolarHBondContact O-NH2 2.83Å; D221-R232 IonicContact OD1-CZ 2.93Å; D221-R232 IonicContact OD1-NH1 2.66Å; D221-R232 PolarHBondContact OD1-NH1 2.96Å; D221-R232 IonicContact OD2-CZ 2.69Å; D221-R232 IonicContact OD2-NH1 3.82Å; D221-R232 PolarHBondContact OD2-NH1 2.76Å
222	S	56.6	Low	69.4	Low	92 Å²	92	84.9 Å²	84.9	64%	0.643	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-26.3	168.7	79.4	0	0	0	0	112.9	D220 R229	D220-S222 PolarHBondContact O-N 3.35Å; D220-S222 VanDerWaalsContact O-N 3.09Å; D220-S222 WeakPolarHBondContact OD1-CA 3.48Å; D220-S222 WeakPolarHBondContact OD1-CB 3.31Å; D220-S222 PolarHBondContact OD1-N 3.2Å; D220-S222 PolarHBondContact OD1-OG 3.33Å; D220-S222 PolarHBondContact OD2-OG 3.39Å; S222-R229 PolarHBondContact O-NH2 3.44Å
223	A	63	Low	70.8	Confident	81 Å²	81	80.6 Å²	80.6	67%	0.669	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-14.1	-179.4	0	0	0	0	0	114.1	D220	D220-A223 HydrophobicContact CB-CB 4.26Å; D220-A223 WeakPolarHBondContact O-CB 3.15Å; D220-A223 PolarHBondContact O-N 2.99Å
224	L	70.8	Confident	72.7	Confident	38 Å²	38	72.5 Å²	72.5	20%	0.199	39%	0.392	C	S	.	.	S	Bend	trans	-68.8	145.3	175.2	-67.1	-172.2	0	0	0	112.5	V219 D221 Q228 R229	V219-L224 HydrophobicContact CG1-CD2 3.98Å; V219-L224 HydrophobicContact CG1-CG 4.42Å; D221-L224 WeakPolarHBondContact OD1-CD1 3.3Å; L224-Q228 HydrophobicContact CB-CB 4.3Å; L224-R229 PolarHBondContact O-NH1 3.33Å; L224-R229 PolarHBondContact O-NH2 3.08Å
225	D	86.1	Confident	74.8	Confident	87 Å²	87	75.8 Å²	75.8	47%	0.465	41%	0.406	S	S	.	.			trans	-64	157	166.7	175.2	59.1	0	0	0	111.7	E227 Q228 R229	D225-E227 VanDerWaalsContact C-N 3.34Å; D225-E227 PolarHBondContact O-N 2.79Å; D225-E227 WeakPolarHBondContact OD2-CB 3.4Å; D225-E227 PolarHBondContact OD2-N 3.19Å; D225-Q228 HydrophobicContact CB-CB 4.31Å; D225-Q228 HydrophobicContact CB-CG 4.02Å; D225-Q228 WeakPolarHBondContact O-CB 3.1Å; D225-Q228 PolarHBondContact O-N 3.15Å; D225-R229 WeakPolarHBondContact O-CB 3.42Å; D225-R229 PolarHBondContact O-N 3.17Å
226	K	87.8	Confident	77	Confident	76 Å²	76	68.9 Å²	68.9	33%	0.33	37%	0.373	S	S	.	.	H	α-helix	trans	-58.7	-41.6	-179.3	-152	176.7	-162.9	161.5	0	112.5	R230 E690 E693	K226-R230 WeakPolarHBondContact O-CB 3.46Å; K226-R230 PolarHBondContact O-N 2.74Å; K226-E690 WeakPolarHBondContact CD-OE1 3.43Å; K226-E690 VanDerWaalsContact CE-OE1 3.31Å; K226-E690 WeakPolarHBondContact CE-OE1 3.26Å; K226-E690 IonicContact NZ-OE1 2.79Å; K226-E690 PolarHBondContact NZ-OE1 3.05Å; K226-E693 IonicContact NZ-OE1 3.43Å; K226-E693 IonicContact NZ-OE2 2.75Å; K226-E693 PolarHBondContact NZ-OE2 3.42Å
227	E	92.1	Very high	79	Confident	66 Å²	66	64 Å²	64	31%	0.308	34%	0.339	S	S	.	.	H	α-helix	trans	-74.5	-33.1	178.7	-173	57.2	-137.2	0	0	111.4	D225 R230 S231 R300	D225-E227 VanDerWaalsContact C-N 3.34Å; D225-E227 PolarHBondContact O-N 2.79Å; D225-E227 WeakPolarHBondContact OD2-CB 3.4Å; D225-E227 PolarHBondContact OD2-N 3.19Å; E227-R230 IonicContact OE1-CZ 3.75Å; E227-R230 IonicContact OE1-NE 2.81Å; E227-R230 PolarHBondContact OE1-NE 2.91Å; E227-R230 IonicContact OE1-NH2 2.77Å; E227-R230 PolarHBondContact OE1-NH2 2.94Å; E227-R230 IonicContact OE2-NE 2.77Å; E227-R230 PolarHBondContact OE2-NE 2.64Å; E227-S231 VanDerWaalsContact O-CB 3.27Å; E227-S231 WeakPolarHBondContact O-CB 3.18Å; E227-S231 PolarHBondContact O-N 3.05Å; E227-R300 IonicContact OE2-CZ 3.14Å; E227-R300 IonicContact OE2-NE 2.73Å; E227-R300 IonicContact OE2-NH2 2.71Å; E227-R300 PolarHBondContact OE2-NH2 3.22Å
228	Q	91.4	Very high	81	Confident	106 Å²	106	63.9 Å²	63.9	50%	0.495	34%	0.335	S	S	.	.	H	α-helix	trans	-64.1	-47	171.1	-67.3	175.1	-22.3	0	0	111.6	L224 D225 S231 R232	L224-Q228 HydrophobicContact CB-CB 4.3Å; D225-Q228 HydrophobicContact CB-CB 4.31Å; D225-Q228 HydrophobicContact CB-CG 4.02Å; D225-Q228 WeakPolarHBondContact O-CB 3.1Å; D225-Q228 PolarHBondContact O-N 3.15Å; Q228-S231 WeakPolarHBondContact O-CB 3.25Å; Q228-S231 PolarHBondContact O-N 3.13Å; Q228-R232 PolarHBondContact O-N 2.82Å
229	R	91.1	Very high	83.1	Confident	73 Å²	73	58.3 Å²	58.3	28%	0.275	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-43.4	177.3	-168.9	-179.4	-63.4	93.7	1.1	111.4	P210 D221 S222 L224 D225 R232 G233	P210-R229 HydrophobicContact CG-CG 3.88Å; D221-R229 VanDerWaalsContact O-CZ 3.27Å; D221-R229 PolarHBondContact O-NE 2.94Å; D221-R229 PolarHBondContact O-NH2 2.83Å; S222-R229 PolarHBondContact O-NH2 3.44Å; L224-R229 PolarHBondContact O-NH1 3.33Å; L224-R229 PolarHBondContact O-NH2 3.08Å; D225-R229 WeakPolarHBondContact O-CB 3.42Å; D225-R229 PolarHBondContact O-N 3.17Å; R229-R232 PolarHBondContact O-N 2.89Å; R229-G233 PolarHBondContact O-N 2.88Å
230	R	95.3	Very high	84.7	Confident	20 Å²	20	57.3 Å²	57.3	8%	0.075	32%	0.32	C	S	.	.	H	α-helix	trans	-57.7	-49.3	171.6	-173.4	-158.3	73.5	69.7	4	111.5	L201 R202 T204 H205 K226 E227 G233 V234	L201-R230 PolarHBondContact O-NH1 3.25Å; R202-R230 PolarHBondContact O-NE 2.75Å; R202-R230 PolarHBondContact O-NH2 3.31Å; R202-R230 VanDerWaalsContact O-NH2 3.12Å; T204-R230 VanDerWaalsContact O-CD 3.27Å; T204-R230 WeakPolarHBondContact O-CD 3.22Å; T204-R230 WeakPolarHBondContact O-CG 3.32Å; T204-R230 PolarHBondContact O-NH1 3.33Å; H205-R230 HydrophobicContact CB-CG 4.48Å; H205-R230 WeakPolarHBondContact CE1-CD 3.23Å; K226-R230 WeakPolarHBondContact O-CB 3.46Å; K226-R230 PolarHBondContact O-N 2.74Å; E227-R230 IonicContact OE1-CZ 3.75Å; E227-R230 IonicContact OE1-NE 2.81Å; E227-R230 PolarHBondContact OE1-NE 2.91Å; E227-R230 IonicContact OE1-NH2 2.77Å; E227-R230 PolarHBondContact OE1-NH2 2.94Å; E227-R230 IonicContact OE2-NE 2.77Å; E227-R230 PolarHBondContact OE2-NE 2.64Å; R230-G233 PolarHBondContact O-N 3.24Å; R230-V234 WeakPolarHBondContact O-CG2 3.11Å; R230-V234 PolarHBondContact O-N 3.47Å
231	S	94.3	Very high	86.2	Confident	39 Å²	39	53.8 Å²	53.8	27%	0.273	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-50.4	180	-172.5	0	0	0	0	111.6	Q198 E227 Q228 G233 V234 Q235	Q198-S231 PolarHBondContact NE2-O 3.27Å; Q198-S231 PolarHBondContact NE2-OG 2.88Å; Q198-S231 VanDerWaalsContact NE2-OG 3.07Å; E227-S231 VanDerWaalsContact O-CB 3.27Å; E227-S231 WeakPolarHBondContact O-CB 3.18Å; E227-S231 PolarHBondContact O-N 3.05Å; Q228-S231 WeakPolarHBondContact O-CB 3.25Å; Q228-S231 PolarHBondContact O-N 3.13Å; S231-G233 VanDerWaalsContact C-N 3.34Å; S231-G233 PolarHBondContact O-N 2.96Å; S231-V234 PolarHBondContact O-N 3.39Å; S231-Q235 PolarHBondContact O-N 2.97Å
232	R	93.2	Very high	87.1	Confident	40 Å²	40	56.4 Å²	56.4	15%	0.151	32%	0.322	C	S	.	.	H	α-helix	trans	-56.1	-45.7	174.5	-175.1	-173.6	176.2	165.3	7.3	111.6	P210 D214 S217 D221 Q228 R229 Q235 Q236	P210-R232 HydrophobicContact CB-CG 4.01Å; D214-R232 IonicContact OD2-CZ 3.02Å; D214-R232 IonicContact OD2-NH2 3.54Å; D214-R232 PolarHBondContact OD2-NH2 2.62Å; S217-R232 PolarHBondContact OG-NH2 3.44Å; D221-R232 IonicContact OD1-CZ 2.93Å; D221-R232 IonicContact OD1-NH1 2.66Å; D221-R232 PolarHBondContact OD1-NH1 2.96Å; D221-R232 IonicContact OD2-CZ 2.69Å; D221-R232 IonicContact OD2-NH1 3.82Å; D221-R232 PolarHBondContact OD2-NH1 2.76Å; Q228-R232 PolarHBondContact O-N 2.82Å; R229-R232 PolarHBondContact O-N 2.89Å; R232-Q235 PolarHBondContact O-N 2.89Å; R232-Q236 PolarHBondContact O-N 2.9Å
233	G	94.5	Very high	87.6	Confident	2 Å²	2	57.8 Å²	57.8	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-42.8	179.4	0	0	0	0	0	113.2	R229 R230 S231 W237	R229-G233 PolarHBondContact O-N 2.88Å; R230-G233 PolarHBondContact O-N 3.24Å; S231-G233 VanDerWaalsContact C-N 3.34Å; S231-G233 PolarHBondContact O-N 2.96Å; G233-W237 VanDerWaalsContact O-CB 3.31Å; G233-W237 WeakPolarHBondContact O-CB 3.35Å; G233-W237 PolarHBondContact O-N 3.41Å
234	V	95.4	Very high	87.5	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-37	173.6	178.1	0	0	0	0	111.4	Q198 L201 T204 I206 R230 S231 W237 L238	Q198-V234 HydrophobicContact CG-CG1 3.99Å; L201-V234 HydrophobicContact CB-CG1 4.08Å; L201-V234 HydrophobicContact CD1-CG1 4.04Å; T204-V234 VanDerWaalsContact O-CG2 3.23Å; T204-V234 WeakPolarHBondContact O-CG2 3.31Å; I206-V234 HydrophobicContact CD1-CG2 4.38Å; I206-V234 HydrophobicContact CG1-CG2 4.02Å; R230-V234 WeakPolarHBondContact O-CG2 3.11Å; R230-V234 PolarHBondContact O-N 3.47Å; S231-V234 PolarHBondContact O-N 3.39Å; V234-W237 PolarHBondContact O-N 3.14Å; V234-L238 HydrophobicContact CG1-CD1 3.83Å; V234-L238 HydrophobicContact CG1-CG 4.18Å; V234-L238 WeakPolarHBondContact O-CB 3.23Å; V234-L238 VanDerWaalsContact O-CG 3.27Å; V234-L238 WeakPolarHBondContact O-CG 3.4Å; V234-L238 PolarHBondContact O-N 3.14Å
235	Q	94.3	Very high	86.9	Confident	120 Å²	120	58.7 Å²	58.7	56%	0.561	33%	0.326	S	S	*	.	H	α-helix	trans	-65.5	-47	177.5	-173.1	-179.4	-6.7	0	0	112.1	S231 R232 L238 A239	S231-Q235 PolarHBondContact O-N 2.97Å; R232-Q235 PolarHBondContact O-N 2.89Å; Q235-L238 PolarHBondContact O-N 3Å; Q235-A239 WeakPolarHBondContact O-CB 3.5Å; Q235-A239 PolarHBondContact O-N 3.03Å
236	Q	93.9	Very high	85.4	Confident	38 Å²	38	64.2 Å²	64.2	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-42.6	175.1	-77.5	-178.7	-18.1	0	0	111.3	Y209 F211 D214 R232 A239 S240	Y209-Q236 HydrophobicContact CD1-CB 3.96Å; Y209-Q236 HydrophobicContact CE1-CB 4.42Å; F211-Q236 VanDerWaalsContact N-OE1 3.13Å; D214-Q236 PolarHBondContact OD2-NE2 2.69Å; R232-Q236 PolarHBondContact O-N 2.9Å; Q236-A239 PolarHBondContact O-N 2.9Å; Q236-S240 PolarHBondContact O-N 3.02Å
237	W	94.4	Very high	83.9	Confident	6 Å²	6	64.8 Å²	64.8	2%	0.023	38%	0.377	C	S	.	.	H	α-helix	trans	-59.9	-51.8	175	173	-100.3	0	0	0	112.5	I206 Y209 G233 V234 A239 S240 L241 E253 T257 P305	I206-W237 HydrophobicContact CB-CB 4.38Å; I206-W237 HydrophobicContact CB-CG 4.44Å; I206-W237 HydrophobicContact CD1-CB 4.38Å; I206-W237 HydrophobicContact CD1-CD2 4.36Å; I206-W237 HydrophobicContact CD1-CG 3.9Å; I206-W237 HydrophobicContact CG1-CB 3.8Å; I206-W237 HydrophobicContact CG1-CD2 4.42Å; I206-W237 HydrophobicContact CG1-CG 3.82Å; I206-W237 HydrophobicContact CG2-CB 4.18Å; I206-W237 HydrophobicContact CG2-CD2 3.66Å; I206-W237 HydrophobicContact CG2-CE3 3.65Å; I206-W237 HydrophobicContact CG2-CG 3.92Å; I206-W237 HydrophobicContact CG2-CZ3 4.24Å; Y209-W237 HydrophobicContact CD1-CB 4.29Å; Y209-W237 HydrophobicContact CD2-CE3 4.27Å; Y209-W237 HydrophobicContact CE1-CB 4.36Å; Y209-W237 HydrophobicContact CE1-CE3 4.36Å; Y209-W237 AromaticContact CE2-CE3 3.6Å; Y209-W237 HydrophobicContact CE2-CE3 3.6Å; Y209-W237 HydrophobicContact CE2-CZ3 4.04Å; Y209-W237 AromaticContact CZ-CE3 3.66Å; G233-W237 VanDerWaalsContact O-CB 3.31Å; G233-W237 WeakPolarHBondContact O-CB 3.35Å; G233-W237 PolarHBondContact O-N 3.41Å; V234-W237 PolarHBondContact O-N 3.14Å; W237-A239 VanDerWaalsContact C-N 3.27Å; W237-A239 PolarHBondContact O-N 2.79Å; W237-S240 WeakPolarHBondContact O-CA 3.38Å; W237-S240 WeakPolarHBondContact O-CB 3.44Å; W237-S240 PolarHBondContact O-N 2.85Å; W237-S240 PolarHBondContact O-OG 2.85Å; W237-L241 HydrophobicContact CZ2-CD2 4.21Å; W237-L241 PolarHBondContact O-N 3.45Å; W237-E253 HydrophobicContact CH2-CB 3.61Å; W237-E253 HydrophobicContact CH2-CG 3.72Å; W237-E253 HydrophobicContact CZ2-CB 3.8Å; W237-E253 HydrophobicContact CZ2-CG 4.42Å; W237-E253 HydrophobicContact CZ3-CB 4.48Å; W237-E253 HydrophobicContact CZ3-CG 4.36Å; W237-T257 PolarHBondContact NE1-OG1 2.99Å; W237-P305 HydrophobicContact CE3-CG 4.4Å; W237-P305 HydrophobicContact CH2-CB 3.96Å; W237-P305 HydrophobicContact CH2-CG 3.47Å; W237-P305 VanDerWaalsContact CH2-CG 3.47Å; W237-P305 HydrophobicContact CZ2-CG 4.39Å; W237-P305 HydrophobicContact CZ3-CB 4.12Å; W237-P305 HydrophobicContact CZ3-CG 3.49Å; W237-P305 VanDerWaalsContact CZ3-CG 3.49Å
238	L	93.2	Very high	82.5	Confident	33 Å²	33	67.3 Å²	67.3	17%	0.173	39%	0.389	C	S	.	.	H	α-helix	trans	-61.5	-35.1	178.8	-71.4	173.2	0	0	0	112.4	I196 Q198 L201 V234 Q235 S240 L241 T257	I196-L238 HydrophobicContact CB-CD2 4.09Å; I196-L238 HydrophobicContact CG2-CD2 4.05Å; Q198-L238 HydrophobicContact CB-CD1 3.94Å; Q198-L238 HydrophobicContact CG-CD1 4.31Å; L201-L238 HydrophobicContact CD1-CD1 4.44Å; L201-L238 HydrophobicContact CD1-CD2 4.15Å; V234-L238 HydrophobicContact CG1-CD1 3.83Å; V234-L238 HydrophobicContact CG1-CG 4.18Å; V234-L238 WeakPolarHBondContact O-CB 3.23Å; V234-L238 VanDerWaalsContact O-CG 3.27Å; V234-L238 WeakPolarHBondContact O-CG 3.4Å; V234-L238 PolarHBondContact O-N 3.14Å; Q235-L238 PolarHBondContact O-N 3Å; L238-S240 VanDerWaalsContact C-N 3.28Å; L238-S240 PolarHBondContact O-N 3.47Å; L238-L241 HydrophobicContact CD2-CD1 3.9Å; L238-L241 PolarHBondContact O-N 2.87Å; L238-T257 HydrophobicContact CD2-CG2 3.91Å
239	A	91.3	Very high	81.2	Confident	89 Å²	89	67.4 Å²	67.4	74%	0.736	39%	0.389	S	S	*	.	H	α-helix	trans	-71.4	-19.8	174	0	0	0	0	0	113.8	Q235 Q236 W237	Q235-A239 WeakPolarHBondContact O-CB 3.5Å; Q235-A239 PolarHBondContact O-N 3.03Å; Q236-A239 PolarHBondContact O-N 2.9Å; W237-A239 VanDerWaalsContact C-N 3.27Å; W237-A239 PolarHBondContact O-N 2.79Å
240	S	90	Very high	80.4	Confident	60 Å²	60	66.1 Å²	66.1	42%	0.42	39%	0.387	S	S	.	.	H	α-helix	trans	-88.5	-9.6	175.8	74.3	0	0	0	0	114.2	Q236 W237 L238 S242	Q236-S240 PolarHBondContact O-N 3.02Å; W237-S240 WeakPolarHBondContact O-CA 3.38Å; W237-S240 WeakPolarHBondContact O-CB 3.44Å; W237-S240 PolarHBondContact O-N 2.85Å; W237-S240 PolarHBondContact O-OG 2.85Å; L238-S240 VanDerWaalsContact C-N 3.28Å; L238-S240 PolarHBondContact O-N 3.47Å; S240-S242 PolarHBondContact O-N 3.46Å
241	L	87.9	Confident	80	Confident	29 Å²	29	66.7 Å²	66.7	15%	0.152	39%	0.394	C	S	.	.			trans	-72.4	113.7	179.2	-65.7	-178.5	0	0	0	110.9	W237 L238 V243 E253 L254 T257	W237-L241 HydrophobicContact CZ2-CD2 4.21Å; W237-L241 PolarHBondContact O-N 3.45Å; L238-L241 HydrophobicContact CD2-CD1 3.9Å; L238-L241 PolarHBondContact O-N 2.87Å; L241-V243 PolarHBondContact O-N 2.75Å; L241-E253 HydrophobicContact CD2-CB 3.71Å; L241-L254 HydrophobicContact CD1-CD1 4.39Å; L241-T257 HydrophobicContact CD1-CG2 4.07Å
242	S	73.3	Confident	79.9	Confident	89 Å²	89	65.3 Å²	65.3	62%	0.622	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-56.5	127.2	168.7	-54.3	0	0	0	0	111.2	S240	S240-S242 PolarHBondContact O-N 3.46Å
243	V	65.4	Low	79.8	Confident	121 Å²	121	65.2 Å²	65.2	73%	0.733	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-68.4	126.2	164.8	-178.5	0	0	0	0	107.5	L241	L241-V243 PolarHBondContact O-N 2.75Å
244	P	61	Low	79.7	Confident	43 Å²	43	66 Å²	66	28%	0.279	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-68.3	134	-179.6	27.5	-33.7	0	0	0	111
245	T	58.2	Low	79.7	Confident	95 Å²	95	67.6 Å²	67.6	58%	0.583	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-74.7	155.4	172.6	-36	0	0	0	0	110	G247 E248	T245-G247 PolarHBondContact O-N 2.97Å; T245-E248 WeakPolarHBondContact CB-OE2 3.42Å; T245-E248 PolarHBondContact N-OE2 3.02Å; T245-E248 PolarHBondContact O-N 3.5Å; T245-E248 PolarHBondContact OG1-OE2 2.81Å
246	E	55.5	Low	79.8	Confident	204 Å²	204	61.9 Å²	61.9	95%	0.953	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	112.6	178.1	-71.7	-167.2	138	0	0	112
247	G	56.6	Low	79.9	Confident	87 Å²	87	60 Å²	60	90%	0.897	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.8	-7.2	179.2	0	0	0	0	0	115.8	T245	T245-G247 PolarHBondContact O-N 2.97Å
248	E	62.1	Low	80	Confident	120 Å²	120	59.8 Å²	59.8	56%	0.561	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-79.2	156	175.7	-63.9	-173.5	130.3	0	0	112.5	T245	T245-E248 WeakPolarHBondContact CB-OE2 3.42Å; T245-E248 PolarHBondContact N-OE2 3.02Å; T245-E248 PolarHBondContact O-N 3.5Å; T245-E248 PolarHBondContact OG1-OE2 2.81Å
249	Q	64.2	Low	80.2	Confident	108 Å²	108	58.2 Å²	58.2	51%	0.505	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-79.3	138.8	171.7	-64.2	-162.7	-74.9	0	0	110.4	F58 S251	F58-Q249 HydrophobicContact CD1-CG 4.42Å; F58-Q249 HydrophobicContact CE1-CG 4.21Å; Q249-S251 PolarHBondContact O-N 2.94Å
250	N	75.2	Confident	80.5	Confident	45 Å²	45	54 Å²	54	24%	0.241	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-50.3	127.4	172.5	-65.8	-67.1	0	0	0	111	L254 Q255	N250-L254 HydrophobicContact CB-CD2 4.16Å; N250-Q255 HydrophobicContact CB-CG 4.18Å; N250-Q255 PolarHBondContact O-NE2 2.87Å
251	S	87	Confident	80.9	Confident	32 Å²	32	51.7 Å²	51.7	22%	0.224	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-56.8	152	178.9	66.1	0	0	0	0	111.8	Q249 E253 L254 Q255	Q249-S251 PolarHBondContact O-N 2.94Å; S251-E253 WeakPolarHBondContact CB-OE2 3.33Å; S251-E253 PolarHBondContact O-N 2.82Å; S251-L254 PolarHBondContact O-N 3.25Å; S251-L254 VanDerWaalsContact OG-CB 3.26Å; S251-L254 WeakPolarHBondContact OG-CB 3.47Å; S251-L254 PolarHBondContact OG-N 2.91Å; S251-L254 VanDerWaalsContact OG-N 3.16Å; S251-Q255 WeakPolarHBondContact O-CG 3.48Å; S251-Q255 PolarHBondContact O-N 3.25Å
252	A	91	Very high	81.4	Confident	11 Å²	11	50.7 Å²	50.7	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-30.3	179.9	0	0	0	0	0	111.4	K64 Q255 L256	K64-A252 HydrophobicContact CB-CB 3.83Å; K64-A252 HydrophobicContact CD-CB 3.38Å; K64-A252 HydrophobicContact CG-CB 4.2Å; A252-Q255 WeakPolarHBondContact O-CB 3.49Å; A252-Q255 PolarHBondContact O-N 3.28Å; A252-L256 WeakPolarHBondContact O-CG 3.26Å; A252-L256 PolarHBondContact O-N 3.04Å
253	E	92.4	Very high	82.6	Confident	38 Å²	38	46.5 Å²	46.5	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-71	-42.9	178.9	-61.3	63.9	-137.7	0	0	110.5	K64 W237 L241 S251 L256 T257	K64-E253 IonicContact NZ-OE1 3.56Å; K64-E253 PolarHBondContact NZ-OE1 3.05Å; W237-E253 HydrophobicContact CH2-CB 3.61Å; W237-E253 HydrophobicContact CH2-CG 3.72Å; W237-E253 HydrophobicContact CZ2-CB 3.8Å; W237-E253 HydrophobicContact CZ2-CG 4.42Å; W237-E253 HydrophobicContact CZ3-CB 4.48Å; W237-E253 HydrophobicContact CZ3-CG 4.36Å; L241-E253 HydrophobicContact CD2-CB 3.71Å; S251-E253 WeakPolarHBondContact CB-OE2 3.33Å; S251-E253 PolarHBondContact O-N 2.82Å; E253-L256 PolarHBondContact O-N 3.13Å; E253-T257 WeakPolarHBondContact O-CB 2.92Å; E253-T257 PolarHBondContact O-N 3.1Å; E253-T257 PolarHBondContact O-OG1 2.83Å
254	L	92	Very high	84.2	Confident	19 Å²	19	41.8 Å²	41.8	10%	0.099	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-41.6	169.9	178.2	59.7	0	0	0	111.1	I196 L241 N250 S251 T257 V258	I196-L254 HydrophobicContact CD1-CD1 3.73Å; L241-L254 HydrophobicContact CD1-CD1 4.39Å; N250-L254 HydrophobicContact CB-CD2 4.16Å; S251-L254 PolarHBondContact O-N 3.25Å; S251-L254 VanDerWaalsContact OG-CB 3.26Å; S251-L254 WeakPolarHBondContact OG-CB 3.47Å; S251-L254 PolarHBondContact OG-N 2.91Å; S251-L254 VanDerWaalsContact OG-N 3.16Å; L254-T257 WeakPolarHBondContact O-CB 3.43Å; L254-T257 PolarHBondContact O-N 3.23Å; L254-T257 VanDerWaalsContact O-N 3.17Å; L254-V258 HydrophobicContact CD1-CG2 4.23Å; L254-V258 WeakPolarHBondContact O-CG2 3.34Å; L254-V258 PolarHBondContact O-N 3.03Å
255	Q	94.1	Very high	85.9	Confident	32 Å²	32	43.5 Å²	43.5	15%	0.15	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-42.6	176.5	-71.4	-178.6	57.1	0	0	112.4	V67 V184 N250 S251 A252 T257 G259	V67-Q255 HydrophobicContact CG2-CB 3.82Å; V184-Q255 HydrophobicContact CG1-CB 3.8Å; V184-Q255 HydrophobicContact CG1-CG 3.97Å; V184-Q255 WeakPolarHBondContact CG1-O 3.46Å; N250-Q255 HydrophobicContact CB-CG 4.18Å; N250-Q255 PolarHBondContact O-NE2 2.87Å; S251-Q255 WeakPolarHBondContact O-CG 3.48Å; S251-Q255 PolarHBondContact O-N 3.25Å; A252-Q255 WeakPolarHBondContact O-CB 3.49Å; A252-Q255 PolarHBondContact O-N 3.28Å; Q255-T257 VanDerWaalsContact C-N 3.33Å; Q255-T257 PolarHBondContact O-N 3.33Å; Q255-G259 PolarHBondContact O-N 3.32Å
256	L	96.8	Very high	87.9	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-40.3	172	-72.5	-179.1	0	0	0	112	V67 A252 E253 G259 A260 I282 I303 P305	V67-L256 HydrophobicContact CG1-CD2 4.38Å; A252-L256 WeakPolarHBondContact O-CG 3.26Å; A252-L256 PolarHBondContact O-N 3.04Å; E253-L256 PolarHBondContact O-N 3.13Å; L256-G259 CarbonylContact O-C 3.54Å; L256-G259 WeakPolarHBondContact O-CA 3.45Å; L256-G259 PolarHBondContact O-N 3.18Å; L256-A260 PolarHBondContact O-N 2.83Å; L256-I282 HydrophobicContact CD2-CG2 4.14Å; L256-I303 HydrophobicContact CB-CG2 3.85Å; L256-I303 HydrophobicContact CD1-CG2 3.83Å; L256-I303 HydrophobicContact CG-CG2 4.36Å; L256-P305 HydrophobicContact CD1-CB 4.45Å
257	T	96.4	Very high	89.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-46.8	179.4	-54.2	0	0	0	0	111.6	I196 L201 W237 L238 L241 E253 L254 Q255 G259 A260 L261	I196-T257 HydrophobicContact CD1-CG2 3.76Å; I196-T257 HydrophobicContact CG2-CG2 4.31Å; L201-T257 HydrophobicContact CD1-CG2 3.89Å; W237-T257 PolarHBondContact NE1-OG1 2.99Å; L238-T257 HydrophobicContact CD2-CG2 3.91Å; L241-T257 HydrophobicContact CD1-CG2 4.07Å; E253-T257 WeakPolarHBondContact O-CB 2.92Å; E253-T257 PolarHBondContact O-N 3.1Å; E253-T257 PolarHBondContact O-OG1 2.83Å; L254-T257 WeakPolarHBondContact O-CB 3.43Å; L254-T257 PolarHBondContact O-N 3.23Å; L254-T257 VanDerWaalsContact O-N 3.17Å; Q255-T257 VanDerWaalsContact C-N 3.33Å; Q255-T257 PolarHBondContact O-N 3.33Å; T257-G259 VanDerWaalsContact C-N 3.3Å; T257-G259 PolarHBondContact O-N 3.43Å; T257-A260 WeakPolarHBondContact O-CB 3.2Å; T257-A260 PolarHBondContact O-N 3.27Å; T257-A260 VanDerWaalsContact O-N 3.12Å; T257-L261 PolarHBondContact O-N 3.22Å; T257-L261 VanDerWaalsContact O-N 3.07Å
258	V	95.9	Very high	91.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-33	174.7	174.1	0	0	0	0	111.4	V184 R187 I191 I196 L254 A260 L261 I262	V184-V258 HydrophobicContact CG1-CB 4.25Å; V184-V258 HydrophobicContact CG1-CG1 4.24Å; V184-V258 HydrophobicContact CG2-CG1 4.43Å; R187-V258 HydrophobicContact CB-CG1 3.73Å; R187-V258 HydrophobicContact CG-CG1 3.93Å; I191-V258 HydrophobicContact CD1-CG1 4.36Å; I191-V258 HydrophobicContact CD1-CG2 3.89Å; I196-V258 HydrophobicContact CD1-CG2 3.9Å; L254-V258 HydrophobicContact CD1-CG2 4.23Å; L254-V258 WeakPolarHBondContact O-CG2 3.34Å; L254-V258 PolarHBondContact O-N 3.03Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.01Å; V258-L261 HydrophobicContact CG2-CD1 4.48Å; V258-L261 PolarHBondContact O-N 2.94Å; V258-I262 HydrophobicContact CG1-CD1 4.39Å; V258-I262 WeakPolarHBondContact O-CG1 3.43Å; V258-I262 PolarHBondContact O-N 3.07Å
259	G	97.8	Very high	93.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.4	-43.9	168	0	0	0	0	0	112.7	Q255 L256 T257 I262 V263	Q255-G259 PolarHBondContact O-N 3.32Å; L256-G259 CarbonylContact O-C 3.54Å; L256-G259 WeakPolarHBondContact O-CA 3.45Å; L256-G259 PolarHBondContact O-N 3.18Å; T257-G259 VanDerWaalsContact C-N 3.3Å; T257-G259 PolarHBondContact O-N 3.43Å; G259-I262 PolarHBondContact O-N 2.91Å; G259-V263 WeakPolarHBondContact O-CG2 3.22Å; G259-V263 PolarHBondContact O-N 3.05Å
260	A	98.4	Very high	95.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.7	-37.2	177	0	0	0	0	0	113	L201 T204 L256 T257 V258 I262 V263 E264 I282 Q301 I303	L201-A260 HydrophobicContact CD2-CB 3.82Å; T204-A260 HydrophobicContact CG2-CB 4.29Å; L256-A260 PolarHBondContact O-N 2.83Å; T257-A260 WeakPolarHBondContact O-CB 3.2Å; T257-A260 PolarHBondContact O-N 3.27Å; T257-A260 VanDerWaalsContact O-N 3.12Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.01Å; A260-I262 PolarHBondContact O-N 3.07Å; A260-V263 CarbonylContact O-C 3.53Å; A260-V263 PolarHBondContact O-N 3.16Å; A260-V263 VanDerWaalsContact O-N 3.14Å; A260-E264 WeakPolarHBondContact O-CG 3.21Å; A260-E264 PolarHBondContact O-N 3.25Å; A260-I282 HydrophobicContact CB-CD1 4.29Å; A260-Q301 PolarHBondContact O-NE2 3.01Å; A260-I303 HydrophobicContact CB-CD1 3.52Å; A260-I303 HydrophobicContact CB-CG1 3.8Å
261	L	97.6	Very high	96.4	Very high	12 Å²	12	19.8 Å²	19.8	6%	0.063	11%	0.112	C	C	.	.	H	α-helix	trans	-57.1	-48.2	172	-64.9	174.7	0	0	0	111.5	I191 I196 L200 L201 T257 V258 V263 E264 E265	I191-L261 HydrophobicContact CD1-CD1 4.08Å; I196-L261 HydrophobicContact CD1-CD1 4.22Å; I196-L261 HydrophobicContact CG1-CD1 4.4Å; I196-L261 HydrophobicContact CG2-CD1 4Å; I196-L261 HydrophobicContact CG2-CD2 4.1Å; I196-L261 HydrophobicContact CG2-CG 4.43Å; L200-L261 HydrophobicContact CB-CD2 3.45Å; L200-L261 VanDerWaalsContact CB-CD2 3.45Å; L200-L261 HydrophobicContact CD1-CD2 4.12Å; L200-L261 HydrophobicContact CG-CD2 4.44Å; L201-L261 HydrophobicContact CD2-CD2 3.68Å; L201-L261 HydrophobicContact CD2-CG 4.16Å; L201-L261 HydrophobicContact CG-CD2 3.86Å; T257-L261 PolarHBondContact O-N 3.22Å; T257-L261 VanDerWaalsContact O-N 3.07Å; V258-L261 HydrophobicContact CG2-CD1 4.48Å; V258-L261 PolarHBondContact O-N 2.94Å; L261-V263 PolarHBondContact O-N 3.1Å; L261-E264 PolarHBondContact O-N 3.49Å; L261-E265 WeakPolarHBondContact O-CG 3.22Å; L261-E265 PolarHBondContact O-N 3.02Å
262	I	97.9	Very high	96.9	Very high	9 Å²	9	27 Å²	27	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-32.7	177.6	-64.2	164.5	0	0	0	111.1	F165 L180 A183 V184 V258 G259 A260 M266	F165-I262 HydrophobicContact CD1-CG2 4.26Å; L180-I262 HydrophobicContact CD2-CG2 4.37Å; A183-I262 HydrophobicContact CB-CD1 4.04Å; V184-I262 HydrophobicContact CG2-CD1 3.98Å; V258-I262 HydrophobicContact CG1-CD1 4.39Å; V258-I262 WeakPolarHBondContact O-CG1 3.43Å; V258-I262 PolarHBondContact O-N 3.07Å; G259-I262 PolarHBondContact O-N 2.91Å; A260-I262 PolarHBondContact O-N 3.07Å; I262-M266 VanDerWaalsContact O-CB 3.27Å; I262-M266 WeakPolarHBondContact O-CB 3.46Å; I262-M266 PolarHBondContact O-N 3.02Å
263	V	98.7	Very high	97.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-77.5	-32.8	176.7	-179.2	0	0	0	0	112.6	A69 L180 G259 A260 L261 M266 R267 A280 I282	A69-V263 HydrophobicContact CB-CG2 3.86Å; L180-V263 HydrophobicContact CD1-CG2 3.61Å; G259-V263 WeakPolarHBondContact O-CG2 3.22Å; G259-V263 PolarHBondContact O-N 3.05Å; A260-V263 CarbonylContact O-C 3.53Å; A260-V263 PolarHBondContact O-N 3.16Å; A260-V263 VanDerWaalsContact O-N 3.14Å; L261-V263 PolarHBondContact O-N 3.1Å; V263-M266 PolarHBondContact O-N 3.14Å; V263-R267 HydrophobicContact CG1-CG 4.15Å; V263-R267 VanDerWaalsContact O-CB 3.29Å; V263-R267 WeakPolarHBondContact O-CB 3.35Å; V263-R267 VanDerWaalsContact O-CG 3.26Å; V263-R267 WeakPolarHBondContact O-CG 3.37Å; V263-R267 PolarHBondContact O-N 2.81Å; V263-A280 HydrophobicContact CG1-CB 3.48Å; V263-A280 VanDerWaalsContact CG1-CB 3.48Å; V263-I282 HydrophobicContact CB-CD1 4.35Å; V263-I282 HydrophobicContact CB-CG1 4.33Å; V263-I282 HydrophobicContact CG1-CD1 4.32Å; V263-I282 HydrophobicContact CG2-CD1 4.49Å; V263-I282 HydrophobicContact CG2-CG1 3.95Å
264	E	98.5	Very high	97.5	Very high	23 Å²	23	29.8 Å²	29.8	11%	0.107	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-47.2	169.6	-63.7	-80.1	-161.9	0	0	109.8	L201 R202 T203 T204 A260 L261 M266 R267 A268	L201-E264 VanDerWaalsContact C-OE1 3.29Å; R202-E264 PolarHBondContact N-OE1 2.86Å; T203-E264 PolarHBondContact N-OE1 2.83Å; T203-E264 VanDerWaalsContact OG1-CD 3.31Å; T203-E264 PolarHBondContact OG1-OE1 2.91Å; T203-E264 PolarHBondContact OG1-OE2 3.14Å; T204-E264 PolarHBondContact N-OE1 3.27Å; T204-E264 PolarHBondContact OG1-OE1 3.11Å; A260-E264 WeakPolarHBondContact O-CG 3.21Å; A260-E264 PolarHBondContact O-N 3.25Å; L261-E264 PolarHBondContact O-N 3.49Å; E264-M266 VanDerWaalsContact C-N 3.34Å; E264-M266 PolarHBondContact O-N 3.05Å; E264-R267 PolarHBondContact O-N 3.11Å; E264-R267 IonicContact OE2-NH1 3.92Å; E264-R267 PolarHBondContact OE2-NH1 3.42Å; E264-A268 WeakPolarHBondContact O-CB 3.34Å; E264-A268 PolarHBondContact O-N 2.56Å
265	E	98.4	Very high	97.7	Very high	78 Å²	78	31.2 Å²	31.2	36%	0.364	17%	0.17	S	C	.	.	H	α-helix	trans	-55.5	-47.3	174.5	-72	175.6	-171.3	0	0	111.7	F165 R187 L261 A269	F165-E265 HydrophobicContact CE1-CB 4.08Å; R187-E265 IonicContact CZ-OE1 3.41Å; R187-E265 IonicContact CZ-OE2 2.76Å; R187-E265 IonicContact NH1-OE1 2.62Å; R187-E265 PolarHBondContact NH1-OE1 2.56Å; R187-E265 IonicContact NH1-OE2 3.58Å; R187-E265 IonicContact NH2-OE1 2.75Å; R187-E265 PolarHBondContact NH2-OE1 2.93Å; R187-E265 VanDerWaalsContact NH2-OE1 3.15Å; R187-E265 IonicContact NH2-OE2 2.74Å; R187-E265 PolarHBondContact NH2-OE2 3.17Å; L261-E265 WeakPolarHBondContact O-CG 3.22Å; L261-E265 PolarHBondContact O-N 3.02Å; E265-A269 WeakPolarHBondContact O-CB 3.44Å; E265-A269 PolarHBondContact O-N 3.09Å
266	M	98.6	Very high	97.9	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-69.8	-37.8	-179.7	-176.5	-120.5	56.1	0	0	112.6	V71 M162 F165 M178 I262 V263 E264 A269 V270	V71-M266 HydrophobicContact CB-CE 4.43Å; V71-M266 HydrophobicContact CG1-CE 3.89Å; V71-M266 HydrophobicContact CG2-CE 3.72Å; V71-M266 HydrophobicContact CG2-SD 3.89Å; M162-M266 HydrophobicContact CB-SD 4.4Å; M162-M266 HydrophobicContact CE-SD 4.21Å; M162-M266 HydrophobicContact CG-SD 3.83Å; F165-M266 HydrophobicContact CB-CG 4.42Å; F165-M266 HydrophobicContact CD1-CB 3.9Å; F165-M266 HydrophobicContact CD1-CG 4.41Å; F165-M266 HydrophobicContact CD2-CB 3.84Å; F165-M266 HydrophobicContact CD2-CG 3.48Å; F165-M266 VanDerWaalsContact CD2-CG 3.48Å; F165-M266 HydrophobicContact CE1-CB 3.92Å; F165-M266 HydrophobicContact CE2-CB 3.87Å; F165-M266 HydrophobicContact CE2-CG 3.74Å; F165-M266 HydrophobicContact CG-CB 3.86Å; F165-M266 HydrophobicContact CG-CG 3.86Å; F165-M266 HydrophobicContact CZ-CB 3.91Å; F165-M266 HydrophobicContact CZ-CG 4.32Å; M178-M266 HydrophobicContact CE-CG 4.33Å; M178-M266 HydrophobicContact CE-SD 3.84Å; M178-M266 HydrophobicContact SD-SD 3.49Å; I262-M266 VanDerWaalsContact O-CB 3.27Å; I262-M266 WeakPolarHBondContact O-CB 3.46Å; I262-M266 PolarHBondContact O-N 3.02Å; V263-M266 PolarHBondContact O-N 3.14Å; E264-M266 VanDerWaalsContact C-N 3.34Å; E264-M266 PolarHBondContact O-N 3.05Å; M266-A269 WeakPolarHBondContact O-CB 3.33Å; M266-A269 PolarHBondContact O-N 3.19Å; M266-V270 HydrophobicContact CE-CG2 4.42Å; M266-V270 WeakPolarHBondContact O-CG2 3.21Å; M266-V270 PolarHBondContact O-N 2.88Å
267	R	98.7	Very high	98	Very high	12 Å²	12	32.5 Å²	32.5	5%	0.045	17%	0.173	C	C	.	.	H	α-helix	trans	-68.5	-44.1	177.9	-77.1	-176.3	40.7	-96.5	-4.1	111.1	T203 V263 E264 A269 V270 E271 C278 N299	T203-R267 PolarHBondContact OG1-NH1 3.36Å; T203-R267 PolarHBondContact OG1-NH2 3.03Å; V263-R267 HydrophobicContact CG1-CG 4.15Å; V263-R267 VanDerWaalsContact O-CB 3.29Å; V263-R267 WeakPolarHBondContact O-CB 3.35Å; V263-R267 VanDerWaalsContact O-CG 3.26Å; V263-R267 WeakPolarHBondContact O-CG 3.37Å; V263-R267 PolarHBondContact O-N 2.81Å; E264-R267 PolarHBondContact O-N 3.11Å; E264-R267 IonicContact OE2-NH1 3.92Å; E264-R267 PolarHBondContact OE2-NH1 3.42Å; R267-A269 VanDerWaalsContact C-N 3.27Å; R267-A269 PolarHBondContact O-N 2.87Å; R267-V270 PolarHBondContact O-N 2.91Å; R267-V270 VanDerWaalsContact O-N 3.17Å; R267-E271 PolarHBondContact O-N 3.35Å; R267-C278 PolarHBondContact NE-O 2.89Å; R267-C278 PolarHBondContact NH2-O 2.8Å; R267-N299 PolarHBondContact NH2-O 3.44Å; R267-N299 PolarHBondContact NH2-OD1 3.03Å
268	A	98.4	Very high	98.1	Very high	62 Å²	62	32.5 Å²	32.5	51%	0.512	17%	0.174	S	C	.	.	H	α-helix	trans	-60.2	-37.6	171.5	0	0	0	0	0	111.9	E264 K272	E264-A268 WeakPolarHBondContact O-CB 3.34Å; E264-A268 PolarHBondContact O-N 2.56Å; A268-K272 WeakPolarHBondContact O-CB 3.46Å; A268-K272 PolarHBondContact O-N 3.21Å
269	A	98.6	Very high	98.2	Very high	17 Å²	17	32.5 Å²	32.5	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-41	173.8	0	0	0	0	0	112.7	V161 F165 E265 M266 R267 H273	V161-A269 HydrophobicContact CG1-CB 3.97Å; F165-A269 HydrophobicContact CE2-CB 3.97Å; F165-A269 HydrophobicContact CZ-CB 3.82Å; E265-A269 WeakPolarHBondContact O-CB 3.44Å; E265-A269 PolarHBondContact O-N 3.09Å; M266-A269 WeakPolarHBondContact O-CB 3.33Å; M266-A269 PolarHBondContact O-N 3.19Å; R267-A269 VanDerWaalsContact C-N 3.27Å; R267-A269 PolarHBondContact O-N 2.87Å; A269-H273 WeakPolarHBondContact O-CB 3.41Å; A269-H273 PolarHBondContact O-N 3.39Å; A269-H273 PolarHBondContact O-ND1 3.49Å
270	V	98.4	Very high	98.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-49.3	176.4	171.1	0	0	0	0	110.9	M73 V158 V161 M162 M266 R267 K272 H273 T274	M73-V270 HydrophobicContact CE-CG1 3.75Å; M73-V270 HydrophobicContact SD-CG1 4.22Å; V158-V270 HydrophobicContact CG1-CG1 4.25Å; V158-V270 HydrophobicContact CG2-CG1 4.22Å; V161-V270 HydrophobicContact CB-CG2 4.14Å; V161-V270 HydrophobicContact CG1-CG2 3.75Å; M162-V270 HydrophobicContact CG-CG2 4.27Å; M266-V270 HydrophobicContact CE-CG2 4.42Å; M266-V270 WeakPolarHBondContact O-CG2 3.21Å; M266-V270 PolarHBondContact O-N 2.88Å; R267-V270 PolarHBondContact O-N 2.91Å; R267-V270 VanDerWaalsContact O-N 3.17Å; V270-K272 PolarHBondContact O-N 3.26Å; V270-H273 PolarHBondContact O-N 3.33Å; V270-T274 WeakPolarHBondContact O-CB 3.43Å; V270-T274 PolarHBondContact O-N 3.07Å; V270-T274 PolarHBondContact O-OG1 2.84Å
271	E	98.4	Very high	98.3	Very high	69 Å²	69	32.5 Å²	32.5	32%	0.322	17%	0.174	S	C	.	.	H	α-helix	trans	-61.1	-44.3	178.3	-171.1	170.5	-166.1	0	0	110.9	R267 H273 G275 F276 R277	R267-E271 PolarHBondContact O-N 3.35Å; E271-H273 PolarHBondContact O-N 3.26Å; E271-G275 VanDerWaalsContact O-CA 3.26Å; E271-G275 WeakPolarHBondContact O-CA 3.36Å; E271-G275 PolarHBondContact O-N 2.56Å; E271-F276 WeakPolarHBondContact CA-O 3.41Å; E271-R277 VanDerWaalsContact CD-CG 3.48Å; E271-R277 HydrophobicContact CG-CG 4.23Å; E271-R277 WeakPolarHBondContact OE1-CG 3.3Å; E271-R277 IonicContact OE1-CZ 2.71Å; E271-R277 IonicContact OE1-NE 3.15Å; E271-R277 PolarHBondContact OE1-NE 3.25Å; E271-R277 IonicContact OE1-NH2 3.39Å
272	K	98.3	Very high	98.4	Very high	185 Å²	185	32 Å²	32	80%	0.804	17%	0.171	S	C	*	.	H	α-helix	trans	-62.5	-39.1	178.1	-178.9	175.6	178.8	177.7	0	114.3	A268 V270	A268-K272 WeakPolarHBondContact O-CB 3.46Å; A268-K272 PolarHBondContact O-N 3.21Å; V270-K272 PolarHBondContact O-N 3.26Å
273	H	97.9	Very high	98.4	Very high	101 Å²	101	31.5 Å²	31.5	47%	0.468	17%	0.169	S	C	.	.	H	α-helix	trans	-85.8	-31.6	-177.2	-74	86.3	0	0	0	113.4	V161 R164 A269 V270 E271	V161-H273 HydrophobicContact CG2-CB 3.77Å; R164-H273 PolarHBondContact NH1-CE1 3.41Å; R164-H273 PolarHBondContact NH1-NE2 3.1Å; A269-H273 WeakPolarHBondContact O-CB 3.41Å; A269-H273 PolarHBondContact O-N 3.39Å; A269-H273 PolarHBondContact O-ND1 3.49Å; V270-H273 PolarHBondContact O-N 3.33Å; E271-H273 PolarHBondContact O-N 3.26Å
274	T	97.4	Very high	98.3	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-114.4	-17.7	-169.3	68.9	0	0	0	0	113.8	R83 E157 V158 V270 F276	R83-T274 WeakPolarHBondContact CD-O 3.21Å; R83-T274 PolarHBondContact NH1-O 2.91Å; E157-T274 HydrophobicContact CB-CG2 3.99Å; V158-T274 HydrophobicContact CG2-CG2 4.22Å; V270-T274 WeakPolarHBondContact O-CB 3.43Å; V270-T274 PolarHBondContact O-N 3.07Å; V270-T274 PolarHBondContact O-OG1 2.84Å; T274-F276 VanDerWaalsContact CB-CD2 3.5Å; T274-F276 HydrophobicContact CG2-CD2 4.42Å; T274-F276 WeakPolarHBondContact OG1-CB 3.22Å; T274-F276 VanDerWaalsContact OG1-CD2 3.31Å; T274-F276 WeakPolarHBondContact OG1-CD2 3.47Å; T274-F276 PolarHBondContact OG1-N 2.93Å
275	G	97.3	Very high	98.3	Very high	50 Å²	50	30.5 Å²	30.5	52%	0.515	16%	0.164	S	C	.	.	S	Bend	trans	73.1	12.2	-169.4	0	0	0	0	0	114.1	E271	E271-G275 VanDerWaalsContact O-CA 3.26Å; E271-G275 WeakPolarHBondContact O-CA 3.36Å; E271-G275 PolarHBondContact O-N 2.56Å
276	F	98.1	Very high	98.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.			trans	-108.5	126.2	-179	-53	-42.4	0	0	0	112.5	M73 F76 Q79 V80 R83 A154 V158 E271 T274	M73-F276 HydrophobicContact CE-CB 3.31Å; M73-F276 HydrophobicContact CE-CD2 4.37Å; M73-F276 HydrophobicContact CE-CG 4.27Å; F76-F276 HydrophobicContact CE2-CD2 4.26Å; F76-F276 HydrophobicContact CE2-CE2 4.22Å; Q79-F276 HydrophobicContact CB-CD1 3.88Å; Q79-F276 HydrophobicContact CB-CE1 4.4Å; V80-F276 HydrophobicContact CB-CE1 4.5Å; V80-F276 HydrophobicContact CB-CZ 4.42Å; V80-F276 HydrophobicContact CG2-CE1 4.1Å; V80-F276 HydrophobicContact CG2-CE2 4.44Å; V80-F276 HydrophobicContact CG2-CZ 3.78Å; R83-F276 HydrophobicContact CB-CE1 3.92Å; R83-F276 HydrophobicContact CG-CE1 4.39Å; R83-F276 VanDerWaalsContact NH1-CZ 3.35Å; A154-F276 HydrophobicContact CB-CE2 3.78Å; A154-F276 HydrophobicContact CB-CZ 3.91Å; V158-F276 HydrophobicContact CG2-CD2 3.94Å; E271-F276 WeakPolarHBondContact CA-O 3.41Å; T274-F276 VanDerWaalsContact CB-CD2 3.5Å; T274-F276 HydrophobicContact CG2-CD2 4.42Å; T274-F276 WeakPolarHBondContact OG1-CB 3.22Å; T274-F276 VanDerWaalsContact OG1-CD2 3.31Å; T274-F276 WeakPolarHBondContact OG1-CD2 3.47Å; T274-F276 PolarHBondContact OG1-N 2.93Å
277	R	98.2	Very high	98.2	Very high	58 Å²	58	27.1 Å²	27.1	22%	0.219	15%	0.149	C	C	.	.			trans	-75.5	150.9	168.8	-70.4	170.4	175	-177.8	-2.9	111.2	D74 Q79 E271 N299 D675	D74-R277 PolarHBondContact N-O 2.66Å; Q79-R277 PolarHBondContact NE2-O 2.92Å; E271-R277 VanDerWaalsContact CD-CG 3.48Å; E271-R277 HydrophobicContact CG-CG 4.23Å; E271-R277 WeakPolarHBondContact OE1-CG 3.3Å; E271-R277 IonicContact OE1-CZ 2.71Å; E271-R277 IonicContact OE1-NE 3.15Å; E271-R277 PolarHBondContact OE1-NE 3.25Å; E271-R277 IonicContact OE1-NH2 3.39Å; R277-N299 HydrophobicContact CB-CB 4.22Å; R277-N299 WeakPolarHBondContact CD-ND2 3.39Å; R277-N299 HydrophobicContact CG-CB 4.5Å; R277-D675 IonicContact CZ-OD2 2.8Å; R277-D675 IonicContact NH1-OD1 2.84Å; R277-D675 IonicContact NH1-OD2 3.81Å; R277-D675 PolarHBondContact NH1-OD2 3.44Å; R277-D675 IonicContact NH2-OD2 3.72Å; R277-D675 PolarHBondContact NH2-OD2 3.44Å
278	C	98.6	Very high	98.2	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.007	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	161.4	175.3	58.8	0	0	0	0	112.4	V71 M73 D74 R267 N299	V71-C278 HydrophobicContact CG1-CB 4.18Å; M73-C278 HydrophobicContact CE-CB 3.78Å; M73-C278 HydrophobicContact SD-CB 3.46Å; M73-C278 WeakPolarHBondContact SD-CB 3.17Å; D74-C278 VanDerWaalsContact OD2-C 3.24Å; D74-C278 WeakPolarHBondContact OD2-CA 3.48Å; R267-C278 PolarHBondContact NE-O 2.89Å; R267-C278 PolarHBondContact NH2-O 2.8Å; C278-N299 PolarHBondContact O-OD1 2.87Å
279	S	98.8	Very high	98.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.8	175.6	-62.4	0	0	0	0	110.5	D72 D74 C293 N299 R300	D72-S279 PolarHBondContact N-O 2.86Å; D72-S279 PolarHBondContact O-N 3.27Å; D72-S279 VanDerWaalsContact O-N 3.13Å; D74-S279 PolarHBondContact OD2-N 3.2Å; D74-S279 VanDerWaalsContact OD2-N 3.15Å; D74-S279 PolarHBondContact OD2-OG 2.94Å; S279-C293 PolarHBondContact O-SG 3.2Å; S279-C293 VanDerWaalsContact O-SG 3.39Å; S279-N299 PolarHBondContact OG-N 3.39Å; S279-R300 WeakPolarHBondContact CA-O 3.2Å; S279-R300 VanDerWaalsContact CB-O 3.29Å; S279-R300 WeakPolarHBondContact CB-O 3.39Å
280	A	98.9	Very high	98.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.1	-177.6	0	0	0	0	0	113.9	L70 V71 V263 R300 Q301 T302	L70-A280 CarbonylContact O-C 3.57Å; L70-A280 WeakPolarHBondContact O-CA 3.24Å; L70-A280 WeakPolarHBondContact O-CB 3.15Å; V71-A280 HydrophobicContact CG2-CB 4.16Å; V263-A280 HydrophobicContact CG1-CB 3.48Å; V263-A280 VanDerWaalsContact CG1-CB 3.48Å; A280-R300 PolarHBondContact N-O 2.77Å; A280-R300 VanDerWaalsContact N-O 3.17Å; A280-Q301 HydrophobicContact CB-CB 3.98Å; A280-Q301 CarbonylContact O-C 3.6Å; A280-Q301 WeakPolarHBondContact O-CA 3.38Å; A280-T302 PolarHBondContact O-N 3.33Å
281	G	98.8	Very high	98.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.8	174.8	0	0	0	0	0	110.4	A69 L70 A289 T302	A69-G281 CarbonylContact C-O 3.56Å; A69-G281 VanDerWaalsContact CA-O 3.27Å; A69-G281 WeakPolarHBondContact CA-O 3.44Å; L70-G281 PolarHBondContact N-O 2.74Å; L70-G281 PolarHBondContact O-N 3.01Å; G281-A289 WeakPolarHBondContact CA-O 3.3Å; G281-T302 CarbonylContact C-O 3.48Å; G281-T302 WeakPolarHBondContact CA-O 3.05Å
282	I	98.8	Very high	98.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124	-176.1	-52.2	89.9	0	0	0	108.4	V67 A69 L256 A260 V263 Q301 T302 I303 L304	V67-I282 HydrophobicContact CG1-CG2 3.91Å; A69-I282 HydrophobicContact CB-CG1 4.5Å; L256-I282 HydrophobicContact CD2-CG2 4.14Å; A260-I282 HydrophobicContact CB-CD1 4.29Å; V263-I282 HydrophobicContact CB-CD1 4.35Å; V263-I282 HydrophobicContact CB-CG1 4.33Å; V263-I282 HydrophobicContact CG1-CD1 4.32Å; V263-I282 HydrophobicContact CG2-CD1 4.49Å; V263-I282 HydrophobicContact CG2-CG1 3.95Å; I282-Q301 HydrophobicContact CD1-CB 4.07Å; I282-Q301 HydrophobicContact CD1-CG 4.33Å; I282-T302 PolarHBondContact N-O 2.93Å; I282-I303 WeakPolarHBondContact O-CA 3.12Å; I282-L304 PolarHBondContact O-N 3.08Å
283	S	98.5	Very high	98.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	-174.3	178.4	-166.6	0	0	0	0	110	V68 N285 L288 L304	V68-S283 CarbonylContact C-O 3.57Å; V68-S283 WeakPolarHBondContact CA-O 3.4Å; V68-S283 PolarHBondContact N-O 2.57Å; V68-S283 PolarHBondContact O-N 3.04Å; S283-N285 VanDerWaalsContact C-N 3.34Å; S283-N285 PolarHBondContact O-N 3.04Å; S283-L288 WeakPolarHBondContact OG-CB 3.48Å; S283-L288 WeakPolarHBondContact OG-CD1 3.06Å; S283-L304 WeakPolarHBondContact CB-O 3.32Å; S283-L304 PolarHBondContact OG-O 2.93Å
284	H	97.8	Very high	98.1	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.009	8%	0.082	C	C	.	.	S	Bend	trans	-79.7	-11.7	-176.7	-57.2	-63.7	0	0	0	114.8	G63 K64 R66	G63-H284 WeakPolarHBondContact O-CB 3.34Å; K64-H284 PolarHBondContact O-ND1 2.98Å; R66-H284 PolarHBondContact NE-O 3.19Å; R66-H284 WeakPolarHBondContact O-CA 3.28Å; R66-H284 PolarHBondContact O-ND1 2.9Å
285	N	97.7	Very high	98	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-152.4	173.4	-178	66.9	71	0	0	0	114.4	S283 V287 L288 A289 G370 E372	S283-N285 VanDerWaalsContact C-N 3.34Å; S283-N285 PolarHBondContact O-N 3.04Å; N285-V287 PolarHBondContact O-N 2.82Å; N285-V287 PolarHBondContact OD1-N 3.17Å; N285-L288 PolarHBondContact OD1-N 2.93Å; N285-A289 WeakPolarHBondContact O-CB 3.33Å; N285-A289 PolarHBondContact O-N 3.01Å; N285-G370 PolarHBondContact ND2-O 3.03Å; N285-E372 HydrophobicContact CB-CB 3.85Å; N285-E372 VanDerWaalsContact CB-O 3.28Å; N285-E372 WeakPolarHBondContact CB-O 3.29Å
286	K	97.9	Very high	98	Very high	1 Å²	1	14.5 Å²	14.5	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-75.1	-20.1	-169.8	-64.6	172.1	79.5	-173.3	0	113.8	V68 E169 Y177 K290 E374 A375 V376	V68-K286 HydrophobicContact CG1-CG 3.88Å; E169-K286 IonicContact OE2-NZ 2.89Å; E169-K286 PolarHBondContact OE2-NZ 3.26Å; Y177-K286 HydrophobicContact CD1-CB 3.95Å; Y177-K286 HydrophobicContact CD1-CG 3.8Å; Y177-K286 VanDerWaalsContact CE1-CA 3.49Å; Y177-K286 HydrophobicContact CE1-CB 3.51Å; Y177-K286 HydrophobicContact CE1-CG 3.92Å; Y177-K286 WeakPolarHBondContact CE1-O 3.26Å; Y177-K286 HydrophobicContact CE2-CB 4.5Å; Y177-K286 HydrophobicContact CG-CG 4.2Å; Y177-K286 VanDerWaalsContact CZ-O 3.27Å; Y177-K286 PolarHBondContact OH-O 3.49Å; K286-K290 PolarHBondContact O-N 3.17Å; K286-E374 HydrophobicContact CD-CB 4.17Å; K286-E374 HydrophobicContact CD-CG 4.1Å; K286-E374 WeakPolarHBondContact CD-O 3.41Å; K286-E374 WeakPolarHBondContact CE-OE2 3.14Å; K286-E374 IonicContact NZ-OE1 3.8Å; K286-E374 IonicContact NZ-OE2 2.99Å; K286-E374 PolarHBondContact NZ-OE2 3.36Å; K286-A375 PolarHBondContact NZ-O 2.72Å; K286-V376 HydrophobicContact CD-CG2 4.12Å; K286-V376 HydrophobicContact CG-CG2 4.2Å
287	V	97.4	Very high	97.9	Very high	7 Å²	7	17 Å²	17	4%	0.042	9%	0.093	C	C	.	.	H	α-helix	trans	-83.3	-49	175.7	-178.7	0	0	0	0	109.8	N285 K290 L291 I321 R322 L367 E372	N285-V287 PolarHBondContact O-N 2.82Å; N285-V287 PolarHBondContact OD1-N 3.17Å; V287-K290 PolarHBondContact O-N 2.98Å; V287-L291 PolarHBondContact O-N 3.16Å; V287-I321 HydrophobicContact CG1-CG2 4.03Å; V287-R322 HydrophobicContact CG1-CB 4.44Å; V287-L367 HydrophobicContact CB-CD1 3.89Å; V287-L367 HydrophobicContact CG1-CD1 3.92Å; V287-L367 HydrophobicContact CG2-CD1 3.99Å; V287-E372 HydrophobicContact CG2-CG 3.92Å
288	L	98.1	Very high	97.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.6	-43.2	176.7	-62.9	-173.3	0	0	0	112.1	S283 N285 K290 L291 A292 L304 L306 V309 F313 G370	S283-L288 WeakPolarHBondContact OG-CB 3.48Å; S283-L288 WeakPolarHBondContact OG-CD1 3.06Å; N285-L288 PolarHBondContact OD1-N 2.93Å; L288-K290 VanDerWaalsContact C-N 3.32Å; L288-K290 PolarHBondContact O-N 3.36Å; L288-L291 WeakPolarHBondContact O-CB 3.44Å; L288-L291 PolarHBondContact O-N 2.79Å; L288-A292 WeakPolarHBondContact O-CB 3.17Å; L288-A292 PolarHBondContact O-N 2.79Å; L288-L304 HydrophobicContact CB-CD2 4Å; L288-L304 HydrophobicContact CB-CG 4.46Å; L288-L304 HydrophobicContact CD2-CD2 4.01Å; L288-L304 HydrophobicContact CG-CD2 4.47Å; L288-L306 HydrophobicContact CD1-CD1 4.36Å; L288-V309 HydrophobicContact CD1-CG2 3.66Å; L288-V309 HydrophobicContact CD2-CG1 4.24Å; L288-V309 HydrophobicContact CD2-CG2 3.85Å; L288-V309 HydrophobicContact CG-CG2 4.43Å; L288-F313 HydrophobicContact CD2-CE1 4.11Å; L288-F313 HydrophobicContact CD2-CZ 3.79Å; L288-G370 VanDerWaalsContact CD1-O 3.3Å; L288-G370 WeakPolarHBondContact CD1-O 3.41Å
289	A	98.5	Very high	97.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-37.2	176.2	0	0	0	0	0	113	V68 L70 G281 N285 C293	V68-A289 HydrophobicContact CG1-CB 4.21Å; V68-A289 WeakPolarHBondContact O-CB 3.34Å; L70-A289 HydrophobicContact CB-CB 4.24Å; G281-A289 WeakPolarHBondContact CA-O 3.3Å; N285-A289 WeakPolarHBondContact O-CB 3.33Å; N285-A289 PolarHBondContact O-N 3.01Å; A289-C293 WeakPolarHBondContact O-CB 3.36Å; A289-C293 PolarHBondContact O-N 2.94Å
290	K	98.3	Very high	97.9	Very high	51 Å²	51	19 Å²	19	22%	0.222	10%	0.104	C	C	.	.	H	α-helix	trans	-69.1	-38.6	175.2	-179.8	64.2	-151.3	177.1	0	112.1	L70 D72 E175 K286 V287 L288	L70-K290 HydrophobicContact CD1-CB 4.11Å; L70-K290 HydrophobicContact CD1-CD 3.5Å; L70-K290 VanDerWaalsContact CD1-CD 3.5Å; L70-K290 HydrophobicContact CD1-CG 4.35Å; L70-K290 HydrophobicContact CD2-CD 3.75Å; L70-K290 HydrophobicContact CG-CD 4.27Å; D72-K290 IonicContact OD2-NZ 3.25Å; D72-K290 PolarHBondContact OD2-NZ 2.97Å; E175-K290 WeakPolarHBondContact OE2-CE 3.43Å; E175-K290 IonicContact OE2-NZ 3.98Å; E175-K290 PolarHBondContact OE2-NZ 3.13Å; K286-K290 PolarHBondContact O-N 3.17Å; V287-K290 PolarHBondContact O-N 2.98Å; L288-K290 VanDerWaalsContact C-N 3.32Å; L288-K290 PolarHBondContact O-N 3.36Å
291	L	97.5	Very high	97.9	Very high	28 Å²	28	19 Å²	19	15%	0.147	10%	0.104	C	C	.	.	H	α-helix	trans	-64.8	-52.9	177.3	179.1	62.7	0	0	0	110.7	V287 L288 C293 G294 L304 L312 F313 L316	V287-L291 PolarHBondContact O-N 3.16Å; L288-L291 WeakPolarHBondContact O-CB 3.44Å; L288-L291 PolarHBondContact O-N 2.79Å; L291-C293 VanDerWaalsContact C-N 3.28Å; L291-C293 PolarHBondContact O-N 2.89Å; L291-G294 WeakPolarHBondContact O-CA 3.07Å; L291-G294 PolarHBondContact O-N 2.69Å; L291-L304 HydrophobicContact CD2-CD2 4.21Å; L291-L312 HydrophobicContact CD2-CD2 3.63Å; L291-L312 HydrophobicContact CD2-CG 4.4Å; L291-L312 HydrophobicContact CG-CD2 4.34Å; L291-F313 HydrophobicContact CD2-CE1 3.67Å; L291-F313 HydrophobicContact CD2-CZ 4.47Å; L291-L316 HydrophobicContact CD1-CD1 4.24Å; L291-L316 HydrophobicContact CD1-CD2 3.89Å; L291-L316 HydrophobicContact CD2-CD2 3.56Å; L291-L316 HydrophobicContact CG-CD2 4.39Å
292	A	98.3	Very high	97.9	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-55.2	-40.2	179.8	0	0	0	0	0	112.9	L288 G294 L295 T302 L304	L288-A292 WeakPolarHBondContact O-CB 3.17Å; L288-A292 PolarHBondContact O-N 2.79Å; A292-G294 PolarHBondContact O-N 3.06Å; A292-L295 PolarHBondContact O-N 2.74Å; A292-T302 WeakPolarHBondContact O-CB 3.4Å; A292-T302 PolarHBondContact O-OG1 3.43Å; A292-L304 HydrophobicContact CB-CB 3.72Å; A292-L304 HydrophobicContact CB-CD2 4.25Å
293	C	98.5	Very high	97.9	Very high	2 Å²	2	19 Å²	19	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-26.4	175.3	-178.7	0	0	0	0	113.5	L70 S279 A289 L291 K297	L70-C293 HydrophobicContact CD2-CB 3.7Å; L70-C293 VanDerWaalsContact CD2-SG 3.51Å; S279-C293 PolarHBondContact O-SG 3.2Å; S279-C293 VanDerWaalsContact O-SG 3.39Å; A289-C293 WeakPolarHBondContact O-CB 3.36Å; A289-C293 PolarHBondContact O-N 2.94Å; L291-C293 VanDerWaalsContact C-N 3.28Å; L291-C293 PolarHBondContact O-N 2.89Å; C293-K297 WeakPolarHBondContact O-CE 3.32Å; C293-K297 WeakPolarHBondContact O-CG 3.34Å
294	G	96.8	Very high	97.8	Very high	49 Å²	49	19 Å²	19	51%	0.505	11%	0.105	S	C	.	.	H	α-helix	trans	-83.9	-14.9	178.6	0	0	0	0	0	115	L291 A292	L291-G294 WeakPolarHBondContact O-CA 3.07Å; L291-G294 PolarHBondContact O-N 2.69Å; A292-G294 PolarHBondContact O-N 3.06Å
295	L	96.1	Very high	97.7	Very high	61 Å²	61	19 Å²	19	32%	0.319	11%	0.105	S	C	.	.	H	α-helix	trans	-75.3	-41.5	-167.1	-61.1	179	0	0	0	113.8	Q207 A292 T302	Q207-L295 HydrophobicContact CG-CD1 4.33Å; A292-L295 PolarHBondContact O-N 2.74Å; L295-T302 HydrophobicContact CD1-CG2 4.2Å
296	N	96.9	Very high	97.6	Very high	45 Å²	45	20.1 Å²	20.1	24%	0.241	11%	0.111	C	C	.	.	S	Bend	trans	-120.8	24.1	-169	-64.4	-68.2	0	0	0	114.1	H205 R300 T302	H205-N296 WeakPolarHBondContact CB-ND2 3.31Å; H205-N296 VanDerWaalsContact CD2-CG 3.48Å; H205-N296 PolarHBondContact CD2-OD1 3.42Å; N296-R300 HydrophobicContact CB-CB 4.14Å; N296-R300 VanDerWaalsContact O-CB 3.32Å; N296-R300 WeakPolarHBondContact O-CB 3.49Å; N296-T302 WeakPolarHBondContact ND2-CG2 3.41Å; N296-T302 PolarHBondContact ND2-OG1 2.79Å
297	K	96.8	Very high	97.2	Very high	51 Å²	51	25.3 Å²	25.3	22%	0.222	14%	0.139	C	C	.	.			trans	-65.1	145.9	178.3	-60.8	-139.9	-175.2	-166.2	0	111.8	D72 D74 Y111 C293	D72-K297 PolarHBondContact O-NZ 3.37Å; D72-K297 IonicContact OD1-NZ 3.47Å; D72-K297 PolarHBondContact OD1-NZ 3.48Å; D72-K297 IonicContact OD2-NZ 3.05Å; D72-K297 PolarHBondContact OD2-NZ 3.16Å; D74-K297 WeakPolarHBondContact OD1-CD 3.25Å; Y111-K297 HydrophobicContact CE1-CB 4.3Å; C293-K297 WeakPolarHBondContact O-CE 3.32Å; C293-K297 WeakPolarHBondContact O-CG 3.34Å
298	P	97.6	Very high	97	Very high	15 Å²	15	25.7 Å²	25.7	10%	0.097	14%	0.142	C	C	.	.	S	Bend	cis	-93.4	164.6	7.1	35.1	-34.8	0	0	0	115.2	Y111 R300 W689	Y111-P298 HydrophobicContact CD1-CB 4.06Å; Y111-P298 HydrophobicContact CD1-CG 3.92Å; Y111-P298 HydrophobicContact CD2-CB 3.91Å; Y111-P298 HydrophobicContact CD2-CG 4.29Å; Y111-P298 HydrophobicContact CE1-CB 3.87Å; Y111-P298 HydrophobicContact CE1-CG 4.15Å; Y111-P298 HydrophobicContact CE2-CB 3.71Å; Y111-P298 HydrophobicContact CG-CB 4.09Å; Y111-P298 HydrophobicContact CG-CG 4.01Å; P298-R300 VanDerWaalsContact C-N 3.31Å; P298-R300 PolarHBondContact O-N 3.22Å; P298-W689 HydrophobicContact CG-CD2 3.95Å; P298-W689 HydrophobicContact CG-CG 4.05Å; P298-W689 HydrophobicContact CG-CZ2 4.4Å
299	N	98	Very high	96.9	Very high	29 Å²	29	25.8 Å²	25.8	16%	0.155	14%	0.142	C	C	.	.	S	Bend	trans	45.9	47.1	170.2	-159.9	23.6	0	0	0	115.1	D74 R267 R277 C278 S279	D74-N299 PolarHBondContact OD2-N 2.89Å; R267-N299 PolarHBondContact NH2-O 3.44Å; R267-N299 PolarHBondContact NH2-OD1 3.03Å; R277-N299 HydrophobicContact CB-CB 4.22Å; R277-N299 WeakPolarHBondContact CD-ND2 3.39Å; R277-N299 HydrophobicContact CG-CB 4.5Å; C278-N299 PolarHBondContact O-OD1 2.87Å; S279-N299 PolarHBondContact OG-N 3.39Å
300	R	98.4	Very high	96.6	Very high	57 Å²	57	31.3 Å²	31.3	22%	0.215	18%	0.176	C	C	.	.			trans	-139.3	168.5	172.9	-64.7	-64.6	-169.1	-86	9.6	109.7	T203 E227 S279 A280 N296 P298	T203-R300 WeakPolarHBondContact O-CB 3.45Å; T203-R300 WeakPolarHBondContact O-CD 3.47Å; E227-R300 IonicContact OE2-CZ 3.14Å; E227-R300 IonicContact OE2-NE 2.73Å; E227-R300 IonicContact OE2-NH2 2.71Å; E227-R300 PolarHBondContact OE2-NH2 3.22Å; S279-R300 WeakPolarHBondContact CA-O 3.2Å; S279-R300 VanDerWaalsContact CB-O 3.29Å; S279-R300 WeakPolarHBondContact CB-O 3.39Å; A280-R300 PolarHBondContact N-O 2.77Å; A280-R300 VanDerWaalsContact N-O 3.17Å; N296-R300 HydrophobicContact CB-CB 4.14Å; N296-R300 VanDerWaalsContact O-CB 3.32Å; N296-R300 WeakPolarHBondContact O-CB 3.49Å; P298-R300 VanDerWaalsContact C-N 3.31Å; P298-R300 PolarHBondContact O-N 3.22Å
301	Q	98.7	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.1	170.1	63.3	-175.1	53.7	0	0	111.6	T203 T204 H205 A260 A280 I282	T203-Q301 PolarHBondContact O-N 3.26Å; T204-Q301 CarbonylContact C-O 3.59Å; T204-Q301 WeakPolarHBondContact CA-O 3.12Å; T204-Q301 HydrophobicContact CG2-CG 4.44Å; T204-Q301 VanDerWaalsContact OG1-CG 3.26Å; T204-Q301 WeakPolarHBondContact OG1-CG 3.4Å; T204-Q301 PolarHBondContact OG1-NE2 2.76Å; H205-Q301 PolarHBondContact N-O 2.87Å; A260-Q301 PolarHBondContact O-NE2 3.01Å; A280-Q301 HydrophobicContact CB-CB 3.98Å; A280-Q301 CarbonylContact O-C 3.6Å; A280-Q301 WeakPolarHBondContact O-CA 3.38Å; I282-Q301 HydrophobicContact CD1-CB 4.07Å; I282-Q301 HydrophobicContact CD1-CG 4.33Å
302	T	98.8	Very high	96.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.6	-178.9	-38.2	0	0	0	0	110.7	H205 Q207 A280 G281 I282 A292 L295 N296	H205-T302 HydrophobicContact CB-CG2 4.14Å; H205-T302 CarbonylContact O-C 3.59Å; H205-T302 WeakPolarHBondContact O-CA 3.46Å; Q207-T302 HydrophobicContact CB-CG2 4.4Å; A280-T302 PolarHBondContact O-N 3.33Å; G281-T302 CarbonylContact C-O 3.48Å; G281-T302 WeakPolarHBondContact CA-O 3.05Å; I282-T302 PolarHBondContact N-O 2.93Å; A292-T302 WeakPolarHBondContact O-CB 3.4Å; A292-T302 PolarHBondContact O-OG1 3.43Å; L295-T302 HydrophobicContact CD1-CG2 4.2Å; N296-T302 WeakPolarHBondContact ND2-CG2 3.41Å; N296-T302 PolarHBondContact ND2-OG1 2.79Å
303	I	98.6	Very high	96.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.1	161.1	-54.9	-172.3	0	0	0	108.2	T204 H205 I206 Q207 L256 A260 I282 P305	T204-I303 HydrophobicContact CG2-CD1 4.15Å; T204-I303 HydrophobicContact CG2-CG1 3.89Å; H205-I303 PolarHBondContact O-N 3.09Å; I206-I303 HydrophobicContact CD1-CB 3.93Å; I206-I303 HydrophobicContact CD1-CD1 3.6Å; I206-I303 HydrophobicContact CD1-CG1 3.87Å; Q207-I303 PolarHBondContact N-O 3.32Å; L256-I303 HydrophobicContact CB-CG2 3.85Å; L256-I303 HydrophobicContact CD1-CG2 3.83Å; L256-I303 HydrophobicContact CG-CG2 4.36Å; A260-I303 HydrophobicContact CB-CD1 3.52Å; A260-I303 HydrophobicContact CB-CG1 3.8Å; I282-I303 WeakPolarHBondContact O-CA 3.12Å; I303-P305 HydrophobicContact CG2-CG 4.32Å
304	L	98	Very high	96	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.212	C	C	.	.			trans	-117.7	95.7	169.3	174.6	51	0	0	0	109	Q207 I282 S283 L288 L291 A292 V309 L312	Q207-L304 HydrophobicContact CB-CD1 3.89Å; Q207-L304 HydrophobicContact CG-CD1 3.87Å; I282-L304 PolarHBondContact O-N 3.08Å; S283-L304 WeakPolarHBondContact CB-O 3.32Å; S283-L304 PolarHBondContact OG-O 2.93Å; L288-L304 HydrophobicContact CB-CD2 4Å; L288-L304 HydrophobicContact CB-CG 4.46Å; L288-L304 HydrophobicContact CD2-CD2 4.01Å; L288-L304 HydrophobicContact CG-CD2 4.47Å; L291-L304 HydrophobicContact CD2-CD2 4.21Å; A292-L304 HydrophobicContact CB-CB 3.72Å; A292-L304 HydrophobicContact CB-CD2 4.25Å; L304-V309 HydrophobicContact CD1-CG2 4.14Å; L304-V309 HydrophobicContact CG-CG2 4.34Å; L304-L312 HydrophobicContact CD1-CD2 3.85Å; L304-L312 HydrophobicContact CD2-CD2 3.74Å; L304-L312 HydrophobicContact CG-CD2 4.5Å
305	P	95.8	Very high	95.9	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.019	22%	0.218	C	C	.	.			trans	-61.3	155.9	170.6	-18.5	32.7	0	0	0	111	I206 W237 L256 I303 D307	I206-P305 HydrophobicContact CG2-CG 4.27Å; W237-P305 HydrophobicContact CE3-CG 4.4Å; W237-P305 HydrophobicContact CH2-CB 3.96Å; W237-P305 HydrophobicContact CH2-CG 3.47Å; W237-P305 VanDerWaalsContact CH2-CG 3.47Å; W237-P305 HydrophobicContact CZ2-CG 4.39Å; W237-P305 HydrophobicContact CZ3-CB 4.12Å; W237-P305 HydrophobicContact CZ3-CG 3.49Å; W237-P305 VanDerWaalsContact CZ3-CG 3.49Å; L256-P305 HydrophobicContact CD1-CB 4.45Å; I303-P305 HydrophobicContact CG2-CG 4.32Å; P305-D307 VanDerWaalsContact C-N 3.34Å
306	L	93.9	Very high	96	Very high	23 Å²	23	38 Å²	38	12%	0.12	21%	0.208	C	C	.	.	S	Bend	trans	-65	-40.5	178.7	-172.7	59.4	0	0	0	111.6	K64 L288 S308 V309	K64-L306 HydrophobicContact CD-CD2 4.39Å; K64-L306 HydrophobicContact CG-CB 4.35Å; K64-L306 HydrophobicContact CG-CD2 3.68Å; L288-L306 HydrophobicContact CD1-CD1 4.36Å; L306-S308 VanDerWaalsContact C-N 3.32Å; L306-S308 PolarHBondContact O-N 2.75Å; L306-V309 HydrophobicContact CD1-CG2 4.32Å; L306-V309 WeakPolarHBondContact O-CB 3.45Å; L306-V309 VanDerWaalsContact O-CG2 3.24Å; L306-V309 WeakPolarHBondContact O-CG2 3.23Å; L306-V309 PolarHBondContact O-N 3.47Å
307	D	91.2	Very high	96	Very high	110 Å²	110	38.8 Å²	38.8	59%	0.588	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-40.7	-175.6	-56.9	21.5	0	0	0	111.3	K64 P305 V309	K64-D307 IonicContact NZ-OD1 3.87Å; K64-D307 PolarHBondContact NZ-OD1 2.69Å; P305-D307 VanDerWaalsContact C-N 3.34Å; D307-V309 PolarHBondContact O-N 2.81Å
308	S	93	Very high	95.9	Very high	15 Å²	15	36.4 Å²	36.4	11%	0.105	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.6	174.6	-45.2	0	0	0	0	114.4	Q207 L306 T310 L312	Q207-S308 VanDerWaalsContact O-CB 3.29Å; Q207-S308 WeakPolarHBondContact O-CB 3.22Å; Q207-S308 PolarHBondContact O-OG 3.24Å; L306-S308 VanDerWaalsContact C-N 3.32Å; L306-S308 PolarHBondContact O-N 2.75Å; S308-T310 VanDerWaalsContact C-N 3.35Å; S308-L312 WeakPolarHBondContact O-CB 3.31Å; S308-L312 PolarHBondContact O-N 2.86Å
309	V	94.4	Very high	95.8	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-35.6	-179.1	177.8	0	0	0	0	111.5	L288 L304 L306 D307 E311 L312 F313	L288-V309 HydrophobicContact CD1-CG2 3.66Å; L288-V309 HydrophobicContact CD2-CG1 4.24Å; L288-V309 HydrophobicContact CD2-CG2 3.85Å; L288-V309 HydrophobicContact CG-CG2 4.43Å; L304-V309 HydrophobicContact CD1-CG2 4.14Å; L304-V309 HydrophobicContact CG-CG2 4.34Å; L306-V309 HydrophobicContact CD1-CG2 4.32Å; L306-V309 WeakPolarHBondContact O-CB 3.45Å; L306-V309 VanDerWaalsContact O-CG2 3.24Å; L306-V309 WeakPolarHBondContact O-CG2 3.23Å; L306-V309 PolarHBondContact O-N 3.47Å; D307-V309 PolarHBondContact O-N 2.81Å; V309-E311 PolarHBondContact O-N 3.38Å; V309-L312 PolarHBondContact O-N 3.12Å; V309-F313 HydrophobicContact CG1-CD1 3.68Å; V309-F313 HydrophobicContact CG1-CD2 3.7Å; V309-F313 HydrophobicContact CG1-CE1 3.71Å; V309-F313 HydrophobicContact CG1-CE2 3.75Å; V309-F313 HydrophobicContact CG1-CG 3.69Å; V309-F313 HydrophobicContact CG1-CZ 3.75Å; V309-F313 VanDerWaalsContact O-CB 3.23Å; V309-F313 WeakPolarHBondContact O-CB 3.37Å; V309-F313 WeakPolarHBondContact O-CG 3.42Å; V309-F313 PolarHBondContact O-N 2.96Å
310	T	92.9	Very high	95.6	Very high	116 Å²	116	43.9 Å²	43.9	71%	0.712	25%	0.247	S	C	*	.	H	α-helix	trans	-60.9	-46.9	-177.4	-56.6	0	0	0	0	111.5	S308 S314	S308-T310 VanDerWaalsContact C-N 3.35Å; T310-S314 PolarHBondContact O-N 2.85Å
311	E	92.9	Very high	95.4	Very high	123 Å²	123	41.4 Å²	41.4	58%	0.575	24%	0.238	S	C	*	.	H	α-helix	trans	-63.9	-52.2	175.3	-174.3	-171.6	-170.3	0	0	110.8	V309 F313 S314	V309-E311 PolarHBondContact O-N 3.38Å; E311-F313 VanDerWaalsContact C-N 3.26Å; E311-F313 PolarHBondContact O-N 3.26Å; E311-S314 WeakPolarHBondContact O-CB 3.3Å; E311-S314 PolarHBondContact O-N 2.79Å; E311-S314 VanDerWaalsContact O-N 3.13Å; E311-S314 PolarHBondContact O-OG 2.66Å
312	L	94.3	Very high	95.1	Very high	20 Å²	20	45.2 Å²	45.2	11%	0.105	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-38.6	-179.6	-178.2	63.5	0	0	0	112.4	Q207 L291 L304 S308 V309 L316	Q207-L312 HydrophobicContact CG-CD2 4.31Å; L291-L312 HydrophobicContact CD2-CD2 3.63Å; L291-L312 HydrophobicContact CD2-CG 4.4Å; L291-L312 HydrophobicContact CG-CD2 4.34Å; L304-L312 HydrophobicContact CD1-CD2 3.85Å; L304-L312 HydrophobicContact CD2-CD2 3.74Å; L304-L312 HydrophobicContact CG-CD2 4.5Å; S308-L312 WeakPolarHBondContact O-CB 3.31Å; S308-L312 PolarHBondContact O-N 2.86Å; V309-L312 PolarHBondContact O-N 3.12Å; L312-L316 WeakPolarHBondContact O-CB 3.43Å; L312-L316 PolarHBondContact O-N 2.98Å
313	F	96.9	Very high	94.8	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-81	-17.9	-176.9	-80.6	23.2	0	0	0	113.2	L288 L291 V309 E311 T315 L316 I321 M341 G342 L367	L288-F313 HydrophobicContact CD2-CE1 4.11Å; L288-F313 HydrophobicContact CD2-CZ 3.79Å; L291-F313 HydrophobicContact CD2-CE1 3.67Å; L291-F313 HydrophobicContact CD2-CZ 4.47Å; V309-F313 HydrophobicContact CG1-CD1 3.68Å; V309-F313 HydrophobicContact CG1-CD2 3.7Å; V309-F313 HydrophobicContact CG1-CE1 3.71Å; V309-F313 HydrophobicContact CG1-CE2 3.75Å; V309-F313 HydrophobicContact CG1-CG 3.69Å; V309-F313 HydrophobicContact CG1-CZ 3.75Å; V309-F313 VanDerWaalsContact O-CB 3.23Å; V309-F313 WeakPolarHBondContact O-CB 3.37Å; V309-F313 WeakPolarHBondContact O-CG 3.42Å; V309-F313 PolarHBondContact O-N 2.96Å; E311-F313 VanDerWaalsContact C-N 3.26Å; E311-F313 PolarHBondContact O-N 3.26Å; F313-T315 PolarHBondContact O-N 3.05Å; F313-L316 HydrophobicContact CD1-CD2 3.87Å; F313-L316 HydrophobicContact CE1-CD2 3.81Å; F313-I321 HydrophobicContact CE1-CD1 4.06Å; F313-I321 HydrophobicContact CE2-CD1 4.34Å; F313-I321 HydrophobicContact CZ-CD1 3.73Å; F313-M341 HydrophobicContact CB-CB 4.15Å; F313-M341 HydrophobicContact CD2-CB 3.74Å; F313-M341 HydrophobicContact CD2-CG 3.4Å; F313-M341 VanDerWaalsContact CD2-CG 3.4Å; F313-M341 HydrophobicContact CE2-CB 4.25Å; F313-M341 HydrophobicContact CE2-CG 3.55Å; F313-M341 HydrophobicContact CG-CB 3.96Å; F313-M341 HydrophobicContact CG-CG 4.14Å; F313-M341 HydrophobicContact CZ-CG 4.39Å; F313-M341 PolarHBondContact O-N 3.29Å; F313-G342 PolarHBondContact O-N 3.41Å; F313-L367 VanDerWaalsContact CE2-O 3.32Å; F313-L367 WeakPolarHBondContact CE2-O 3.25Å
314	S	95.9	Very high	94.6	Very high	64 Å²	64	50.1 Å²	50.1	45%	0.448	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-30.1	174.7	74.7	0	0	0	0	113	T310 E311 N340	T310-S314 PolarHBondContact O-N 2.85Å; E311-S314 WeakPolarHBondContact O-CB 3.3Å; E311-S314 PolarHBondContact O-N 2.79Å; E311-S314 VanDerWaalsContact O-N 3.13Å; E311-S314 PolarHBondContact O-OG 2.66Å; S314-N340 WeakPolarHBondContact O-CB 3.4Å; S314-N340 PolarHBondContact O-ND2 3.3Å
315	T	95.6	Very high	94.4	Very high	102 Å²	102	53.1 Å²	53.1	63%	0.626	31%	0.31	S	S	*	.	H	α-helix	trans	-113.7	-10.8	-177.7	55.3	0	0	0	0	114.3	F313 P317 N340	F313-T315 PolarHBondContact O-N 3.05Å; T315-P317 VanDerWaalsContact O-CD 3.3Å; T315-P317 WeakPolarHBondContact O-CD 3.41Å; T315-N340 PolarHBondContact O-OD1 3.13Å
316	L	96.3	Very high	94.2	Very high	22 Å²	22	55 Å²	55	12%	0.115	33%	0.329	C	S	.	.	S	Bend	trans	-83.2	115.9	-176.4	-178	67.4	0	0	0	112.1	L291 L312 F313 K320 I321 N340 M341	L291-L316 HydrophobicContact CD1-CD1 4.24Å; L291-L316 HydrophobicContact CD1-CD2 3.89Å; L291-L316 HydrophobicContact CD2-CD2 3.56Å; L291-L316 HydrophobicContact CG-CD2 4.39Å; L312-L316 WeakPolarHBondContact O-CB 3.43Å; L312-L316 PolarHBondContact O-N 2.98Å; F313-L316 HydrophobicContact CD1-CD2 3.87Å; F313-L316 HydrophobicContact CE1-CD2 3.81Å; L316-K320 HydrophobicContact CD1-CB 3.66Å; L316-K320 HydrophobicContact CD1-CG 3.97Å; L316-K320 HydrophobicContact CG-CB 4.22Å; L316-I321 HydrophobicContact CD2-CD1 3.65Å; L316-I321 HydrophobicContact CD2-CG1 4.34Å; L316-N340 CarbonylContact O-C 3.53Å; L316-N340 VanDerWaalsContact O-CA 3.3Å; L316-N340 WeakPolarHBondContact O-CA 3.47Å; L316-M341 PolarHBondContact O-N 3.3Å
317	P	97.3	Very high	94.1	Very high	61 Å²	61	63.2 Å²	63.2	40%	0.396	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-64.5	140.7	-178.4	-24.6	35.9	0	0	0	112.8	T315 G319 K320 E339 N340	T315-P317 VanDerWaalsContact O-CD 3.3Å; T315-P317 WeakPolarHBondContact O-CD 3.41Å; P317-G319 PolarHBondContact O-N 3.39Å; P317-K320 HydrophobicContact CB-CG 4.42Å; P317-K320 WeakPolarHBondContact O-CB 3.4Å; P317-K320 PolarHBondContact O-N 3.43Å; P317-E339 VanDerWaalsContact CA-O 3.32Å; P317-E339 WeakPolarHBondContact CA-O 3.44Å; P317-N340 WeakPolarHBondContact CA-OD1 3.24Å
318	V	96.3	Very high	94.2	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-49.9	-37.9	-178.1	174.6	0	0	0	0	112.4	K320 I321 L324 I332 T333 V338 E339 M341 L344	V318-K320 PolarHBondContact O-N 2.73Å; V318-I321 PolarHBondContact O-N 2.75Å; V318-L324 HydrophobicContact CG1-CB 4.28Å; V318-L324 HydrophobicContact CG1-CD1 3.85Å; V318-L324 VanDerWaalsContact O-CB 3.3Å; V318-L324 WeakPolarHBondContact O-CB 3.41Å; V318-I332 HydrophobicContact CG1-CG2 4.37Å; V318-T333 HydrophobicContact CB-CG2 3.92Å; V318-T333 HydrophobicContact CG1-CG2 4.34Å; V318-T333 HydrophobicContact CG2-CG2 4.14Å; V318-V338 HydrophobicContact CG2-CG2 4.43Å; V318-E339 PolarHBondContact N-O 3.46Å; V318-M341 HydrophobicContact CG2-SD 4.49Å; V318-L344 HydrophobicContact CG2-CD1 3.92Å
319	G	94.9	Very high	94.2	Very high	44 Å²	44	60.5 Å²	60.5	45%	0.454	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-68	-9	178.6	0	0	0	0	0	116.3	P317 G325	P317-G319 PolarHBondContact O-N 3.39Å; G319-G325 WeakPolarHBondContact O-CA 3.03Å
320	K	93.9	Very high	94.3	Very high	157 Å²	157	62.9 Å²	62.9	68%	0.683	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-84.2	-22.6	173.9	-66	-74.1	-172.2	162	0	112.8	L316 P317 V318	L316-K320 HydrophobicContact CD1-CB 3.66Å; L316-K320 HydrophobicContact CD1-CG 3.97Å; L316-K320 HydrophobicContact CG-CB 4.22Å; P317-K320 HydrophobicContact CB-CG 4.42Å; P317-K320 WeakPolarHBondContact O-CB 3.4Å; P317-K320 PolarHBondContact O-N 3.43Å; V318-K320 PolarHBondContact O-N 2.73Å
321	I	94.3	Very high	94.4	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	35%	0.351	C	S	.	.	S	Bend	trans	-70.8	141.2	-178.8	-66.3	-67.2	0	0	0	110.8	V287 F313 L316 V318 N323 L324 G325 M341 L367	V287-I321 HydrophobicContact CG1-CG2 4.03Å; F313-I321 HydrophobicContact CE1-CD1 4.06Å; F313-I321 HydrophobicContact CE2-CD1 4.34Å; F313-I321 HydrophobicContact CZ-CD1 3.73Å; L316-I321 HydrophobicContact CD2-CD1 3.65Å; L316-I321 HydrophobicContact CD2-CG1 4.34Å; V318-I321 PolarHBondContact O-N 2.75Å; I321-N323 PolarHBondContact O-N 3.25Å; I321-L324 HydrophobicContact CB-CB 4.21Å; I321-L324 HydrophobicContact CB-CD1 4.06Å; I321-L324 HydrophobicContact CB-CG 4.36Å; I321-L324 HydrophobicContact CG2-CB 4.41Å; I321-L324 HydrophobicContact CG2-CD1 3.82Å; I321-L324 HydrophobicContact CG2-CG 4.07Å; I321-L324 PolarHBondContact O-N 2.92Å; I321-G325 PolarHBondContact O-N 3.47Å; I321-M341 HydrophobicContact CD1-CG 4.32Å; I321-M341 HydrophobicContact CG1-CB 4.3Å; I321-M341 HydrophobicContact CG1-CG 3.98Å; I321-M341 HydrophobicContact CG1-SD 3.95Å; I321-L367 HydrophobicContact CG2-CD2 3.75Å
322	R	92.8	Very high	94.5	Very high	81 Å²	81	54 Å²	54	31%	0.306	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	138.9	178.5	-179.1	175.1	166.6	-139.8	-19	110.2	Y177 V287 L324 E374	Y177-R322 PolarHBondContact OH-NH1 3.11Å; V287-R322 HydrophobicContact CG1-CB 4.44Å; R322-L324 PolarHBondContact O-N 2.72Å; R322-L324 VanDerWaalsContact O-N 3.15Å; R322-E374 IonicContact NH1-OE2 3.39Å; R322-E374 IonicContact NH2-OE2 2.82Å
323	N	92.6	Very high	94.6	Very high	103 Å²	103	55.2 Å²	55.2	55%	0.551	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	-15.6	-172	-46.4	-33.3	0	0	0	115.7	I321 W363	I321-N323 PolarHBondContact O-N 3.25Å; N323-W363 HydrophobicContact CB-CH2 4.28Å
324	L	94.3	Very high	94.6	Very high	0 Å²	0	63 Å²	63	0%	0	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-18.4	-177.9	-64.5	-172.6	0	0	0	114.8	V318 I321 R322 G326 M328 G329 I332 M341 W363 L364	V318-L324 HydrophobicContact CG1-CB 4.28Å; V318-L324 HydrophobicContact CG1-CD1 3.85Å; V318-L324 VanDerWaalsContact O-CB 3.3Å; V318-L324 WeakPolarHBondContact O-CB 3.41Å; I321-L324 HydrophobicContact CB-CB 4.21Å; I321-L324 HydrophobicContact CB-CD1 4.06Å; I321-L324 HydrophobicContact CB-CG 4.36Å; I321-L324 HydrophobicContact CG2-CB 4.41Å; I321-L324 HydrophobicContact CG2-CD1 3.82Å; I321-L324 HydrophobicContact CG2-CG 4.07Å; I321-L324 PolarHBondContact O-N 2.92Å; R322-L324 PolarHBondContact O-N 2.72Å; R322-L324 VanDerWaalsContact O-N 3.15Å; L324-G326 PolarHBondContact O-N 3.3Å; L324-M328 HydrophobicContact CD2-CB 4.37Å; L324-M328 HydrophobicContact CD2-CE 3.91Å; L324-M328 HydrophobicContact CD2-CG 3.82Å; L324-M328 HydrophobicContact CD2-SD 3.88Å; L324-G329 WeakPolarHBondContact O-CA 3.49Å; L324-G329 PolarHBondContact O-N 2.82Å; L324-G329 VanDerWaalsContact O-N 3.08Å; L324-I332 HydrophobicContact CD1-CD1 4.46Å; L324-I332 HydrophobicContact CD2-CD1 3.71Å; L324-M341 HydrophobicContact CD1-CE 4.27Å; L324-M341 HydrophobicContact CD1-SD 4.05Å; L324-W363 HydrophobicContact CD2-CH2 4.03Å; L324-W363 HydrophobicContact CD2-CZ3 3.84Å; L324-W363 HydrophobicContact CG-CH2 4.11Å; L324-W363 HydrophobicContact CG-CZ3 4.34Å; L324-L364 HydrophobicContact CD1-CD2 4.17Å; L324-L364 HydrophobicContact CD2-CD2 4.42Å
325	G	92.5	Very high	94.6	Very high	64 Å²	64	63 Å²	63	66%	0.66	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	40.4	176.8	0	0	0	0	0	117.2	G319 I321	G319-G325 WeakPolarHBondContact O-CA 3.03Å; I321-G325 PolarHBondContact O-N 3.47Å
326	G	92.4	Very high	94.6	Very high	42 Å²	42	59 Å²	59	43%	0.433	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.6	-152	178.3	0	0	0	0	0	111.4	L324 M328 G329 A330	L324-G326 PolarHBondContact O-N 3.3Å; G326-M328 PolarHBondContact O-N 3.42Å; G326-G329 PolarHBondContact O-N 2.85Å; G326-A330 PolarHBondContact O-N 3.47Å; G326-A330 VanDerWaalsContact O-N 3.12Å
327	K	91.1	Very high	94.6	Very high	195 Å²	195	60.8 Å²	60.8	85%	0.848	36%	0.364	S	S	*	.	H	α-helix	trans	-54.4	-31.4	-176.3	-66.5	-171.6	176.9	-171.2	0	114.4	S331	K327-S331 VanDerWaalsContact O-CB 3.27Å; K327-S331 WeakPolarHBondContact O-CB 3.2Å; K327-S331 PolarHBondContact O-N 2.9Å
328	M	92.8	Very high	94.6	Very high	67 Å²	67	58.2 Å²	58.2	33%	0.33	35%	0.348	S	S	.	.	H	α-helix	trans	-69.5	-51.6	-178.7	-175.2	174.8	171.8	0	0	111.8	L324 G326 A330 S331 I332 T360 W363	L324-M328 HydrophobicContact CD2-CB 4.37Å; L324-M328 HydrophobicContact CD2-CE 3.91Å; L324-M328 HydrophobicContact CD2-CG 3.82Å; L324-M328 HydrophobicContact CD2-SD 3.88Å; G326-M328 PolarHBondContact O-N 3.42Å; M328-A330 PolarHBondContact O-N 3.4Å; M328-S331 PolarHBondContact O-N 3.42Å; M328-I332 HydrophobicContact CE-CD1 4.27Å; M328-I332 HydrophobicContact CG-CD1 4.08Å; M328-I332 WeakPolarHBondContact O-CD1 3.32Å; M328-I332 WeakPolarHBondContact O-CG1 3.3Å; M328-I332 PolarHBondContact O-N 2.78Å; M328-T360 HydrophobicContact CE-CG2 3.33Å; M328-W363 HydrophobicContact CE-CE3 4.03Å; M328-W363 HydrophobicContact CE-CZ3 3.61Å; M328-W363 HydrophobicContact SD-CZ3 4.49Å
329	G	94.8	Very high	94.5	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-42.3	175	0	0	0	0	0	112.1	L324 G326 S331 I332 T333	L324-G329 WeakPolarHBondContact O-CA 3.49Å; L324-G329 PolarHBondContact O-N 2.82Å; L324-G329 VanDerWaalsContact O-N 3.08Å; G326-G329 PolarHBondContact O-N 2.85Å; G329-S331 VanDerWaalsContact C-N 3.31Å; G329-S331 PolarHBondContact O-N 3.42Å; G329-I332 WeakPolarHBondContact O-CB 3.47Å; G329-I332 PolarHBondContact O-N 2.84Å; G329-T333 WeakPolarHBondContact O-CG2 3.31Å; G329-T333 PolarHBondContact O-N 2.92Å; G329-T333 PolarHBondContact O-OG1 2.9Å
330	A	94.9	Very high	94.7	Very high	52 Å²	52	64.9 Å²	64.9	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-58	-42	174.5	0	0	0	0	0	112.5	G326 M328 I332 T333 E334	G326-A330 PolarHBondContact O-N 3.47Å; G326-A330 VanDerWaalsContact O-N 3.12Å; M328-A330 PolarHBondContact O-N 3.4Å; A330-I332 VanDerWaalsContact C-N 3.34Å; A330-T333 WeakPolarHBondContact CA-OG1 3.21Å; A330-T333 PolarHBondContact O-OG1 2.97Å; A330-E334 WeakPolarHBondContact O-CB 3.33Å; A330-E334 PolarHBondContact O-N 3.49Å
331	S	95.3	Very high	94.8	Very high	52 Å²	52	57.4 Å²	57.4	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-66.6	-33.9	174.6	-174.7	0	0	0	0	112.4	K327 M328 G329 T335	K327-S331 VanDerWaalsContact O-CB 3.27Å; K327-S331 WeakPolarHBondContact O-CB 3.2Å; K327-S331 PolarHBondContact O-N 2.9Å; M328-S331 PolarHBondContact O-N 3.42Å; G329-S331 VanDerWaalsContact C-N 3.31Å; G329-S331 PolarHBondContact O-N 3.42Å; S331-T335 WeakPolarHBondContact O-CB 3.38Å; S331-T335 PolarHBondContact O-N 3.11Å; S331-T335 PolarHBondContact O-OG1 3.22Å
332	I	95.4	Very high	94.9	Very high	0 Å²	0	58 Å²	58	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-68.4	-49.4	175.9	-69.6	159.3	0	0	0	110.4	V318 L324 M328 G329 A330 E334 T335 L336 V338 L344 F356 L364	V318-I332 HydrophobicContact CG1-CG2 4.37Å; L324-I332 HydrophobicContact CD1-CD1 4.46Å; L324-I332 HydrophobicContact CD2-CD1 3.71Å; M328-I332 HydrophobicContact CE-CD1 4.27Å; M328-I332 HydrophobicContact CG-CD1 4.08Å; M328-I332 WeakPolarHBondContact O-CD1 3.32Å; M328-I332 WeakPolarHBondContact O-CG1 3.3Å; M328-I332 PolarHBondContact O-N 2.78Å; G329-I332 WeakPolarHBondContact O-CB 3.47Å; G329-I332 PolarHBondContact O-N 2.84Å; A330-I332 VanDerWaalsContact C-N 3.34Å; I332-E334 VanDerWaalsContact C-N 3.34Å; I332-E334 PolarHBondContact O-N 3.27Å; I332-T335 PolarHBondContact O-N 2.84Å; I332-L336 HydrophobicContact CG2-CD1 4.05Å; I332-L336 WeakPolarHBondContact O-CB 3.23Å; I332-L336 PolarHBondContact O-N 3.44Å; I332-V338 HydrophobicContact CG2-CG2 4.14Å; I332-L344 HydrophobicContact CG2-CD1 4.35Å; I332-L344 HydrophobicContact CG2-CD2 4.2Å; I332-L344 HydrophobicContact CG2-CG 4.49Å; I332-F356 HydrophobicContact CB-CE1 4.49Å; I332-F356 HydrophobicContact CB-CZ 4.23Å; I332-F356 HydrophobicContact CG1-CD1 4.26Å; I332-F356 HydrophobicContact CG1-CE1 3.75Å; I332-F356 HydrophobicContact CG1-CE2 4.27Å; I332-F356 HydrophobicContact CG1-CZ 3.76Å; I332-L364 HydrophobicContact CD1-CD1 3.74Å; I332-L364 HydrophobicContact CD1-CD2 3.72Å; I332-L364 HydrophobicContact CD1-CG 4.39Å; I332-L364 HydrophobicContact CG1-CD1 4.12Å
333	T	96.4	Very high	95.1	Very high	47 Å²	47	56 Å²	56	29%	0.288	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-42.6	178.2	54.6	0	0	0	0	111.7	V318 G329 A330 G337 V338	V318-T333 HydrophobicContact CB-CG2 3.92Å; V318-T333 HydrophobicContact CG1-CG2 4.34Å; V318-T333 HydrophobicContact CG2-CG2 4.14Å; G329-T333 WeakPolarHBondContact O-CG2 3.31Å; G329-T333 PolarHBondContact O-N 2.92Å; G329-T333 PolarHBondContact O-OG1 2.9Å; A330-T333 WeakPolarHBondContact CA-OG1 3.21Å; A330-T333 PolarHBondContact O-OG1 2.97Å; T333-G337 PolarHBondContact O-N 3.3Å; T333-G337 VanDerWaalsContact O-N 3.12Å; T333-V338 WeakPolarHBondContact CA-O 3.49Å; T333-V338 WeakPolarHBondContact CB-O 3.44Å; T333-V338 HydrophobicContact CG2-CG2 4.35Å; T333-V338 VanDerWaalsContact CG2-O 3.25Å; T333-V338 WeakPolarHBondContact CG2-O 3.45Å; T333-V338 PolarHBondContact O-N 2.74Å
334	E	96.2	Very high	95.3	Very high	165 Å²	165	51 Å²	51	77%	0.771	31%	0.311	S	S	*	.	H	α-helix	trans	-68.9	-40.1	177.6	-176.1	176.3	-160	0	0	113	A330 I332	A330-E334 WeakPolarHBondContact O-CB 3.33Å; A330-E334 PolarHBondContact O-N 3.49Å; I332-E334 VanDerWaalsContact C-N 3.34Å; I332-E334 PolarHBondContact O-N 3.27Å
335	T	95.8	Very high	95.4	Very high	62 Å²	62	54 Å²	54	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-79.3	-35.1	-175.4	-56	0	0	0	0	112.9	S331 I332 H355 F356	S331-T335 WeakPolarHBondContact O-CB 3.38Å; S331-T335 PolarHBondContact O-N 3.11Å; S331-T335 PolarHBondContact O-OG1 3.22Å; I332-T335 PolarHBondContact O-N 2.84Å; T335-H355 HydrophobicContact CG2-CB 4.28Å; T335-H355 VanDerWaalsContact CG2-ND1 3.32Å; T335-H355 WeakPolarHBondContact CG2-ND1 3.26Å; T335-F356 HydrophobicContact CG2-CZ 4.24Å
336	L	96.4	Very high	95.6	Very high	18 Å²	18	58.2 Å²	58.2	9%	0.094	33%	0.325	C	S	.	.	H	α-helix	trans	-100.2	-13.5	-174.6	-59.2	-174.8	0	0	0	114.3	I332 V338 L344 F347 L352 F356	I332-L336 HydrophobicContact CG2-CD1 4.05Å; I332-L336 WeakPolarHBondContact O-CB 3.23Å; I332-L336 PolarHBondContact O-N 3.44Å; L336-V338 HydrophobicContact CB-CB 4.48Å; L336-V338 HydrophobicContact CB-CG1 3.73Å; L336-V338 HydrophobicContact CB-CG2 3.99Å; L336-L344 HydrophobicContact CD1-CG 4.35Å; L336-F347 HydrophobicContact CB-CE1 4.3Å; L336-F347 HydrophobicContact CB-CE2 4.15Å; L336-F347 HydrophobicContact CB-CZ 3.77Å; L336-F347 HydrophobicContact CD1-CD2 4.21Å; L336-F347 HydrophobicContact CD1-CE2 4.12Å; L336-F347 HydrophobicContact CD1-CZ 4.35Å; L336-F347 HydrophobicContact CD2-CD1 4.19Å; L336-F347 HydrophobicContact CD2-CE1 3.93Å; L336-F347 HydrophobicContact CD2-CZ 4.24Å; L336-F347 HydrophobicContact CG-CZ 4.34Å; L336-L352 HydrophobicContact CD1-CD2 3.74Å; L336-F356 HydrophobicContact CD1-CE2 4.01Å; L336-F356 HydrophobicContact CD1-CZ 4.32Å; L336-F356 HydrophobicContact CD2-CE2 4.07Å; L336-F356 HydrophobicContact CD2-CZ 4.23Å; L336-F356 HydrophobicContact CG-CE2 4.07Å; L336-F356 HydrophobicContact CG-CZ 4.01Å
337	G	96.6	Very high	95.9	Very high	61 Å²	61	57.9 Å²	57.9	63%	0.629	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	56.5	-171.4	0	0	0	0	0	111.4	T333	T333-G337 PolarHBondContact O-N 3.3Å; T333-G337 VanDerWaalsContact O-N 3.12Å
338	V	96.4	Very high	96.2	Very high	7 Å²	7	51 Å²	51	4%	0.042	29%	0.289	C	S	.	.			trans	-131.9	151.4	-176.1	-60.9	0	0	0	0	110.9	V318 I332 T333 L336 D343 L344 F347	V318-V338 HydrophobicContact CG2-CG2 4.43Å; I332-V338 HydrophobicContact CG2-CG2 4.14Å; T333-V338 WeakPolarHBondContact CA-O 3.49Å; T333-V338 WeakPolarHBondContact CB-O 3.44Å; T333-V338 HydrophobicContact CG2-CG2 4.35Å; T333-V338 VanDerWaalsContact CG2-O 3.25Å; T333-V338 WeakPolarHBondContact CG2-O 3.45Å; T333-V338 PolarHBondContact O-N 2.74Å; L336-V338 HydrophobicContact CB-CB 4.48Å; L336-V338 HydrophobicContact CB-CG1 3.73Å; L336-V338 HydrophobicContact CB-CG2 3.99Å; V338-D343 HydrophobicContact CB-CB 3.65Å; V338-D343 HydrophobicContact CG1-CB 3.52Å; V338-L344 HydrophobicContact CB-CD1 4.34Å; V338-L344 HydrophobicContact CG2-CD1 3.9Å; V338-F347 HydrophobicContact CG1-CE2 3.79Å; V338-F347 HydrophobicContact CG1-CZ 4.24Å
339	E	95.8	Very high	96.4	Very high	150 Å²	150	51 Å²	51	70%	0.701	29%	0.29	S	S	*	.			trans	-117.3	-43.2	176.3	-62.2	-170.1	173	0	0	111	P317 V318 D343	P317-E339 VanDerWaalsContact CA-O 3.32Å; P317-E339 WeakPolarHBondContact CA-O 3.44Å; V318-E339 PolarHBondContact N-O 3.46Å; E339-D343 PolarHBondContact N-OD2 2.86Å
340	N	97.6	Very high	96.5	Very high	35 Å²	35	54.6 Å²	54.6	19%	0.187	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-108.9	156.8	-172.3	-64.9	-25.5	0	0	0	112.6	S314 T315 L316 P317 G342 D343	S314-N340 WeakPolarHBondContact O-CB 3.4Å; S314-N340 PolarHBondContact O-ND2 3.3Å; T315-N340 PolarHBondContact O-OD1 3.13Å; L316-N340 CarbonylContact O-C 3.53Å; L316-N340 VanDerWaalsContact O-CA 3.3Å; L316-N340 WeakPolarHBondContact O-CA 3.47Å; P317-N340 WeakPolarHBondContact CA-OD1 3.24Å; N340-G342 PolarHBondContact O-N 2.94Å; N340-D343 PolarHBondContact N-OD2 3.31Å; N340-D343 WeakPolarHBondContact O-CB 3.19Å; N340-D343 PolarHBondContact O-N 3.29Å; N340-D343 VanDerWaalsContact O-N 3.14Å
341	M	97.1	Very high	96.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-65.6	-29.6	-174.8	-164.8	64.4	-166.5	0	0	112.6	F313 L316 V318 I321 L324 D343 L344 L367 C368	F313-M341 HydrophobicContact CB-CB 4.15Å; F313-M341 HydrophobicContact CD2-CB 3.74Å; F313-M341 HydrophobicContact CD2-CG 3.4Å; F313-M341 VanDerWaalsContact CD2-CG 3.4Å; F313-M341 HydrophobicContact CE2-CB 4.25Å; F313-M341 HydrophobicContact CE2-CG 3.55Å; F313-M341 HydrophobicContact CG-CB 3.96Å; F313-M341 HydrophobicContact CG-CG 4.14Å; F313-M341 HydrophobicContact CZ-CG 4.39Å; F313-M341 PolarHBondContact O-N 3.29Å; L316-M341 PolarHBondContact O-N 3.3Å; V318-M341 HydrophobicContact CG2-SD 4.49Å; I321-M341 HydrophobicContact CD1-CG 4.32Å; I321-M341 HydrophobicContact CG1-CB 4.3Å; I321-M341 HydrophobicContact CG1-CG 3.98Å; I321-M341 HydrophobicContact CG1-SD 3.95Å; L324-M341 HydrophobicContact CD1-CE 4.27Å; L324-M341 HydrophobicContact CD1-SD 4.05Å; M341-D343 VanDerWaalsContact C-N 3.31Å; M341-D343 PolarHBondContact O-N 3.36Å; M341-L344 HydrophobicContact CE-CD2 3.95Å; M341-L344 PolarHBondContact O-N 2.93Å; M341-L344 HydrophobicContact SD-CD2 4.18Å; M341-L367 HydrophobicContact CE-CB 4.13Å; M341-L367 HydrophobicContact CE-CD2 3.9Å; M341-L367 HydrophobicContact CE-CG 3.89Å; M341-C368 HydrophobicContact CE-CB 3.98Å; M341-C368 WeakPolarHBondContact O-CB 3.2Å
342	G	95.9	Very high	96.7	Very high	15 Å²	15	53.6 Å²	53.6	16%	0.155	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-66.6	-27.2	175.4	0	0	0	0	0	113.7	F313 N340 L344 T345	F313-G342 PolarHBondContact O-N 3.41Å; N340-G342 PolarHBondContact O-N 2.94Å; G342-L344 PolarHBondContact O-N 2.89Å; G342-L344 VanDerWaalsContact O-N 3.13Å; G342-T345 WeakPolarHBondContact O-CB 3.16Å; G342-T345 WeakPolarHBondContact O-CG2 3.49Å; G342-T345 PolarHBondContact O-N 3.18Å; G342-T345 PolarHBondContact O-OG1 3.23Å
343	D	97.1	Very high	96.7	Very high	39 Å²	39	54.4 Å²	54.4	21%	0.209	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.8	177.8	-72.1	-44.9	0	0	0	112.8	V338 E339 N340 M341 T345 R346 F347	V338-D343 HydrophobicContact CB-CB 3.65Å; V338-D343 HydrophobicContact CG1-CB 3.52Å; E339-D343 PolarHBondContact N-OD2 2.86Å; N340-D343 PolarHBondContact N-OD2 3.31Å; N340-D343 WeakPolarHBondContact O-CB 3.19Å; N340-D343 PolarHBondContact O-N 3.29Å; N340-D343 VanDerWaalsContact O-N 3.14Å; M341-D343 VanDerWaalsContact C-N 3.31Å; M341-D343 PolarHBondContact O-N 3.36Å; D343-T345 PolarHBondContact O-N 3.49Å; D343-R346 WeakPolarHBondContact O-CB 3.38Å; D343-R346 VanDerWaalsContact O-CG 3.29Å; D343-R346 WeakPolarHBondContact O-CG 3.18Å; D343-R346 PolarHBondContact O-N 3.41Å; D343-R346 PolarHBondContact O-NE 3.28Å; D343-R346 IonicContact OD1-CZ 2.66Å; D343-R346 IonicContact OD1-NH1 3.52Å; D343-R346 PolarHBondContact OD1-NH1 3.05Å; D343-R346 VanDerWaalsContact OD1-NH1 3.14Å; D343-F347 WeakPolarHBondContact O-CE2 3.39Å
344	L	96.7	Very high	96.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-70.2	-20.7	179.9	-79.5	69.8	0	0	0	112.2	V318 I332 L336 V338 M341 G342 R346 F347 L364 C368	V318-L344 HydrophobicContact CG2-CD1 3.92Å; I332-L344 HydrophobicContact CG2-CD1 4.35Å; I332-L344 HydrophobicContact CG2-CD2 4.2Å; I332-L344 HydrophobicContact CG2-CG 4.49Å; L336-L344 HydrophobicContact CD1-CG 4.35Å; V338-L344 HydrophobicContact CB-CD1 4.34Å; V338-L344 HydrophobicContact CG2-CD1 3.9Å; M341-L344 HydrophobicContact CE-CD2 3.95Å; M341-L344 PolarHBondContact O-N 2.93Å; M341-L344 HydrophobicContact SD-CD2 4.18Å; G342-L344 PolarHBondContact O-N 2.89Å; G342-L344 VanDerWaalsContact O-N 3.13Å; L344-R346 PolarHBondContact O-N 3.42Å; L344-F347 PolarHBondContact O-N 3.01Å; L344-L364 HydrophobicContact CD2-CB 4.38Å; L344-L364 HydrophobicContact CD2-CD2 4.11Å; L344-C368 HydrophobicContact CB-CB 3.58Å
345	T	96.4	Very high	96.7	Very high	63 Å²	63	56.5 Å²	56.5	39%	0.387	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.4	-27.3	177.4	61.9	0	0	0	0	112.5	G342 D343 F347 C368 R369	G342-T345 WeakPolarHBondContact O-CB 3.16Å; G342-T345 WeakPolarHBondContact O-CG2 3.49Å; G342-T345 PolarHBondContact O-N 3.18Å; G342-T345 PolarHBondContact O-OG1 3.23Å; D343-T345 PolarHBondContact O-N 3.49Å; T345-F347 PolarHBondContact O-N 2.87Å; T345-C368 HydrophobicContact CG2-CB 4.3Å; T345-R369 PolarHBondContact O-NH2 2.81Å
346	R	97	Very high	96.6	Very high	151 Å²	151	54.1 Å²	54.1	57%	0.57	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-66.2	-13.8	178.4	-51.4	179.4	-53.4	-169.9	16.3	113.7	D343 L344	D343-R346 WeakPolarHBondContact O-CB 3.38Å; D343-R346 VanDerWaalsContact O-CG 3.29Å; D343-R346 WeakPolarHBondContact O-CG 3.18Å; D343-R346 PolarHBondContact O-N 3.41Å; D343-R346 PolarHBondContact O-NE 3.28Å; D343-R346 IonicContact OD1-CZ 2.66Å; D343-R346 IonicContact OD1-NH1 3.52Å; D343-R346 PolarHBondContact OD1-NH1 3.05Å; D343-R346 VanDerWaalsContact OD1-NH1 3.14Å; L344-R346 PolarHBondContact O-N 3.42Å
347	F	97.6	Very high	96.6	Very high	35 Å²	35	54.9 Å²	54.9	15%	0.154	31%	0.311	C	S	.	.	S	Bend	trans	-105.5	136.5	-177.5	-59.8	-94	0	0	0	110.9	L336 V338 D343 L344 T345 L352	L336-F347 HydrophobicContact CB-CE1 4.3Å; L336-F347 HydrophobicContact CB-CE2 4.15Å; L336-F347 HydrophobicContact CB-CZ 3.77Å; L336-F347 HydrophobicContact CD1-CD2 4.21Å; L336-F347 HydrophobicContact CD1-CE2 4.12Å; L336-F347 HydrophobicContact CD1-CZ 4.35Å; L336-F347 HydrophobicContact CD2-CD1 4.19Å; L336-F347 HydrophobicContact CD2-CE1 3.93Å; L336-F347 HydrophobicContact CD2-CZ 4.24Å; L336-F347 HydrophobicContact CG-CZ 4.34Å; V338-F347 HydrophobicContact CG1-CE2 3.79Å; V338-F347 HydrophobicContact CG1-CZ 4.24Å; D343-F347 WeakPolarHBondContact O-CE2 3.39Å; L344-F347 PolarHBondContact O-N 3.01Å; T345-F347 PolarHBondContact O-N 2.87Å; F347-L352 HydrophobicContact CB-CD1 4.33Å; F347-L352 HydrophobicContact CB-CD2 3.88Å; F347-L352 HydrophobicContact CB-CG 3.88Å; F347-L352 HydrophobicContact CG-CD2 4.34Å
348	S	97.5	Very high	96.5	Very high	52 Å²	52	59.6 Å²	59.6	36%	0.364	32%	0.317	S	S	.	.			trans	-70	154.9	172.2	65.4	0	0	0	0	111.7	A350 Q351 L352	S348-A350 PolarHBondContact O-N 3.18Å; S348-Q351 PolarHBondContact O-N 3.31Å; S348-Q351 WeakPolarHBondContact OG-CG 3.47Å; S348-Q351 PolarHBondContact OG-N 3.49Å; S348-Q351 PolarHBondContact OG-OE1 3.23Å; S348-L352 PolarHBondContact O-N 2.78Å; S348-L352 VanDerWaalsContact O-N 3.08Å
349	L	97.3	Very high	96.4	Very high	67 Å²	67	67 Å²	67	35%	0.351	35%	0.349	S	S	.	.	H	α-helix	trans	-49.6	-40.7	172.2	174.8	60.3	0	0	0	112.3	L352 G353 Q362 Y365	L349-L352 PolarHBondContact O-N 2.8Å; L349-G353 PolarHBondContact O-N 3.33Å; L349-Q362 VanDerWaalsContact CD1-CA 3.48Å; L349-Q362 HydrophobicContact CD1-CB 4.04Å; L349-Q362 VanDerWaalsContact CD2-OE1 3.3Å; L349-Y365 HydrophobicContact CB-CD1 4.48Å; L349-Y365 HydrophobicContact CB-CD2 3.92Å; L349-Y365 HydrophobicContact CB-CE2 4.19Å; L349-Y365 HydrophobicContact CB-CG 4.08Å; L349-Y365 HydrophobicContact CD1-CG 4.27Å
350	A	97.2	Very high	96.3	Very high	75 Å²	75	61.5 Å²	61.5	62%	0.62	33%	0.325	S	S	*	.	H	α-helix	trans	-63.8	-41.3	178.7	0	0	0	0	0	112.8	S348 Q354	S348-A350 PolarHBondContact O-N 3.18Å; A350-Q354 WeakPolarHBondContact O-CB 3.05Å; A350-Q354 PolarHBondContact O-N 3.45Å
351	Q	97.2	Very high	96.3	Very high	84 Å²	84	59.8 Å²	59.8	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-46.5	176.3	-71.3	161.2	-62.5	0	0	111.2	S348 G353 Q354 H355	S348-Q351 PolarHBondContact O-N 3.31Å; S348-Q351 WeakPolarHBondContact OG-CG 3.47Å; S348-Q351 PolarHBondContact OG-N 3.49Å; S348-Q351 PolarHBondContact OG-OE1 3.23Å; Q351-G353 VanDerWaalsContact C-N 3.32Å; Q351-G353 PolarHBondContact O-N 3.13Å; Q351-Q354 PolarHBondContact O-N 3.05Å; Q351-H355 PolarHBondContact O-CD2 2.67Å; Q351-H355 PolarHBondContact O-N 2.56Å
352	L	96.7	Very high	96.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-39	178.2	-64.2	175.9	0	0	0	111.6	L336 F347 S348 L349 H355 F356 L364 Y365	L336-L352 HydrophobicContact CD1-CD2 3.74Å; F347-L352 HydrophobicContact CB-CD1 4.33Å; F347-L352 HydrophobicContact CB-CD2 3.88Å; F347-L352 HydrophobicContact CB-CG 3.88Å; F347-L352 HydrophobicContact CG-CD2 4.34Å; S348-L352 PolarHBondContact O-N 2.78Å; S348-L352 VanDerWaalsContact O-N 3.08Å; L349-L352 PolarHBondContact O-N 2.8Å; L352-H355 PolarHBondContact O-N 3.28Å; L352-F356 HydrophobicContact CD2-CE2 4.24Å; L352-F356 WeakPolarHBondContact O-CD2 3.41Å; L352-F356 PolarHBondContact O-N 3.22Å; L352-L364 HydrophobicContact CD1-CB 4.34Å; L352-Y365 HydrophobicContact CD1-CD2 4.22Å
353	G	96.5	Very high	96.2	Very high	17 Å²	17	65.3 Å²	65.3	18%	0.175	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-37.9	172.8	0	0	0	0	0	113.3	L349 Q351 G357	L349-G353 PolarHBondContact O-N 3.33Å; Q351-G353 VanDerWaalsContact C-N 3.32Å; Q351-G353 PolarHBondContact O-N 3.13Å; G353-G357 CarbonylContact O-C 3.6Å; G353-G357 WeakPolarHBondContact O-CA 3.41Å; G353-G357 PolarHBondContact O-N 2.73Å
354	Q	96.5	Very high	96.2	Very high	162 Å²	162	63.4 Å²	63.4	76%	0.757	33%	0.325	S	S	*	.	H	α-helix	trans	-66.2	-39.3	176	-176.2	178.5	3	0	0	112.5	A350 Q351	A350-Q354 WeakPolarHBondContact O-CB 3.05Å; A350-Q354 PolarHBondContact O-N 3.45Å; Q351-Q354 PolarHBondContact O-N 3.05Å
355	H	94.6	Very high	96.2	Very high	93 Å²	93	66.7 Å²	66.7	43%	0.431	34%	0.338	S	S	.	.	H	α-helix	trans	-80	-40.2	-178.6	-76.2	-71.9	0	0	0	113.8	T335 Q351 L352	T335-H355 HydrophobicContact CG2-CB 4.28Å; T335-H355 VanDerWaalsContact CG2-ND1 3.32Å; T335-H355 WeakPolarHBondContact CG2-ND1 3.26Å; Q351-H355 PolarHBondContact O-CD2 2.67Å; Q351-H355 PolarHBondContact O-N 2.56Å; L352-H355 PolarHBondContact O-N 3.28Å
356	F	94.4	Very high	96.2	Very high	12 Å²	12	64.5 Å²	64.5	5%	0.053	32%	0.324	C	S	.	.	H	α-helix	trans	-117.3	0.5	-169.4	-51.8	-69	0	0	0	114.5	I332 T335 L336 L352 T360 L364	I332-F356 HydrophobicContact CB-CE1 4.49Å; I332-F356 HydrophobicContact CB-CZ 4.23Å; I332-F356 HydrophobicContact CG1-CD1 4.26Å; I332-F356 HydrophobicContact CG1-CE1 3.75Å; I332-F356 HydrophobicContact CG1-CE2 4.27Å; I332-F356 HydrophobicContact CG1-CZ 3.76Å; T335-F356 HydrophobicContact CG2-CZ 4.24Å; L336-F356 HydrophobicContact CD1-CE2 4.01Å; L336-F356 HydrophobicContact CD1-CZ 4.32Å; L336-F356 HydrophobicContact CD2-CE2 4.07Å; L336-F356 HydrophobicContact CD2-CZ 4.23Å; L336-F356 HydrophobicContact CG-CE2 4.07Å; L336-F356 HydrophobicContact CG-CZ 4.01Å; L352-F356 HydrophobicContact CD2-CE2 4.24Å; L352-F356 WeakPolarHBondContact O-CD2 3.41Å; L352-F356 PolarHBondContact O-N 3.22Å; F356-T360 HydrophobicContact CB-CG2 3.72Å; F356-T360 WeakPolarHBondContact O-CB 3.46Å; F356-T360 PolarHBondContact O-OG1 3Å; F356-L364 HydrophobicContact CB-CD1 4.43Å; F356-L364 HydrophobicContact CD2-CD1 3.68Å; F356-L364 HydrophobicContact CE2-CD1 4.19Å; F356-L364 HydrophobicContact CG-CD1 4.07Å
357	G	95.9	Very high	96.2	Very high	35 Å²	35	57.3 Å²	57.3	36%	0.361	30%	0.297	S	S	.	.			trans	84.8	144.7	-172	0	0	0	0	0	112	G353 K359 T360 G361	G353-G357 CarbonylContact O-C 3.6Å; G353-G357 WeakPolarHBondContact O-CA 3.41Å; G353-G357 PolarHBondContact O-N 2.73Å; G357-K359 PolarHBondContact O-N 2.67Å; G357-T360 WeakPolarHBondContact O-CA 3.45Å; G357-T360 WeakPolarHBondContact O-CB 3.4Å; G357-T360 PolarHBondContact O-N 2.86Å; G357-G361 PolarHBondContact O-N 2.69Å
358	E	94.9	Very high	96.1	Very high	159 Å²	159	55.9 Å²	55.9	74%	0.743	29%	0.291	S	S	*	.	H	α-helix	trans	-37.6	-60.6	-173.4	-177.9	-176.5	-150.4	0	0	114.6	T360 G361 Q362	E358-T360 VanDerWaalsContact C-N 3.32Å; E358-T360 PolarHBondContact O-N 3.32Å; E358-G361 PolarHBondContact O-N 2.98Å; E358-G361 VanDerWaalsContact O-N 3.17Å; E358-Q362 PolarHBondContact O-N 3.2Å
359	K	94.3	Very high	96	Very high	164 Å²	164	57.2 Å²	57.2	71%	0.713	29%	0.288	S	S	*	.	H	α-helix	trans	-61.8	-37.7	-177.7	-65.1	176.5	-178.4	171.5	0	113.2	G357 W363	G357-K359 PolarHBondContact O-N 2.67Å; K359-W363 WeakPolarHBondContact O-CB 3.44Å; K359-W363 PolarHBondContact O-N 3.18Å; K359-W363 VanDerWaalsContact O-N 3.11Å
360	T	94.5	Very high	96	Very high	33 Å²	33	54 Å²	54	20%	0.202	27%	0.271	C	S	.	.	H	α-helix	trans	-72.4	-39.5	177.6	-36.6	0	0	0	0	110.7	M328 F356 G357 E358 W363 L364	M328-T360 HydrophobicContact CE-CG2 3.33Å; F356-T360 HydrophobicContact CB-CG2 3.72Å; F356-T360 WeakPolarHBondContact O-CB 3.46Å; F356-T360 PolarHBondContact O-OG1 3Å; G357-T360 WeakPolarHBondContact O-CA 3.45Å; G357-T360 WeakPolarHBondContact O-CB 3.4Å; G357-T360 PolarHBondContact O-N 2.86Å; E358-T360 VanDerWaalsContact C-N 3.32Å; E358-T360 PolarHBondContact O-N 3.32Å; T360-W363 PolarHBondContact O-N 3.22Å; T360-L364 HydrophobicContact CG2-CD1 4.28Å; T360-L364 WeakPolarHBondContact O-CB 3.47Å; T360-L364 VanDerWaalsContact O-CG 3.27Å; T360-L364 WeakPolarHBondContact O-CG 3.32Å; T360-L364 PolarHBondContact O-N 3.24Å
361	G	96.6	Very high	95.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-45.5	177.6	0	0	0	0	0	112.3	G357 E358 L364 Y365	G357-G361 PolarHBondContact O-N 2.69Å; E358-G361 PolarHBondContact O-N 2.98Å; E358-G361 VanDerWaalsContact O-N 3.17Å; G361-L364 PolarHBondContact O-N 2.85Å; G361-Y365 VanDerWaalsContact O-CB 3.26Å; G361-Y365 WeakPolarHBondContact O-CB 3.32Å; G361-Y365 PolarHBondContact O-N 2.9Å
362	Q	96.4	Very high	95.8	Very high	73 Å²	73	48.3 Å²	48.3	34%	0.341	23%	0.232	S	C	.	.	H	α-helix	trans	-58.1	-54.4	172	-173.9	65.1	58.4	0	0	111.1	L349 E358 L364 Y365 D366	L349-Q362 VanDerWaalsContact CD1-CA 3.48Å; L349-Q362 HydrophobicContact CD1-CB 4.04Å; L349-Q362 VanDerWaalsContact CD2-OE1 3.3Å; E358-Q362 PolarHBondContact O-N 3.2Å; Q362-L364 VanDerWaalsContact C-N 3.29Å; Q362-L364 PolarHBondContact O-N 3Å; Q362-Y365 WeakPolarHBondContact O-CB 3.28Å; Q362-Y365 PolarHBondContact O-N 2.98Å; Q362-D366 WeakPolarHBondContact CG-OD2 3.49Å; Q362-D366 PolarHBondContact NE2-OD1 3.14Å; Q362-D366 PolarHBondContact NE2-OD2 3.36Å; Q362-D366 VanDerWaalsContact O-CG 3.32Å; Q362-D366 PolarHBondContact O-N 3.49Å
363	W	95.7	Very high	95.7	Very high	57 Å²	57	52.8 Å²	52.8	22%	0.216	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-38.1	179.8	179.3	72.5	0	0	0	113	N323 L324 M328 K359 T360 L367	N323-W363 HydrophobicContact CB-CH2 4.28Å; L324-W363 HydrophobicContact CD2-CH2 4.03Å; L324-W363 HydrophobicContact CD2-CZ3 3.84Å; L324-W363 HydrophobicContact CG-CH2 4.11Å; L324-W363 HydrophobicContact CG-CZ3 4.34Å; M328-W363 HydrophobicContact CE-CE3 4.03Å; M328-W363 HydrophobicContact CE-CZ3 3.61Å; M328-W363 HydrophobicContact SD-CZ3 4.49Å; K359-W363 WeakPolarHBondContact O-CB 3.44Å; K359-W363 PolarHBondContact O-N 3.18Å; K359-W363 VanDerWaalsContact O-N 3.11Å; T360-W363 PolarHBondContact O-N 3.22Å; W363-L367 HydrophobicContact CH2-CD2 3.72Å; W363-L367 HydrophobicContact CZ2-CD2 3.51Å; W363-L367 HydrophobicContact CZ3-CD2 4.3Å; W363-L367 WeakPolarHBondContact O-CB 3.39Å; W363-L367 PolarHBondContact O-N 2.99Å
364	L	96.6	Very high	95.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71.4	-35.4	175	-72.1	173.1	0	0	0	113.1	L324 I332 L344 L352 F356 T360 G361 Q362 C368	L324-L364 HydrophobicContact CD1-CD2 4.17Å; L324-L364 HydrophobicContact CD2-CD2 4.42Å; I332-L364 HydrophobicContact CD1-CD1 3.74Å; I332-L364 HydrophobicContact CD1-CD2 3.72Å; I332-L364 HydrophobicContact CD1-CG 4.39Å; I332-L364 HydrophobicContact CG1-CD1 4.12Å; L344-L364 HydrophobicContact CD2-CB 4.38Å; L344-L364 HydrophobicContact CD2-CD2 4.11Å; L352-L364 HydrophobicContact CD1-CB 4.34Å; F356-L364 HydrophobicContact CB-CD1 4.43Å; F356-L364 HydrophobicContact CD2-CD1 3.68Å; F356-L364 HydrophobicContact CE2-CD1 4.19Å; F356-L364 HydrophobicContact CG-CD1 4.07Å; T360-L364 HydrophobicContact CG2-CD1 4.28Å; T360-L364 WeakPolarHBondContact O-CB 3.47Å; T360-L364 VanDerWaalsContact O-CG 3.27Å; T360-L364 WeakPolarHBondContact O-CG 3.32Å; T360-L364 PolarHBondContact O-N 3.24Å; G361-L364 PolarHBondContact O-N 2.85Å; Q362-L364 VanDerWaalsContact C-N 3.29Å; Q362-L364 PolarHBondContact O-N 3Å; L364-C368 WeakPolarHBondContact O-CB 3.28Å; L364-C368 PolarHBondContact O-N 2.89Å; L364-C368 PolarHBondContact O-SG 2.78Å; L364-C368 VanDerWaalsContact O-SG 3.37Å
365	Y	96.9	Very high	95.5	Very high	69 Å²	69	49.4 Å²	49.4	27%	0.271	24%	0.241	S	C	.	.	H	α-helix	trans	-68.4	-40.5	178.8	-176.9	-90.8	0	0	0	112.2	L349 L352 G361 Q362 C368 R369	L349-Y365 HydrophobicContact CB-CD1 4.48Å; L349-Y365 HydrophobicContact CB-CD2 3.92Å; L349-Y365 HydrophobicContact CB-CE2 4.19Å; L349-Y365 HydrophobicContact CB-CG 4.08Å; L349-Y365 HydrophobicContact CD1-CG 4.27Å; L352-Y365 HydrophobicContact CD1-CD2 4.22Å; G361-Y365 VanDerWaalsContact O-CB 3.26Å; G361-Y365 WeakPolarHBondContact O-CB 3.32Å; G361-Y365 PolarHBondContact O-N 2.9Å; Q362-Y365 WeakPolarHBondContact O-CB 3.28Å; Q362-Y365 PolarHBondContact O-N 2.98Å; Y365-C368 PolarHBondContact O-SG 2.62Å; Y365-R369 VanDerWaalsContact CD2-NH1 3.27Å; Y365-R369 VanDerWaalsContact CE2-NH1 3.26Å; Y365-R369 VanDerWaalsContact CZ-CZ 3.49Å; Y365-R369 PolarHBondContact O-NH1 3.21Å
366	D	96.4	Very high	95.7	Very high	17 Å²	17	45.5 Å²	45.5	9%	0.091	22%	0.223	C	C	.	.	H	α-helix	trans	-73.1	-46.5	175.5	-58.3	-29.4	0	0	0	109.9	Q362 C368 R369 G370 I371	Q362-D366 WeakPolarHBondContact CG-OD2 3.49Å; Q362-D366 PolarHBondContact NE2-OD1 3.14Å; Q362-D366 PolarHBondContact NE2-OD2 3.36Å; Q362-D366 VanDerWaalsContact O-CG 3.32Å; Q362-D366 PolarHBondContact O-N 3.49Å; D366-C368 PolarHBondContact O-N 2.93Å; D366-R369 CarbonylContact O-C 3.53Å; D366-R369 WeakPolarHBondContact O-CA 3.44Å; D366-R369 WeakPolarHBondContact O-CB 3.3Å; D366-R369 PolarHBondContact O-N 3.41Å; D366-G370 PolarHBondContact O-N 3.29Å; D366-I371 CarbonylContact C-O 3.58Å; D366-I371 VanDerWaalsContact C-O 3.24Å; D366-I371 HydrophobicContact CB-CB 4.12Å; D366-I371 HydrophobicContact CB-CG2 4.27Å; D366-I371 WeakPolarHBondContact O-CB 3.45Å; D366-I371 PolarHBondContact O-N 3.08Å
367	L	96	Very high	95.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-36.1	-175	-172	68.5	0	0	0	112.9	V287 F313 I321 M341 W363 R369 G370 I371 E372	V287-L367 HydrophobicContact CB-CD1 3.89Å; V287-L367 HydrophobicContact CG1-CD1 3.92Å; V287-L367 HydrophobicContact CG2-CD1 3.99Å; F313-L367 VanDerWaalsContact CE2-O 3.32Å; F313-L367 WeakPolarHBondContact CE2-O 3.25Å; I321-L367 HydrophobicContact CG2-CD2 3.75Å; M341-L367 HydrophobicContact CE-CB 4.13Å; M341-L367 HydrophobicContact CE-CD2 3.9Å; M341-L367 HydrophobicContact CE-CG 3.89Å; W363-L367 HydrophobicContact CH2-CD2 3.72Å; W363-L367 HydrophobicContact CZ2-CD2 3.51Å; W363-L367 HydrophobicContact CZ3-CD2 4.3Å; W363-L367 WeakPolarHBondContact O-CB 3.39Å; W363-L367 PolarHBondContact O-N 2.99Å; L367-R369 PolarHBondContact O-N 2.96Å; L367-R369 VanDerWaalsContact O-N 3.14Å; L367-G370 PolarHBondContact O-N 2.83Å; L367-I371 WeakPolarHBondContact CA-O 3.46Å; L367-I371 PolarHBondContact N-O 3.14Å; L367-E372 HydrophobicContact CD1-CB 4.15Å; L367-E372 HydrophobicContact CD1-CG 4.1Å
368	C	96.3	Very high	95.7	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.034	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.3	176	72.3	0	0	0	0	113.8	M341 L344 T345 L364 Y365 D366	M341-C368 HydrophobicContact CE-CB 3.98Å; M341-C368 WeakPolarHBondContact O-CB 3.2Å; L344-C368 HydrophobicContact CB-CB 3.58Å; T345-C368 HydrophobicContact CG2-CB 4.3Å; L364-C368 WeakPolarHBondContact O-CB 3.28Å; L364-C368 PolarHBondContact O-N 2.89Å; L364-C368 PolarHBondContact O-SG 2.78Å; L364-C368 VanDerWaalsContact O-SG 3.37Å; Y365-C368 PolarHBondContact O-SG 2.62Å; D366-C368 PolarHBondContact O-N 2.93Å
369	R	96	Very high	95.6	Very high	79 Å²	79	47.9 Å²	47.9	30%	0.298	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	10.1	172.1	-64.2	168.1	173.6	74.9	8.4	112.3	T345 Y365 D366 L367 I371	T345-R369 PolarHBondContact O-NH2 2.81Å; Y365-R369 VanDerWaalsContact CD2-NH1 3.27Å; Y365-R369 VanDerWaalsContact CE2-NH1 3.26Å; Y365-R369 VanDerWaalsContact CZ-CZ 3.49Å; Y365-R369 PolarHBondContact O-NH1 3.21Å; D366-R369 CarbonylContact O-C 3.53Å; D366-R369 WeakPolarHBondContact O-CA 3.44Å; D366-R369 WeakPolarHBondContact O-CB 3.3Å; D366-R369 PolarHBondContact O-N 3.41Å; L367-R369 PolarHBondContact O-N 2.96Å; L367-R369 VanDerWaalsContact O-N 3.14Å; R369-I371 VanDerWaalsContact C-N 3.32Å; R369-I371 HydrophobicContact CB-CD1 4.36Å; R369-I371 HydrophobicContact CB-CG1 4.45Å; R369-I371 PolarHBondContact O-N 3.42Å
370	G	95.9	Very high	95.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-1.2	-177.9	0	0	0	0	0	115.3	N285 L288 D366 L367	N285-G370 PolarHBondContact ND2-O 3.03Å; L288-G370 VanDerWaalsContact CD1-O 3.3Å; L288-G370 WeakPolarHBondContact CD1-O 3.41Å; D366-G370 PolarHBondContact O-N 3.29Å; L367-G370 PolarHBondContact O-N 2.83Å
371	I	96	Very high	95.5	Very high	17 Å²	17	45.7 Å²	45.7	9%	0.087	22%	0.223	C	C	.	.			trans	-91.9	131	-168.8	-58.1	174.6	0	0	0	110.3	Y62 D366 L367 R369 F373	Y62-I371 HydrophobicContact CD1-CD1 3.71Å; Y62-I371 HydrophobicContact CE1-CD1 3.81Å; Y62-I371 HydrophobicContact CE1-CG2 4.14Å; D366-I371 CarbonylContact C-O 3.58Å; D366-I371 VanDerWaalsContact C-O 3.24Å; D366-I371 HydrophobicContact CB-CB 4.12Å; D366-I371 HydrophobicContact CB-CG2 4.27Å; D366-I371 WeakPolarHBondContact O-CB 3.45Å; D366-I371 PolarHBondContact O-N 3.08Å; L367-I371 WeakPolarHBondContact CA-O 3.46Å; L367-I371 PolarHBondContact N-O 3.14Å; R369-I371 VanDerWaalsContact C-N 3.32Å; R369-I371 HydrophobicContact CB-CD1 4.36Å; R369-I371 HydrophobicContact CB-CG1 4.45Å; R369-I371 PolarHBondContact O-N 3.42Å; I371-F373 HydrophobicContact CG2-CD2 4.4Å; I371-F373 HydrophobicContact CG2-CE1 4.15Å; I371-F373 HydrophobicContact CG2-CE2 3.48Å; I371-F373 VanDerWaalsContact CG2-CE2 3.48Å; I371-F373 HydrophobicContact CG2-CZ 3.31Å
372	E	95.3	Very high	95.4	Very high	22 Å²	22	47.8 Å²	47.8	10%	0.103	24%	0.236	C	C	.	.			trans	-157.8	136	-176.9	-158.3	-73.2	127.9	0	0	111	R66 N285 V287 L367 E374	R66-E372 PolarHBondContact NH2-O 2.91Å; N285-E372 HydrophobicContact CB-CB 3.85Å; N285-E372 VanDerWaalsContact CB-O 3.28Å; N285-E372 WeakPolarHBondContact CB-O 3.29Å; V287-E372 HydrophobicContact CG2-CG 3.92Å; L367-E372 HydrophobicContact CD1-CB 4.15Å; L367-E372 HydrophobicContact CD1-CG 4.1Å; E372-E374 VanDerWaalsContact CD-N 3.27Å; E372-E374 WeakPolarHBondContact OE1-CB 3.45Å; E372-E374 PolarHBondContact OE1-N 2.77Å; E372-E374 PolarHBondContact OE2-N 2.78Å
373	F	93.7	Very high	95.3	Very high	95 Å²	95	51.3 Å²	51.3	42%	0.417	25%	0.251	S	S	.	.			trans	-116.2	9.3	-167.3	-60.3	-69.6	0	0	0	115	Y62 I371 A375	Y62-F373 HydrophobicContact CD2-CZ 4.27Å; Y62-F373 HydrophobicContact CE1-CZ 4.31Å; Y62-F373 HydrophobicContact CE2-CE1 4.42Å; Y62-F373 HydrophobicContact CE2-CE2 4.27Å; Y62-F373 AromaticContact CE2-CZ 3.57Å; Y62-F373 HydrophobicContact CE2-CZ 3.57Å; Y62-F373 AromaticContact CZ-CE2 3.96Å; Y62-F373 AromaticContact CZ-CZ 3.6Å; Y62-F373 WeakPolarHBondContact OH-CE2 3.32Å; I371-F373 HydrophobicContact CG2-CD2 4.4Å; I371-F373 HydrophobicContact CG2-CE1 4.15Å; I371-F373 HydrophobicContact CG2-CE2 3.48Å; I371-F373 VanDerWaalsContact CG2-CE2 3.48Å; I371-F373 HydrophobicContact CG2-CZ 3.31Å; F373-A375 PolarHBondContact O-N 3.34Å; F373-A375 VanDerWaalsContact O-N 3.12Å
374	E	94.6	Very high	95.3	Very high	53 Å²	53	51.4 Å²	51.4	25%	0.248	26%	0.26	C	S	.	.			trans	-63.4	117.1	173.4	-172.4	-176	-138.2	0	0	109.9	R66 K286 R322 E372 K377	R66-E374 PolarHBondContact NH1-O 2.98Å; R66-E374 PolarHBondContact NH2-O 2.91Å; K286-E374 HydrophobicContact CD-CB 4.17Å; K286-E374 HydrophobicContact CD-CG 4.1Å; K286-E374 WeakPolarHBondContact CD-O 3.41Å; K286-E374 WeakPolarHBondContact CE-OE2 3.14Å; K286-E374 IonicContact NZ-OE1 3.8Å; K286-E374 IonicContact NZ-OE2 2.99Å; K286-E374 PolarHBondContact NZ-OE2 3.36Å; R322-E374 IonicContact NH1-OE2 3.39Å; R322-E374 IonicContact NH2-OE2 2.82Å; E372-E374 VanDerWaalsContact CD-N 3.27Å; E372-E374 WeakPolarHBondContact OE1-CB 3.45Å; E372-E374 PolarHBondContact OE1-N 2.77Å; E372-E374 PolarHBondContact OE2-N 2.78Å; E374-K377 IonicContact OE1-NZ 2.77Å; E374-K377 PolarHBondContact OE1-NZ 3.48Å
375	A	95.3	Very high	95.4	Very high	55 Å²	55	52 Å²	52	46%	0.455	26%	0.263	S	S	.	.			trans	-63.3	149	171.8	0	0	0	0	0	112	K286 F373 K377	K286-A375 PolarHBondContact NZ-O 2.72Å; F373-A375 PolarHBondContact O-N 3.34Å; F373-A375 VanDerWaalsContact O-N 3.12Å; A375-K377 PolarHBondContact O-N 3.3Å
376	V	97.3	Very high	95.4	Very high	10 Å²	10	49.8 Å²	49.8	6%	0.061	26%	0.262	C	S	.	.			trans	-72	114.2	165.9	-178.7	0	0	0	0	107.3	V68 E169 D179 K286	V68-V376 HydrophobicContact CG1-CG2 4Å; V68-V376 HydrophobicContact CG2-CG2 4.37Å; E169-V376 HydrophobicContact CB-CG1 3.71Å; D179-V376 HydrophobicContact CB-CB 4.02Å; D179-V376 HydrophobicContact CB-CG2 4.03Å; K286-V376 HydrophobicContact CD-CG2 4.12Å; K286-V376 HydrophobicContact CG-CG2 4.2Å
377	K	95.8	Very high	95.4	Very high	89 Å²	89	49.2 Å²	49.2	39%	0.387	26%	0.259	S	S	.	.			trans	-84.9	122.2	-173.3	-67.9	144.8	-174.8	173.5	0	109.8	E169 E374 A375 R379	E169-K377 WeakPolarHBondContact CA-O 3.33Å; E169-K377 WeakPolarHBondContact CB-O 3.3Å; E169-K377 HydrophobicContact CG-CB 4.32Å; E169-K377 WeakPolarHBondContact CG-O 3.36Å; E169-K377 PolarHBondContact OE2-N 3.02Å; E169-K377 VanDerWaalsContact OE2-N 3.08Å; E374-K377 IonicContact OE1-NZ 2.77Å; E374-K377 PolarHBondContact OE1-NZ 3.48Å; A375-K377 PolarHBondContact O-N 3.3Å; K377-R379 WeakPolarHBondContact O-CB 3.33Å; K377-R379 PolarHBondContact O-N 2.93Å
378	P	94.8	Very high	95.4	Very high	111 Å²	111	52.1 Å²	52.1	72%	0.721	28%	0.279	S	S	*	.			trans	-59.3	97.9	-177.9	23.3	-33.9	0	0	0	110.7	V167	V167-P378 HydrophobicContact CG1-CB 3.68Å
379	R	93.6	Very high	95.5	Very high	56 Å²	56	53.3 Å²	53.3	21%	0.211	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-165.1	84.8	-166.6	-169.6	-177.2	55.8	66.5	-0.3	112.2	I168 E169 R170 K377 L381	I168-R379 CarbonylContact O-C 3.4Å; I168-R379 PolarHBondContact O-N 3.35Å; E169-R379 IonicContact OE1-CZ 3.85Å; E169-R379 IonicContact OE1-NE 3.97Å; E169-R379 IonicContact OE1-NH2 3.32Å; E169-R379 PolarHBondContact OE1-NH2 2.96Å; R170-R379 PolarHBondContact N-O 2.8Å; R170-R379 PolarHBondContact O-NH1 3.19Å; R170-R379 PolarHBondContact O-NH2 2.96Å; K377-R379 WeakPolarHBondContact O-CB 3.33Å; K377-R379 PolarHBondContact O-N 2.93Å; R379-L381 WeakPolarHBondContact CG-O 3.28Å; R379-L381 PolarHBondContact NH1-O 3.06Å
380	Q	91.8	Very high	95.4	Very high	92 Å²	92	54 Å²	54	43%	0.43	29%	0.294	S	S	.	.			trans	-70.3	-38	168.1	-65.2	146.4	-16.7	0	0	111.9	I159 S163 I168 R170	I159-Q380 HydrophobicContact CG2-CB 3.95Å; I159-Q380 HydrophobicContact CG2-CG 4.12Å; S163-Q380 VanDerWaalsContact CB-NE2 3.32Å; S163-Q380 PolarHBondContact OG-NE2 2.99Å; I168-Q380 HydrophobicContact CD1-CG 4.09Å; I168-Q380 HydrophobicContact CG1-CG 3.83Å; R170-Q380 WeakPolarHBondContact CB-O 3.24Å; R170-Q380 WeakPolarHBondContact CD-O 3.41Å
381	L	93.8	Very high	95.4	Very high	59 Å²	59	54.2 Å²	54.2	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	-84.8	151.2	-172.4	-61.8	-177.6	0	0	0	113.8	R379 N425	R379-L381 WeakPolarHBondContact CG-O 3.28Å; R379-L381 PolarHBondContact NH1-O 3.06Å; L381-N425 HydrophobicContact CD1-CB 3.75Å
382	P	94.6	Very high	95.2	Very high	44 Å²	44	57.7 Å²	57.7	29%	0.286	32%	0.318	S	S	.	.			trans	-72	147.3	173.3	30.9	-34.8	0	0	0	111.4	R427	P382-R427 PolarHBondContact O-NH1 2.88Å; P382-R427 PolarHBondContact O-NH2 2.94Å
383	K	94.4	Very high	94.9	Very high	147 Å²	147	59.2 Å²	59.2	64%	0.639	34%	0.34	S	S	*	.	S	Bend	trans	-77.6	-18.2	177.9	-65.1	-172.6	177	-177.1	0	114
384	S	96.9	Very high	94.7	Very high	60 Å²	60	65.2 Å²	65.2	42%	0.42	37%	0.366	S	S	.	.			trans	-146.7	151.7	179.3	54.9	0	0	0	0	110.8	A493	S384-A493 CarbonylContact C-O 3.55Å; S384-A493 WeakPolarHBondContact CA-O 3.44Å; S384-A493 WeakPolarHBondContact CB-O 3.09Å
385	I	98.1	Very high	94.7	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.056	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	111.5	173.4	-68.5	-178.4	0	0	0	106.4	L414 R417 L418 D421 A493 F496	I385-L414 HydrophobicContact CG2-CD1 3.94Å; I385-L414 VanDerWaalsContact O-CD1 3.26Å; I385-L414 WeakPolarHBondContact O-CD1 3.36Å; I385-R417 HydrophobicContact CG2-CB 3.97Å; I385-L418 HydrophobicContact CB-CD2 4.33Å; I385-L418 HydrophobicContact CD1-CD2 4.36Å; I385-L418 HydrophobicContact CG2-CD2 4.49Å; I385-L418 HydrophobicContact CG2-CG 4.5Å; I385-D421 HydrophobicContact CD1-CB 3.46Å; I385-D421 VanDerWaalsContact CD1-CB 3.46Å; I385-A493 PolarHBondContact N-O 2.95Å; I385-A493 PolarHBondContact O-N 2.89Å; I385-F496 HydrophobicContact CB-CZ 4.4Å; I385-F496 HydrophobicContact CD1-CE1 4.47Å; I385-F496 HydrophobicContact CD1-CZ 3.91Å; I385-F496 HydrophobicContact CG1-CZ 3.93Å
386	G	96.9	Very high	94.7	Very high	24 Å²	24	65.1 Å²	65.1	25%	0.247	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	160.3	-178.6	0	0	0	0	0	114.2	R417 L491	G386-R417 PolarHBondContact O-NH1 3.13Å; G386-R417 PolarHBondContact O-NH2 3.06Å; G386-L491 CarbonylContact C-O 3.59Å; G386-L491 WeakPolarHBondContact CA-O 3.27Å
387	C	96.7	Very high	94.7	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.034	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.3	-179.4	55.2	0	0	0	0	108.9	L410 E413 H490 L491	C387-L410 HydrophobicContact CB-CD2 3.98Å; C387-L410 PolarHBondContact SG-O 2.89Å; C387-E413 WeakPolarHBondContact CB-OE2 3.48Å; C387-H490 WeakPolarHBondContact O-CA 3.43Å; C387-H490 PolarHBondContact O-CD2 3.32Å; C387-L491 PolarHBondContact N-O 2.89Å; C387-L491 PolarHBondContact O-N 2.66Å
388	S	96.4	Very high	94.7	Very high	61 Å²	61	62.6 Å²	62.6	43%	0.427	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.1	-179.8	58.8	0	0	0	0	112.5	K145 L489	K145-S388 WeakPolarHBondContact CE-O 3.41Å; S388-L489 CarbonylContact C-O 3.33Å; S388-L489 VanDerWaalsContact CA-O 3.25Å; S388-L489 WeakPolarHBondContact CA-O 3.3Å; S388-L489 WeakPolarHBondContact CB-O 3.2Å
389	K	96.6	Very high	94.8	Very high	29 Å²	29	59.5 Å²	59.5	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	136	169.4	-171.1	175.4	174.8	83.5	0	110.2	G144 K145 F391 W406 L488 L489	G144-K389 PolarHBondContact O-NZ 3.25Å; K145-K389 HydrophobicContact CB-CD 4.19Å; K389-F391 HydrophobicContact CB-CE1 4.45Å; K389-F391 HydrophobicContact CB-CE2 4.05Å; K389-F391 HydrophobicContact CB-CZ 3.8Å; K389-F391 HydrophobicContact CD-CD1 4.41Å; K389-F391 HydrophobicContact CD-CE1 3.5Å; K389-F391 HydrophobicContact CD-CZ 3.6Å; K389-F391 HydrophobicContact CG-CE1 3.89Å; K389-F391 HydrophobicContact CG-CE2 4.26Å; K389-F391 HydrophobicContact CG-CZ 3.75Å; K389-F391 WeakPolarHBondContact O-CE2 3.3Å; K389-W406 HydrophobicContact CD-CD2 4.24Å; K389-W406 HydrophobicContact CD-CE3 3.66Å; K389-W406 HydrophobicContact CD-CH2 3.77Å; K389-W406 HydrophobicContact CD-CZ2 4.31Å; K389-W406 HydrophobicContact CD-CZ3 3.4Å; K389-W406 VanDerWaalsContact CD-CZ3 3.4Å; K389-W406 VanDerWaalsContact CE-CH2 3.47Å; K389-L488 WeakPolarHBondContact O-CA 3.5Å; K389-L489 PolarHBondContact N-O 3.48Å; K389-L489 PolarHBondContact O-N 3.22Å
390	N	95.3	Very high	94.9	Very high	94 Å²	94	58.3 Å²	58.3	50%	0.503	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.1	168.8	-77.3	-39.1	0	0	0	110	P392 R437	N390-P392 WeakPolarHBondContact O-CD 3.41Å; N390-R437 PolarHBondContact OD1-NH2 2.95Å
391	F	95.7	Very high	95.1	Very high	5 Å²	5	61.4 Å²	61.4	2%	0.022	35%	0.35	C	S	.	.			trans	-126.1	74.9	178.2	-58	-78.2	0	0	0	109.4	K389 T395 L397 W406 T487 L489	K389-F391 HydrophobicContact CB-CE1 4.45Å; K389-F391 HydrophobicContact CB-CE2 4.05Å; K389-F391 HydrophobicContact CB-CZ 3.8Å; K389-F391 HydrophobicContact CD-CD1 4.41Å; K389-F391 HydrophobicContact CD-CE1 3.5Å; K389-F391 HydrophobicContact CD-CZ 3.6Å; K389-F391 HydrophobicContact CG-CE1 3.89Å; K389-F391 HydrophobicContact CG-CE2 4.26Å; K389-F391 HydrophobicContact CG-CZ 3.75Å; K389-F391 WeakPolarHBondContact O-CE2 3.3Å; F391-T395 WeakPolarHBondContact CA-OG1 3.12Å; F391-L397 HydrophobicContact CB-CG 4.48Å; F391-L397 HydrophobicContact CD1-CD2 3.61Å; F391-L397 HydrophobicContact CD1-CG 4.14Å; F391-L397 HydrophobicContact CD2-CD1 4.03Å; F391-L397 HydrophobicContact CD2-CD2 4.37Å; F391-L397 HydrophobicContact CD2-CG 3.99Å; F391-L397 HydrophobicContact CE1-CD1 4.34Å; F391-L397 HydrophobicContact CE1-CD2 3.79Å; F391-L397 HydrophobicContact CE1-CG 4.36Å; F391-L397 HydrophobicContact CE2-CD1 3.79Å; F391-L397 HydrophobicContact CE2-CG 4.24Å; F391-L397 HydrophobicContact CG-CD1 4.41Å; F391-L397 HydrophobicContact CG-CD2 3.91Å; F391-L397 HydrophobicContact CG-CG 3.94Å; F391-L397 HydrophobicContact CZ-CD1 3.95Å; F391-L397 HydrophobicContact CZ-CD2 4.26Å; F391-L397 HydrophobicContact CZ-CG 4.4Å; F391-W406 AromaticContact CE1-CD1 3.72Å; F391-W406 AromaticContact CE1-CD2 3.64Å; F391-W406 HydrophobicContact CE1-CD2 3.64Å; F391-W406 AromaticContact CE1-CE2 3.61Å; F391-W406 HydrophobicContact CE1-CE3 4.29Å; F391-W406 AromaticContact CE1-CG 3.74Å; F391-W406 HydrophobicContact CE1-CG 3.74Å; F391-W406 HydrophobicContact CE1-CZ2 4.23Å; F391-W406 AromaticContact CE1-NE1 3.63Å; F391-W406 HydrophobicContact CZ-CB 3.86Å; F391-W406 AromaticContact CZ-CD1 3.87Å; F391-W406 AromaticContact CZ-CD2 3.67Å; F391-W406 HydrophobicContact CZ-CD2 3.67Å; F391-W406 HydrophobicContact CZ-CE3 4.15Å; F391-W406 AromaticContact CZ-CG 3.51Å; F391-W406 HydrophobicContact CZ-CG 3.51Å; F391-T487 PolarHBondContact N-O 2.97Å; F391-T487 WeakPolarHBondContact O-CA 3.37Å; F391-L489 HydrophobicContact CE2-CB 4.08Å; F391-L489 HydrophobicContact CE2-CD1 4.19Å; F391-L489 HydrophobicContact CE2-CG 4Å
392	P	91.1	Very high	95.3	Very high	90 Å²	90	62.5 Å²	62.5	58%	0.584	35%	0.354	S	S	*	.			trans	-72.5	142.5	-173.4	29.8	-35.9	0	0	0	113.1	N390 K394 T395	N390-P392 WeakPolarHBondContact O-CD 3.41Å; P392-K394 PolarHBondContact O-N 3.11Å; P392-T395 VanDerWaalsContact CD-OG1 3.28Å; P392-T395 WeakPolarHBondContact CD-OG1 3.23Å; P392-T395 VanDerWaalsContact N-OG1 3.12Å; P392-T395 PolarHBondContact O-N 2.89Å; P392-T395 VanDerWaalsContact O-N 3.09Å; P392-T395 PolarHBondContact O-OG1 3.26Å
393	G	89.6	Confident	95.5	Very high	54 Å²	54	60.4 Å²	60.4	56%	0.557	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	52.5	-124.6	171.1	0	0	0	0	0	113.2	T395 S396	G393-T395 PolarHBondContact O-N 2.89Å; G393-S396 WeakPolarHBondContact O-CB 3.19Å; G393-S396 PolarHBondContact O-N 3.48Å; G393-S396 VanDerWaalsContact O-N 3.15Å; G393-S396 PolarHBondContact O-OG 2.86Å
394	K	90.1	Very high	95.6	Very high	221 Å²	221	57.8 Å²	57.8	96%	0.961	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-62.3	-11.1	-178.1	-62.8	-174.5	179.3	-177.3	0	114.9	P392	P392-K394 PolarHBondContact O-N 3.11Å
395	T	94	Very high	95.7	Very high	84 Å²	84	60.7 Å²	60.7	52%	0.515	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-90.7	-1.6	177.7	66.2	0	0	0	0	113.9	F391 P392 G393	F391-T395 WeakPolarHBondContact CA-OG1 3.12Å; P392-T395 VanDerWaalsContact CD-OG1 3.28Å; P392-T395 WeakPolarHBondContact CD-OG1 3.23Å; P392-T395 VanDerWaalsContact N-OG1 3.12Å; P392-T395 PolarHBondContact O-N 2.89Å; P392-T395 VanDerWaalsContact O-N 3.09Å; P392-T395 PolarHBondContact O-OG1 3.26Å; G393-T395 PolarHBondContact O-N 2.89Å
396	S	96	Very high	95.7	Very high	21 Å²	21	62.2 Å²	62.2	15%	0.147	34%	0.338	C	S	.	.	S	Bend	trans	-58.8	139.7	179.8	61.1	0	0	0	0	112.7	G393 A398 L486	G393-S396 WeakPolarHBondContact O-CB 3.19Å; G393-S396 PolarHBondContact O-N 3.48Å; G393-S396 VanDerWaalsContact O-N 3.15Å; G393-S396 PolarHBondContact O-OG 2.86Å; S396-A398 PolarHBondContact O-N 2.73Å; S396-L486 CarbonylContact C-O 3.53Å; S396-L486 VanDerWaalsContact CA-O 3.26Å; S396-L486 WeakPolarHBondContact CA-O 3.49Å; S396-L486 WeakPolarHBondContact CB-O 3.38Å
397	L	96.7	Very high	95.8	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.2	-172.8	-46.5	-175.3	0	0	0	110.4	F391 Q402 V403 W406 P485 L486 L489	F391-L397 HydrophobicContact CB-CG 4.48Å; F391-L397 HydrophobicContact CD1-CD2 3.61Å; F391-L397 HydrophobicContact CD1-CG 4.14Å; F391-L397 HydrophobicContact CD2-CD1 4.03Å; F391-L397 HydrophobicContact CD2-CD2 4.37Å; F391-L397 HydrophobicContact CD2-CG 3.99Å; F391-L397 HydrophobicContact CE1-CD1 4.34Å; F391-L397 HydrophobicContact CE1-CD2 3.79Å; F391-L397 HydrophobicContact CE1-CG 4.36Å; F391-L397 HydrophobicContact CE2-CD1 3.79Å; F391-L397 HydrophobicContact CE2-CG 4.24Å; F391-L397 HydrophobicContact CG-CD1 4.41Å; F391-L397 HydrophobicContact CG-CD2 3.91Å; F391-L397 HydrophobicContact CG-CG 3.94Å; F391-L397 HydrophobicContact CZ-CD1 3.95Å; F391-L397 HydrophobicContact CZ-CD2 4.26Å; F391-L397 HydrophobicContact CZ-CG 4.4Å; L397-Q402 HydrophobicContact CB-CB 4.24Å; L397-Q402 HydrophobicContact CD2-CB 4.27Å; L397-V403 HydrophobicContact CB-CG2 3.84Å; L397-V403 HydrophobicContact CD1-CG2 4.13Å; L397-W406 HydrophobicContact CD1-CB 4.08Å; L397-W406 HydrophobicContact CD1-CG 4.22Å; L397-W406 VanDerWaalsContact CD2-CD1 3.49Å; L397-W406 HydrophobicContact CD2-CG 4.48Å; L397-P485 CarbonylContact O-C 3.57Å; L397-P485 WeakPolarHBondContact O-CA 3.41Å; L397-P485 WeakPolarHBondContact O-CB 3.41Å; L397-L486 HydrophobicContact CB-CB 4.27Å; L397-L486 PolarHBondContact N-O 3.39Å; L397-L486 PolarHBondContact O-N 2.93Å; L397-L489 HydrophobicContact CD1-CD1 3.65Å; L397-L489 HydrophobicContact CD1-CG 4.18Å
398	A	96.2	Very high	95.8	Very high	42 Å²	42	63.9 Å²	63.9	35%	0.347	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	5.4	-172.2	0	0	0	0	0	113.5	S396 A481 W482 P485	S396-A398 PolarHBondContact O-N 2.73Å; A398-A481 CarbonylContact O-C 3.6Å; A398-W482 PolarHBondContact O-N 3.08Å; A398-P485 HydrophobicContact CB-CB 4.28Å; A398-P485 HydrophobicContact CB-CG 4.1Å
399	T	96.8	Very high	95.9	Very high	47 Å²	47	62.1 Å²	62.1	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155	174.7	70.9	0	0	0	0	112.1	Q401 Q402 V403 A480	T399-Q401 VanDerWaalsContact C-N 3.33Å; T399-Q401 PolarHBondContact O-N 2.96Å; T399-Q402 PolarHBondContact O-N 2.85Å; T399-Q402 WeakPolarHBondContact OG1-CB 3.37Å; T399-Q402 VanDerWaalsContact OG1-CG 3.27Å; T399-Q402 WeakPolarHBondContact OG1-CG 3.04Å; T399-Q402 PolarHBondContact OG1-N 3.25Å; T399-Q402 PolarHBondContact OG1-OE1 2.7Å; T399-V403 PolarHBondContact O-N 3.29Å; T399-A480 WeakPolarHBondContact CA-O 3.39Å
400	K	95.6	Very high	96	Very high	31 Å²	31	60.8 Å²	60.8	14%	0.135	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-43	176.2	-73.2	172.3	-178.3	163.5	0	112.1	Q402 V403 Q404 F466 N473 G476 N477 Q479 A480 W482	K400-Q402 VanDerWaalsContact C-N 3.34Å; K400-Q402 PolarHBondContact O-N 2.87Å; K400-V403 PolarHBondContact O-N 3.48Å; K400-V403 VanDerWaalsContact O-N 3.13Å; K400-Q404 WeakPolarHBondContact O-CG 3.39Å; K400-Q404 PolarHBondContact O-N 3.3Å; K400-Q404 PolarHBondContact O-OE1 2.77Å; K400-F466 HydrophobicContact CB-CZ 4.35Å; K400-F466 HydrophobicContact CG-CZ 4.3Å; K400-N473 WeakPolarHBondContact CE-ND2 3.24Å; K400-G476 PolarHBondContact NZ-O 3.07Å; K400-N477 PolarHBondContact NZ-O 2.96Å; K400-Q479 WeakPolarHBondContact CD-O 3.45Å; K400-Q479 WeakPolarHBondContact CE-O 3.42Å; K400-Q479 PolarHBondContact NZ-O 2.84Å; K400-A480 PolarHBondContact N-O 2.84Å; K400-W482 HydrophobicContact CG-CE3 4.07Å
401	Q	96.5	Very high	96.2	Very high	157 Å²	157	56.3 Å²	56.3	73%	0.734	29%	0.294	S	S	*	.	H	α-helix	trans	-59.3	-42.7	178.6	-170.6	-178.3	11.8	0	0	112.1	T399 Q404 Y405	T399-Q401 VanDerWaalsContact C-N 3.33Å; T399-Q401 PolarHBondContact O-N 2.96Å; Q401-Q404 PolarHBondContact O-N 2.9Å; Q401-Y405 VanDerWaalsContact O-CB 3.26Å; Q401-Y405 WeakPolarHBondContact O-CB 3.46Å; Q401-Y405 PolarHBondContact O-N 3.1Å
402	Q	97.6	Very high	96.3	Very high	81 Å²	81	58.1 Å²	58.1	38%	0.379	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-42.9	174.6	-76.9	171.5	-21.5	0	0	112.1	L397 T399 K400 W406	L397-Q402 HydrophobicContact CB-CB 4.24Å; L397-Q402 HydrophobicContact CD2-CB 4.27Å; T399-Q402 PolarHBondContact O-N 2.85Å; T399-Q402 WeakPolarHBondContact OG1-CB 3.37Å; T399-Q402 VanDerWaalsContact OG1-CG 3.27Å; T399-Q402 WeakPolarHBondContact OG1-CG 3.04Å; T399-Q402 PolarHBondContact OG1-N 3.25Å; T399-Q402 PolarHBondContact OG1-OE1 2.7Å; K400-Q402 VanDerWaalsContact C-N 3.34Å; K400-Q402 PolarHBondContact O-N 2.87Å; Q402-W406 VanDerWaalsContact O-CD1 3.25Å; Q402-W406 PolarHBondContact O-N 2.93Å
403	V	97.3	Very high	96.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-45	178	176.2	0	0	0	0	111.1	L397 T399 K400 W406 L407 F466 I469 W482 L486	L397-V403 HydrophobicContact CB-CG2 3.84Å; L397-V403 HydrophobicContact CD1-CG2 4.13Å; T399-V403 PolarHBondContact O-N 3.29Å; K400-V403 PolarHBondContact O-N 3.48Å; K400-V403 VanDerWaalsContact O-N 3.13Å; V403-W406 PolarHBondContact O-N 2.88Å; V403-L407 HydrophobicContact CG1-CD1 3.99Å; V403-L407 HydrophobicContact CG1-CG 4.35Å; V403-L407 WeakPolarHBondContact O-CB 3.39Å; V403-L407 VanDerWaalsContact O-CG 3.24Å; V403-L407 WeakPolarHBondContact O-CG 3Å; V403-L407 PolarHBondContact O-N 3.24Å; V403-F466 HydrophobicContact CG1-CD2 4.28Å; V403-F466 HydrophobicContact CG1-CE2 4.47Å; V403-I469 HydrophobicContact CG1-CD1 3.95Å; V403-W482 HydrophobicContact CB-CE3 4.23Å; V403-W482 HydrophobicContact CB-CZ3 4.5Å; V403-W482 HydrophobicContact CG1-CE3 4.33Å; V403-W482 HydrophobicContact CG1-CH2 4.37Å; V403-W482 HydrophobicContact CG1-CZ3 4.15Å; V403-W482 HydrophobicContact CG2-CB 4.47Å; V403-W482 HydrophobicContact CG2-CD2 3.89Å; V403-W482 HydrophobicContact CG2-CE3 3.99Å; V403-W482 HydrophobicContact CG2-CG 4.07Å; V403-L486 HydrophobicContact CG1-CD1 4.14Å; V403-L486 HydrophobicContact CG2-CD1 3.88Å; V403-L486 HydrophobicContact CG2-CG 4.43Å
404	Q	97.8	Very high	97.1	Very high	93 Å²	93	51.5 Å²	51.5	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-45.1	176.9	-70	170.3	-74.1	0	0	111.8	K400 Q401 L407 H408 F466	K400-Q404 WeakPolarHBondContact O-CG 3.39Å; K400-Q404 PolarHBondContact O-N 3.3Å; K400-Q404 PolarHBondContact O-OE1 2.77Å; Q401-Q404 PolarHBondContact O-N 2.9Å; Q404-L407 PolarHBondContact O-N 3.28Å; Q404-H408 WeakPolarHBondContact O-CB 3.26Å; Q404-H408 PolarHBondContact O-N 3.33Å; Q404-F466 HydrophobicContact CG-CD1 4.36Å; Q404-F466 HydrophobicContact CG-CD2 3.48Å; Q404-F466 VanDerWaalsContact CG-CD2 3.48Å; Q404-F466 HydrophobicContact CG-CE1 4.35Å; Q404-F466 HydrophobicContact CG-CE2 3.46Å; Q404-F466 VanDerWaalsContact CG-CE2 3.46Å; Q404-F466 HydrophobicContact CG-CG 3.94Å; Q404-F466 HydrophobicContact CG-CZ 3.92Å
405	Y	98.3	Very high	97.5	Very high	121 Å²	121	43.7 Å²	43.7	48%	0.475	22%	0.217	S	C	.	.	H	α-helix	trans	-56.4	-53.1	175.3	173.9	-95.1	0	0	0	111.6	Q401 L407 H408 Q409	Q401-Y405 VanDerWaalsContact O-CB 3.26Å; Q401-Y405 WeakPolarHBondContact O-CB 3.46Å; Q401-Y405 PolarHBondContact O-N 3.1Å; Y405-L407 PolarHBondContact O-N 3.21Å; Y405-H408 WeakPolarHBondContact O-CB 3.22Å; Y405-H408 PolarHBondContact O-N 2.88Å; Y405-H408 VanDerWaalsContact O-N 3.1Å; Y405-Q409 HydrophobicContact CD1-CG 4.14Å; Y405-Q409 HydrophobicContact CE1-CG 3.67Å; Y405-Q409 HydrophobicContact CE2-CG 4.13Å; Y405-Q409 WeakPolarHBondContact O-CG 3.35Å; Y405-Q409 PolarHBondContact O-N 3.26Å
406	W	98.4	Very high	97.7	Very high	43 Å²	43	44.5 Å²	44.5	16%	0.163	22%	0.215	C	C	.	.	H	α-helix	trans	-71.6	-28.4	-178.1	-76.8	111.7	0	0	0	113.9	H143 G144 K389 F391 L397 Q402 V403 H408 Q409 L410 L489	H143-W406 WeakPolarHBondContact O-CZ3 3.47Å; G144-W406 VanDerWaalsContact O-CH2 3.3Å; G144-W406 WeakPolarHBondContact O-CH2 3.18Å; K389-W406 HydrophobicContact CD-CD2 4.24Å; K389-W406 HydrophobicContact CD-CE3 3.66Å; K389-W406 HydrophobicContact CD-CH2 3.77Å; K389-W406 HydrophobicContact CD-CZ2 4.31Å; K389-W406 HydrophobicContact CD-CZ3 3.4Å; K389-W406 VanDerWaalsContact CD-CZ3 3.4Å; K389-W406 VanDerWaalsContact CE-CH2 3.47Å; F391-W406 AromaticContact CE1-CD1 3.72Å; F391-W406 AromaticContact CE1-CD2 3.64Å; F391-W406 HydrophobicContact CE1-CD2 3.64Å; F391-W406 AromaticContact CE1-CE2 3.61Å; F391-W406 HydrophobicContact CE1-CE3 4.29Å; F391-W406 AromaticContact CE1-CG 3.74Å; F391-W406 HydrophobicContact CE1-CG 3.74Å; F391-W406 HydrophobicContact CE1-CZ2 4.23Å; F391-W406 AromaticContact CE1-NE1 3.63Å; F391-W406 HydrophobicContact CZ-CB 3.86Å; F391-W406 AromaticContact CZ-CD1 3.87Å; F391-W406 AromaticContact CZ-CD2 3.67Å; F391-W406 HydrophobicContact CZ-CD2 3.67Å; F391-W406 HydrophobicContact CZ-CE3 4.15Å; F391-W406 AromaticContact CZ-CG 3.51Å; F391-W406 HydrophobicContact CZ-CG 3.51Å; L397-W406 HydrophobicContact CD1-CB 4.08Å; L397-W406 HydrophobicContact CD1-CG 4.22Å; L397-W406 VanDerWaalsContact CD2-CD1 3.49Å; L397-W406 HydrophobicContact CD2-CG 4.48Å; Q402-W406 VanDerWaalsContact O-CD1 3.25Å; Q402-W406 PolarHBondContact O-N 2.93Å; V403-W406 PolarHBondContact O-N 2.88Å; W406-H408 VanDerWaalsContact C-N 3.33Å; W406-Q409 HydrophobicContact CE3-CB 3.99Å; W406-Q409 HydrophobicContact CE3-CG 4.21Å; W406-Q409 HydrophobicContact CZ3-CB 4.35Å; W406-Q409 HydrophobicContact CZ3-CG 4.42Å; W406-L410 WeakPolarHBondContact O-CB 3.38Å; W406-L410 VanDerWaalsContact O-CG 3.3Å; W406-L410 WeakPolarHBondContact O-CG 3.39Å; W406-L410 PolarHBondContact O-N 3.14Å; W406-L489 HydrophobicContact CB-CD1 3.69Å
407	L	98.3	Very high	97.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-39.7	167.5	-75.1	174.5	0	0	0	111.4	V403 Q404 Y405 A411 F466 I469 L489 L491	V403-L407 HydrophobicContact CG1-CD1 3.99Å; V403-L407 HydrophobicContact CG1-CG 4.35Å; V403-L407 WeakPolarHBondContact O-CB 3.39Å; V403-L407 VanDerWaalsContact O-CG 3.24Å; V403-L407 WeakPolarHBondContact O-CG 3Å; V403-L407 PolarHBondContact O-N 3.24Å; Q404-L407 PolarHBondContact O-N 3.28Å; Y405-L407 PolarHBondContact O-N 3.21Å; L407-A411 VanDerWaalsContact O-CB 3.24Å; L407-A411 WeakPolarHBondContact O-CB 3.48Å; L407-A411 PolarHBondContact O-N 3.47Å; L407-F466 HydrophobicContact CD1-CB 3.77Å; L407-F466 HydrophobicContact CD1-CD2 4.12Å; L407-F466 HydrophobicContact CD1-CG 4.47Å; L407-I469 HydrophobicContact CD1-CD1 4.14Å; L407-L489 HydrophobicContact CD2-CD1 4.23Å; L407-L489 HydrophobicContact CD2-CD2 4.28Å; L407-L489 HydrophobicContact CG-CD1 4.16Å; L407-L491 HydrophobicContact CD2-CD2 3.97Å
408	H	98.6	Very high	97.9	Very high	63 Å²	63	45.4 Å²	45.4	29%	0.292	22%	0.215	S	C	.	.	H	α-helix	trans	-68.8	-44.1	176.6	-171	59.5	0	0	0	112.3	Q404 Y405 W406 L410 A411 L412 S462	Q404-H408 WeakPolarHBondContact O-CB 3.26Å; Q404-H408 PolarHBondContact O-N 3.33Å; Y405-H408 WeakPolarHBondContact O-CB 3.22Å; Y405-H408 PolarHBondContact O-N 2.88Å; Y405-H408 VanDerWaalsContact O-N 3.1Å; W406-H408 VanDerWaalsContact C-N 3.33Å; H408-L410 VanDerWaalsContact C-N 3.31Å; H408-L410 PolarHBondContact O-N 2.9Å; H408-A411 WeakPolarHBondContact O-CB 3.47Å; H408-A411 PolarHBondContact O-N 2.63Å; H408-L412 WeakPolarHBondContact O-CG 3.16Å; H408-L412 PolarHBondContact O-N 2.86Å; H408-S462 PolarHBondContact ND1-OG 3.04Å
409	Q	98.5	Very high	97.9	Very high	25 Å²	25	45.1 Å²	45.1	12%	0.117	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-38.9	173.5	-65.9	-59.2	-88	0	0	112.9	H143 Y405 W406	H143-Q409 HydrophobicContact CB-CB 4.16Å; H143-Q409 PolarHBondContact O-OE1 2.92Å; Y405-Q409 HydrophobicContact CD1-CG 4.14Å; Y405-Q409 HydrophobicContact CE1-CG 3.67Å; Y405-Q409 HydrophobicContact CE2-CG 4.13Å; Y405-Q409 WeakPolarHBondContact O-CG 3.35Å; Y405-Q409 PolarHBondContact O-N 3.26Å; W406-Q409 HydrophobicContact CE3-CB 3.99Å; W406-Q409 HydrophobicContact CE3-CG 4.21Å; W406-Q409 HydrophobicContact CZ3-CB 4.35Å; W406-Q409 HydrophobicContact CZ3-CG 4.42Å
410	L	98.5	Very high	97.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.2	-34.3	173.4	-72.7	170.9	0	0	0	112.4	K145 C387 W406 H408 L414 L489 L491	K145-L410 HydrophobicContact CD-CD2 3.71Å; C387-L410 HydrophobicContact CB-CD2 3.98Å; C387-L410 PolarHBondContact SG-O 2.89Å; W406-L410 WeakPolarHBondContact O-CB 3.38Å; W406-L410 VanDerWaalsContact O-CG 3.3Å; W406-L410 WeakPolarHBondContact O-CG 3.39Å; W406-L410 PolarHBondContact O-N 3.14Å; H408-L410 VanDerWaalsContact C-N 3.31Å; H408-L410 PolarHBondContact O-N 2.9Å; L410-L414 WeakPolarHBondContact O-CB 3.3Å; L410-L414 PolarHBondContact O-N 2.64Å; L410-L414 VanDerWaalsContact O-N 3.14Å; L410-L489 HydrophobicContact CD1-CB 3.57Å; L410-L491 HydrophobicContact CB-CD1 3.68Å; L410-L491 HydrophobicContact CB-CG 4.02Å
411	A	98.6	Very high	98	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-34.1	179.2	0	0	0	0	0	112.7	L407 H408 L414 E415 A458 I461 L491	L407-A411 VanDerWaalsContact O-CB 3.24Å; L407-A411 WeakPolarHBondContact O-CB 3.48Å; L407-A411 PolarHBondContact O-N 3.47Å; H408-A411 WeakPolarHBondContact O-CB 3.47Å; H408-A411 PolarHBondContact O-N 2.63Å; A411-L414 PolarHBondContact O-N 3.34Å; A411-E415 WeakPolarHBondContact O-CB 3.24Å; A411-E415 PolarHBondContact O-N 3.47Å; A411-A458 HydrophobicContact CB-CB 3.83Å; A411-A458 WeakPolarHBondContact CB-O 3.26Å; A411-I461 HydrophobicContact CB-CB 3.97Å; A411-I461 HydrophobicContact CB-CG2 3.61Å; A411-L491 HydrophobicContact CB-CD1 4.17Å
412	L	98.5	Very high	98	Very high	44 Å²	44	44.5 Å²	44.5	23%	0.23	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-54.2	174.3	-69.9	165.1	0	0	0	111.6	H408 L414 E415 E416 A458	H408-L412 WeakPolarHBondContact O-CG 3.16Å; H408-L412 PolarHBondContact O-N 2.86Å; L412-L414 PolarHBondContact O-N 3.2Å; L412-E415 PolarHBondContact O-N 3.02Å; L412-E416 VanDerWaalsContact O-CG 3.31Å; L412-E416 WeakPolarHBondContact O-CG 3.33Å; L412-E416 PolarHBondContact O-N 3.47Å; L412-A458 HydrophobicContact CD2-CB 3.65Å; L412-A458 HydrophobicContact CG-CB 3.92Å
413	E	98.3	Very high	97.9	Very high	5 Å²	5	46.8 Å²	46.8	2%	0.023	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-32.8	175.5	-163.8	-147.9	148.3	0	0	111.9	K145 R152 C387 R417	K145-E413 VanDerWaalsContact CE-OE2 3.23Å; K145-E413 WeakPolarHBondContact CE-OE2 3.31Å; K145-E413 IonicContact NZ-OE1 3.26Å; K145-E413 IonicContact NZ-OE2 2.7Å; K145-E413 PolarHBondContact NZ-OE2 2.82Å; R152-E413 IonicContact CZ-OE1 3.78Å; R152-E413 IonicContact NH1-OE1 2.62Å; R152-E413 IonicContact NH2-OE1 3.64Å; R152-E413 PolarHBondContact NH2-OE1 2.87Å; C387-E413 WeakPolarHBondContact CB-OE2 3.48Å; E413-R417 WeakPolarHBondContact O-CB 3.34Å; E413-R417 VanDerWaalsContact O-CD 3.26Å; E413-R417 WeakPolarHBondContact O-CD 3.47Å; E413-R417 WeakPolarHBondContact O-CG 3.46Å; E413-R417 PolarHBondContact O-N 3.41Å; E413-R417 VanDerWaalsContact OE1-CD 3.3Å; E413-R417 WeakPolarHBondContact OE1-CD 3.13Å; E413-R417 IonicContact OE1-CZ 3.42Å; E413-R417 IonicContact OE1-NE 3.18Å; E413-R417 IonicContact OE1-NH1 2.91Å; E413-R417 PolarHBondContact OE1-NH1 3.43Å
414	L	98.4	Very high	97.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.7	-40.7	178.9	-175	56	0	0	0	112	I385 L410 A411 L412 L418 L432 I461 L491 A493	I385-L414 HydrophobicContact CG2-CD1 3.94Å; I385-L414 VanDerWaalsContact O-CD1 3.26Å; I385-L414 WeakPolarHBondContact O-CD1 3.36Å; L410-L414 WeakPolarHBondContact O-CB 3.3Å; L410-L414 PolarHBondContact O-N 2.64Å; L410-L414 VanDerWaalsContact O-N 3.14Å; A411-L414 PolarHBondContact O-N 3.34Å; L412-L414 PolarHBondContact O-N 3.2Å; L414-L418 HydrophobicContact CD1-CD1 3.86Å; L414-L418 HydrophobicContact CD1-CG 4.06Å; L414-L418 HydrophobicContact CG-CD1 3.79Å; L414-L418 HydrophobicContact CG-CG 4.43Å; L414-L418 VanDerWaalsContact O-CB 3.24Å; L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 WeakPolarHBondContact O-CD1 3.32Å; L414-L418 WeakPolarHBondContact O-CG 3.09Å; L414-L418 PolarHBondContact O-N 2.67Å; L414-L432 HydrophobicContact CD2-CD1 3.92Å; L414-I461 HydrophobicContact CD2-CG2 4.28Å; L414-L491 HydrophobicContact CD2-CB 3.73Å; L414-L491 HydrophobicContact CD2-CD1 4.32Å; L414-A493 HydrophobicContact CD1-CB 4.06Å
415	E	98.4	Very high	97.7	Very high	56 Å²	56	49 Å²	49	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-52.7	174.3	-178.6	-178.6	173.5	0	0	111.2	A411 L412 R417 L418 T419 A458	A411-E415 WeakPolarHBondContact O-CB 3.24Å; A411-E415 PolarHBondContact O-N 3.47Å; L412-E415 PolarHBondContact O-N 3.02Å; E415-R417 VanDerWaalsContact C-N 3.27Å; E415-R417 PolarHBondContact O-N 3.44Å; E415-L418 PolarHBondContact O-N 3.29Å; E415-L418 VanDerWaalsContact O-N 3.14Å; E415-T419 WeakPolarHBondContact O-CB 3.43Å; E415-T419 PolarHBondContact O-N 2.98Å; E415-T419 PolarHBondContact O-OG1 3.3Å; E415-A458 WeakPolarHBondContact OE2-CA 3.49Å; E415-A458 WeakPolarHBondContact OE2-CB 3.39Å; E415-A458 PolarHBondContact OE2-N 3.05Å
416	E	98.1	Very high	97.5	Very high	101 Å²	101	45.2 Å²	45.2	47%	0.472	23%	0.232	S	C	.	.	H	α-helix	trans	-48.9	-49.2	176.5	-71.6	163.8	-172.8	0	0	111.5	H143 L412 K420	H143-E416 IonicContact CD2-OE1 2.69Å; H143-E416 IonicContact CE1-OE1 3.58Å; H143-E416 IonicContact NE2-OE1 3.98Å; H143-E416 PolarHBondContact NE2-OE1 3.24Å; H143-E416 IonicContact NE2-OE2 3.52Å; L412-E416 VanDerWaalsContact O-CG 3.31Å; L412-E416 WeakPolarHBondContact O-CG 3.33Å; L412-E416 PolarHBondContact O-N 3.47Å; E416-K420 PolarHBondContact O-N 3Å; E416-K420 VanDerWaalsContact O-N 3.13Å
417	R	98.3	Very high	97.4	Very high	44 Å²	44	44.4 Å²	44.4	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-75.3	-30.5	-177.1	-70.6	167.9	56.3	-154.2	-10.2	113.6	R152 I385 G386 E413 E415 D421	R152-R417 VanDerWaalsContact NH2-NH1 3.16Å; I385-R417 HydrophobicContact CG2-CB 3.97Å; G386-R417 PolarHBondContact O-NH1 3.13Å; G386-R417 PolarHBondContact O-NH2 3.06Å; E413-R417 WeakPolarHBondContact O-CB 3.34Å; E413-R417 VanDerWaalsContact O-CD 3.26Å; E413-R417 WeakPolarHBondContact O-CD 3.47Å; E413-R417 WeakPolarHBondContact O-CG 3.46Å; E413-R417 PolarHBondContact O-N 3.41Å; E413-R417 VanDerWaalsContact OE1-CD 3.3Å; E413-R417 WeakPolarHBondContact OE1-CD 3.13Å; E413-R417 IonicContact OE1-CZ 3.42Å; E413-R417 IonicContact OE1-NE 3.18Å; E413-R417 IonicContact OE1-NH1 2.91Å; E413-R417 PolarHBondContact OE1-NH1 3.43Å; E415-R417 VanDerWaalsContact C-N 3.27Å; E415-R417 PolarHBondContact O-N 3.44Å; R417-D421 VanDerWaalsContact O-CB 3.26Å; R417-D421 WeakPolarHBondContact O-CB 3.49Å; R417-D421 PolarHBondContact O-N 3.09Å
418	L	98.3	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-76.8	-36.6	176.4	-79.8	170.5	0	0	0	112.5	I385 L414 E415 D421 R422 A429 L453 Y456 A493 F496	I385-L418 HydrophobicContact CB-CD2 4.33Å; I385-L418 HydrophobicContact CD1-CD2 4.36Å; I385-L418 HydrophobicContact CG2-CD2 4.49Å; I385-L418 HydrophobicContact CG2-CG 4.5Å; L414-L418 HydrophobicContact CD1-CD1 3.86Å; L414-L418 HydrophobicContact CD1-CG 4.06Å; L414-L418 HydrophobicContact CG-CD1 3.79Å; L414-L418 HydrophobicContact CG-CG 4.43Å; L414-L418 VanDerWaalsContact O-CB 3.24Å; L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 WeakPolarHBondContact O-CD1 3.32Å; L414-L418 WeakPolarHBondContact O-CG 3.09Å; L414-L418 PolarHBondContact O-N 2.67Å; E415-L418 PolarHBondContact O-N 3.29Å; E415-L418 VanDerWaalsContact O-N 3.14Å; L418-D421 PolarHBondContact O-N 2.88Å; L418-R422 VanDerWaalsContact O-CB 3.29Å; L418-R422 WeakPolarHBondContact O-CB 3.3Å; L418-R422 PolarHBondContact O-N 3.28Å; L418-A429 HydrophobicContact CD2-CB 4.08Å; L418-L453 HydrophobicContact CD1-CD2 3.91Å; L418-Y456 HydrophobicContact CB-CD1 4.33Å; L418-Y456 HydrophobicContact CB-CD2 3.68Å; L418-Y456 HydrophobicContact CB-CE1 4.39Å; L418-Y456 HydrophobicContact CB-CE2 3.71Å; L418-Y456 HydrophobicContact CB-CG 4.02Å; L418-Y456 HydrophobicContact CD1-CD1 3.9Å; L418-Y456 HydrophobicContact CD1-CE1 3.9Å; L418-Y456 HydrophobicContact CD1-CG 4.35Å; L418-Y456 HydrophobicContact CD2-CE1 4.49Å; L418-Y456 HydrophobicContact CD2-CE2 4.47Å; L418-A493 HydrophobicContact CD1-CB 3.74Å; L418-A493 HydrophobicContact CD2-CB 3.76Å; L418-A493 HydrophobicContact CG-CB 4.21Å; L418-F496 HydrophobicContact CD2-CE1 4.27Å; L418-F496 HydrophobicContact CD2-CZ 4.24Å
419	T	97.8	Very high	97.4	Very high	36 Å²	36	42.1 Å²	42.1	22%	0.221	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-51	172.3	-70	0	0	0	0	109.9	E415 D421 R422 E423	E415-T419 WeakPolarHBondContact O-CB 3.43Å; E415-T419 PolarHBondContact O-N 2.98Å; E415-T419 PolarHBondContact O-OG1 3.3Å; T419-D421 PolarHBondContact O-N 3.06Å; T419-R422 PolarHBondContact O-N 3.2Å; T419-E423 WeakPolarHBondContact CG2-OE1 3.33Å; T419-E423 VanDerWaalsContact O-CD 3.27Å; T419-E423 PolarHBondContact O-N 3.29Å
420	K	96.8	Very high	97.3	Very high	113 Å²	113	45.7 Å²	45.7	49%	0.491	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-39.6	174.5	-174.1	167.1	-177.2	166.2	0	113.4	E153 E416 E423 A424	E153-K420 IonicContact OE1-NZ 3.36Å; E153-K420 PolarHBondContact OE1-NZ 3.14Å; E416-K420 PolarHBondContact O-N 3Å; E416-K420 VanDerWaalsContact O-N 3.13Å; K420-E423 PolarHBondContact O-N 2.7Å; K420-A424 WeakPolarHBondContact O-CB 3.47Å; K420-A424 PolarHBondContact O-N 2.89Å
421	D	97.1	Very high	97.3	Very high	14 Å²	14	47.3 Å²	47.3	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-68.4	-37.2	176.6	-176.3	79.2	0	0	0	112.8	I385 R417 L418 T419 N425 R427 F496	I385-D421 HydrophobicContact CD1-CB 3.46Å; I385-D421 VanDerWaalsContact CD1-CB 3.46Å; R417-D421 VanDerWaalsContact O-CB 3.26Å; R417-D421 WeakPolarHBondContact O-CB 3.49Å; R417-D421 PolarHBondContact O-N 3.09Å; L418-D421 PolarHBondContact O-N 2.88Å; T419-D421 PolarHBondContact O-N 3.06Å; D421-N425 WeakPolarHBondContact O-CA 3.3Å; D421-N425 VanDerWaalsContact O-CB 3.22Å; D421-N425 WeakPolarHBondContact O-CB 3.47Å; D421-N425 PolarHBondContact O-N 3.06Å; D421-N425 PolarHBondContact OD1-ND2 2.79Å; D421-R427 IonicContact OD1-CZ 3.51Å; D421-R427 IonicContact OD1-NE 2.73Å; D421-R427 PolarHBondContact OD1-NE 2.96Å; D421-R427 IonicContact OD1-NH2 3.85Å; D421-R427 PolarHBondContact OD1-NH2 3.31Å; D421-R427 WeakPolarHBondContact OD2-CG 3.43Å; D421-R427 IonicContact OD2-CZ 2.67Å; D421-R427 IonicContact OD2-NE 2.72Å; D421-R427 PolarHBondContact OD2-NE 3.37Å; D421-R427 IonicContact OD2-NH2 3.6Å; D421-R427 PolarHBondContact OD2-NH2 2.81Å; D421-F496 WeakPolarHBondContact OD2-CE1 3.38Å
422	R	96.3	Very high	97.3	Very high	95 Å²	95	47.3 Å²	47.3	36%	0.358	24%	0.243	S	C	.	.	H	α-helix	trans	-64.2	-42.2	174.4	177.3	-171	65.7	-164.6	-3.6	112	L418 T419 G426 R427 V428 Y456	L418-R422 VanDerWaalsContact O-CB 3.29Å; L418-R422 WeakPolarHBondContact O-CB 3.3Å; L418-R422 PolarHBondContact O-N 3.28Å; T419-R422 PolarHBondContact O-N 3.2Å; R422-G426 WeakPolarHBondContact O-CA 3.3Å; R422-G426 PolarHBondContact O-N 2.6Å; R422-R427 VanDerWaalsContact CA-O 3.31Å; R422-R427 WeakPolarHBondContact CA-O 3.25Å; R422-R427 WeakPolarHBondContact CB-O 3.14Å; R422-V428 HydrophobicContact CB-CG1 4.47Å; R422-V428 HydrophobicContact CG-CG1 3.87Å; R422-Y456 HydrophobicContact CB-CE2 4.34Å
423	E	95.7	Very high	97.3	Very high	129 Å²	129	46.9 Å²	46.9	60%	0.603	24%	0.242	S	C	*	.	H	α-helix	trans	-71.7	-43.2	-179.9	-78.3	143.6	-147.1	0	0	112.7	T419 K420	T419-E423 WeakPolarHBondContact CG2-OE1 3.33Å; T419-E423 VanDerWaalsContact O-CD 3.27Å; T419-E423 PolarHBondContact O-N 3.29Å; K420-E423 PolarHBondContact O-N 2.7Å
424	A	94.6	Very high	97.2	Very high	75 Å²	75	46.6 Å²	46.6	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-76.6	-41.1	179.1	0	0	0	0	0	113.3	K420	K420-A424 WeakPolarHBondContact O-CB 3.47Å; K420-A424 PolarHBondContact O-N 2.89Å
425	N	95.2	Very high	97	Very high	65 Å²	65	46.7 Å²	46.7	35%	0.348	24%	0.241	S	C	.	.	H	α-helix	trans	-113.2	6.9	-167.4	-57	-48.4	0	0	0	114.1	L381 D421 R427	L381-N425 HydrophobicContact CD1-CB 3.75Å; D421-N425 WeakPolarHBondContact O-CA 3.3Å; D421-N425 VanDerWaalsContact O-CB 3.22Å; D421-N425 WeakPolarHBondContact O-CB 3.47Å; D421-N425 PolarHBondContact O-N 3.06Å; D421-N425 PolarHBondContact OD1-ND2 2.79Å; N425-R427 HydrophobicContact CB-CG 3.96Å; N425-R427 PolarHBondContact O-N 2.8Å; N425-R427 VanDerWaalsContact O-N 3.1Å
426	G	95.8	Very high	96.9	Very high	41 Å²	41	44 Å²	44	42%	0.423	23%	0.229	S	C	.	.	S	Bend	trans	61.7	21.6	171.8	0	0	0	0	0	115.6	R422 A499	R422-G426 WeakPolarHBondContact O-CA 3.3Å; R422-G426 PolarHBondContact O-N 2.6Å; G426-A499 VanDerWaalsContact O-CB 3.23Å; G426-A499 WeakPolarHBondContact O-CB 3.29Å; G426-A499 PolarHBondContact O-N 2.86Å
427	R	96.3	Very high	96.7	Very high	26 Å²	26	41.3 Å²	41.3	10%	0.098	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	160.1	-167.8	66.4	179.1	-168.3	159.7	2.1	113.2	P382 D421 R422 N425 F496 S497	P382-R427 PolarHBondContact O-NH1 2.88Å; P382-R427 PolarHBondContact O-NH2 2.94Å; D421-R427 IonicContact OD1-CZ 3.51Å; D421-R427 IonicContact OD1-NE 2.73Å; D421-R427 PolarHBondContact OD1-NE 2.96Å; D421-R427 IonicContact OD1-NH2 3.85Å; D421-R427 PolarHBondContact OD1-NH2 3.31Å; D421-R427 WeakPolarHBondContact OD2-CG 3.43Å; D421-R427 IonicContact OD2-CZ 2.67Å; D421-R427 IonicContact OD2-NE 2.72Å; D421-R427 PolarHBondContact OD2-NE 3.37Å; D421-R427 IonicContact OD2-NH2 3.6Å; D421-R427 PolarHBondContact OD2-NH2 2.81Å; R422-R427 VanDerWaalsContact CA-O 3.31Å; R422-R427 WeakPolarHBondContact CA-O 3.25Å; R422-R427 WeakPolarHBondContact CB-O 3.14Å; N425-R427 HydrophobicContact CB-CG 3.96Å; N425-R427 PolarHBondContact O-N 2.8Å; N425-R427 VanDerWaalsContact O-N 3.1Å; R427-F496 HydrophobicContact CB-CD1 4.28Å; R427-F496 HydrophobicContact CG-CD1 3.75Å; R427-F496 HydrophobicContact CG-CE1 4.29Å; R427-S497 CarbonylContact C-O 3.48Å; R427-S497 WeakPolarHBondContact CA-O 3.39Å; R427-S497 WeakPolarHBondContact CB-O 3.48Å
428	V	97.6	Very high	96.4	Very high	14 Å²	14	41.2 Å²	41.2	9%	0.085	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	120	-179.4	-74.1	0	0	0	0	112.8	R422 K430 Y456 F496 S497 A499	R422-V428 HydrophobicContact CB-CG1 4.47Å; R422-V428 HydrophobicContact CG-CG1 3.87Å; V428-K430 VanDerWaalsContact CG2-NZ 3.34Å; V428-Y456 WeakPolarHBondContact CA-OH 3.16Å; V428-Y456 WeakPolarHBondContact CB-OH 3.41Å; V428-Y456 HydrophobicContact CG1-CE2 4.25Å; V428-F496 WeakPolarHBondContact O-CA 3.35Å; V428-S497 PolarHBondContact N-O 3.04Å; V428-S497 PolarHBondContact O-N 2.92Å; V428-A499 HydrophobicContact CG1-CB 4.34Å
429	A	97.8	Very high	96	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	136.8	167.7	0	0	0	0	0	112	L418 L453 Y456 A493 F496	L418-A429 HydrophobicContact CD2-CB 4.08Å; A429-L453 HydrophobicContact CB-CD2 4.07Å; A429-Y456 PolarHBondContact N-OH 3.14Å; A429-Y456 PolarHBondContact O-OH 2.89Å; A429-A493 HydrophobicContact CB-CB 3.82Å; A429-F496 HydrophobicContact CB-CD1 3.93Å; A429-F496 HydrophobicContact CB-CD2 4.36Å; A429-F496 HydrophobicContact CB-CE1 3.69Å; A429-F496 HydrophobicContact CB-CE2 4.14Å; A429-F496 HydrophobicContact CB-CG 4.26Å; A429-F496 HydrophobicContact CB-CZ 3.8Å
430	K	97.6	Very high	95.4	Very high	101 Å²	101	47.4 Å²	47.4	44%	0.439	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-10.3	-179	-55.5	-60.6	-175.3	-177.9	0	114.5	V428 L453 S494 K495 S497	V428-K430 VanDerWaalsContact CG2-NZ 3.34Å; K430-L453 PolarHBondContact O-N 3.36Å; K430-S494 PolarHBondContact N-O 3.21Å; K430-S494 VanDerWaalsContact N-O 3.11Å; K430-K495 WeakPolarHBondContact CB-O 3.43Å; K430-K495 PolarHBondContact N-O 3.45Å; K430-S497 WeakPolarHBondContact CE-OG 3.21Å
431	L	98.2	Very high	94.7	Very high	33 Å²	33	44.2 Å²	44.2	17%	0.173	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121	-177.3	-171.3	78.7	0	0	0	111.6	C450 A493 S494 K495	L431-C450 HydrophobicContact CD1-CB 3.92Å; L431-C450 HydrophobicContact CD2-CB 4.26Å; L431-C450 HydrophobicContact CG-CB 4.08Å; L431-A493 CarbonylContact O-C 3.58Å; L431-A493 WeakPolarHBondContact O-CA 3.49Å; L431-S494 PolarHBondContact N-O 3.07Å; L431-S494 PolarHBondContact O-N 2.92Å; L431-S494 PolarHBondContact O-OG 3.25Å; L431-K495 HydrophobicContact CB-CB 4.03Å; L431-K495 HydrophobicContact CB-CD 4.08Å; L431-K495 HydrophobicContact CB-CG 4.03Å; L431-K495 HydrophobicContact CD2-CD 4.07Å; L431-K495 HydrophobicContact CD2-CG 4.23Å
432	L	98.4	Very high	93.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122	170.2	175.6	60.8	0	0	0	109.1	L414 V434 C450 C451 L453 I461 L491	L414-L432 HydrophobicContact CD2-CD1 3.92Å; L432-V434 HydrophobicContact CG-CG2 4.44Å; L432-C450 CarbonylContact O-C 3.53Å; L432-C450 WeakPolarHBondContact O-CA 3.24Å; L432-C450 VanDerWaalsContact O-CB 3.31Å; L432-C450 WeakPolarHBondContact O-CB 3.44Å; L432-C451 PolarHBondContact N-O 3.19Å; L432-C451 PolarHBondContact O-N 3.3Å; L432-L453 HydrophobicContact CB-CB 4.05Å; L432-L453 HydrophobicContact CB-CD1 4.31Å; L432-I461 HydrophobicContact CD1-CG2 4.4Å; L432-I461 HydrophobicContact CD2-CG2 3.93Å; L432-L491 HydrophobicContact CD1-CB 4.34Å
433	T	97.5	Very high	92.6	Very high	34 Å²	34	56 Å²	56	21%	0.209	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	128.3	172.8	-60.4	0	0	0	0	109.8	R449 L491 S492	T433-R449 CarbonylContact C-O 3.55Å; T433-R449 WeakPolarHBondContact CA-O 3.33Å; T433-L491 CarbonylContact O-C 3.51Å; T433-L491 WeakPolarHBondContact O-CA 3.47Å; T433-S492 PolarHBondContact N-O 2.79Å; T433-S492 PolarHBondContact O-N 2.86Å
434	V	97.1	Very high	91	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.8	175.5	-174	0	0	0	0	108.5	L432 V436 S448 R449 S465 I468 I469 H490 L491	L432-V434 HydrophobicContact CG-CG2 4.44Å; V434-V436 HydrophobicContact CG1-CG1 4.48Å; V434-S448 VanDerWaalsContact O-CA 3.23Å; V434-S448 WeakPolarHBondContact O-CA 3.49Å; V434-R449 PolarHBondContact N-O 3.42Å; V434-R449 PolarHBondContact O-N 2.9Å; V434-S465 WeakPolarHBondContact CG2-OG 3.26Å; V434-I468 HydrophobicContact CB-CD1 4.14Å; V434-I468 HydrophobicContact CB-CG1 4.47Å; V434-I468 HydrophobicContact CG2-CD1 3.75Å; V434-I468 HydrophobicContact CG2-CG1 4.18Å; V434-I469 HydrophobicContact CB-CG2 4.19Å; V434-I469 HydrophobicContact CG1-CG2 3.59Å; V434-H490 CarbonylContact C-O 3.49Å; V434-H490 WeakPolarHBondContact CA-O 3.27Å; V434-L491 HydrophobicContact CB-CD2 4.34Å; V434-L491 HydrophobicContact CG1-CD2 4.03Å; V434-L491 HydrophobicContact CG2-CD2 3.8Å
435	G	95	Very high	89.4	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.4	173.7	0	0	0	0	0	111.2	F447 H490	G435-F447 WeakPolarHBondContact CA-O 3.48Å; G435-H490 PolarHBondContact N-O 2.7Å; G435-H490 PolarHBondContact O-N 2.91Å
436	V	94.9	Very high	88.1	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	159.1	174	-49.6	0	0	0	0	111.4	V434 S446 F447 I469 L472 L486 L488 L489	V434-V436 HydrophobicContact CG1-CG1 4.48Å; V436-S446 WeakPolarHBondContact O-CB 3.37Å; V436-S446 PolarHBondContact O-N 3.03Å; V436-F447 HydrophobicContact CG2-CB 4.19Å; V436-F447 HydrophobicContact CG2-CD1 4.41Å; V436-F447 PolarHBondContact N-O 3.45Å; V436-F447 PolarHBondContact O-N 3.16Å; V436-I469 HydrophobicContact CG1-CD1 3.92Å; V436-I469 HydrophobicContact CG1-CG2 4.15Å; V436-L472 HydrophobicContact CG2-CD1 3.48Å; V436-L472 VanDerWaalsContact CG2-CD1 3.48Å; V436-L486 HydrophobicContact CB-CD2 4.44Å; V436-L486 HydrophobicContact CG1-CD1 4.39Å; V436-L486 HydrophobicContact CG2-CD2 4.47Å; V436-L488 WeakPolarHBondContact CA-O 3.26Å; V436-L489 HydrophobicContact CG1-CD2 3.78Å
437	R	94.1	Very high	87.4	Confident	44 Å²	44	55.5 Å²	55.5	17%	0.166	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.6	164.5	-169.2	175.1	54.3	-123.1	-2.2	109.7	N390 D441 R443 Q444 S446 L486 T487 L488	N390-R437 PolarHBondContact OD1-NH2 2.95Å; R437-D441 HydrophobicContact CG-CB 4.48Å; R437-R443 WeakPolarHBondContact CD-O 3.5Å; R437-Q444 PolarHBondContact NH1-O 3.29Å; R437-S446 WeakPolarHBondContact CA-OG 3.39Å; R437-S446 WeakPolarHBondContact CG-OG 3.36Å; R437-L486 CarbonylContact O-C 3.55Å; R437-L486 WeakPolarHBondContact O-CA 3.14Å; R437-T487 WeakPolarHBondContact CG-OG1 3.34Å; R437-T487 PolarHBondContact NE-OG1 2.89Å; R437-T487 PolarHBondContact NH2-O 3.11Å; R437-T487 PolarHBondContact O-N 3.49Å; R437-T487 PolarHBondContact O-OG1 3.11Å; R437-L488 HydrophobicContact CB-CB 3.69Å; R437-L488 PolarHBondContact N-O 3.35Å; R437-L488 PolarHBondContact O-N 2.97Å
438	Q	92.1	Very high	87.2	Confident	43 Å²	43	57.3 Å²	57.3	20%	0.201	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	154.5	176	-77.3	172.6	-37.9	0	0	110.8	G440 D441 S446 L472 P484 L486	Q438-G440 PolarHBondContact O-N 3.43Å; Q438-D441 PolarHBondContact O-N 2.88Å; Q438-S446 PolarHBondContact N-OG 2.86Å; Q438-L472 PolarHBondContact NE2-O 3.29Å; Q438-P484 HydrophobicContact CB-CG 3.9Å; Q438-P484 HydrophobicContact CG-CG 3.84Å; Q438-L486 HydrophobicContact CG-CD2 3.72Å
439	L	90.6	Very high	87	Confident	93 Å²	93	62.8 Å²	62.8	49%	0.487	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	132.3	174.3	-174.8	64.4	0	0	0	110.3	P485 T487	L439-P485 HydrophobicContact CB-CB 4.49Å; L439-P485 WeakPolarHBondContact CB-O 3.35Å; L439-P485 HydrophobicContact CD2-CG 4.46Å; L439-P485 PolarHBondContact N-O 2.87Å; L439-T487 HydrophobicContact CB-CG2 4.05Å; L439-T487 HydrophobicContact CD1-CG2 3.84Å
440	G	84.2	Confident	86.9	Confident	73 Å²	73	66.2 Å²	66.2	75%	0.753	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	-17.7	-177.2	0	0	0	0	0	115	Q438	Q438-G440 PolarHBondContact O-N 3.43Å
441	D	82.7	Confident	86.9	Confident	45 Å²	45	62.7 Å²	62.7	24%	0.241	33%	0.327	C	S	.	.			trans	-79.8	133.6	175.1	-163.4	-17.2	0	0	0	111.7	R437 Q438 R443 S446	R437-D441 HydrophobicContact CG-CB 4.48Å; Q438-D441 PolarHBondContact O-N 2.88Å; D441-R443 WeakPolarHBondContact OD1-CB 3.4Å; D441-R443 WeakPolarHBondContact OD1-CG 3.19Å; D441-R443 PolarHBondContact OD1-N 3.32Å; D441-R443 IonicContact OD1-NE 2.98Å; D441-R443 PolarHBondContact OD1-NE 2.97Å; D441-R443 VanDerWaalsContact OD1-NE 3.12Å; D441-R443 IonicContact OD2-CZ 3.71Å; D441-R443 IonicContact OD2-NE 3.74Å; D441-R443 PolarHBondContact OD2-NE 3.04Å; D441-R443 IonicContact OD2-NH2 2.76Å; D441-R443 PolarHBondContact OD2-NH2 3.36Å; D441-S446 VanDerWaalsContact CB-OG 3.28Å; D441-S446 WeakPolarHBondContact CB-OG 3.27Å; D441-S446 WeakPolarHBondContact OD2-CA 3.23Å; D441-S446 WeakPolarHBondContact OD2-CB 3.42Å; D441-S446 PolarHBondContact OD2-OG 3.47Å
442	K	74.7	Confident	86.9	Confident	211 Å²	211	64 Å²	64	92%	0.917	34%	0.343	S	S	*	.			trans	-90.4	-8.2	178.7	-61.7	-175.3	179.9	-178.3	0	113.2
443	R	75.3	Confident	86.8	Confident	146 Å²	146	64.5 Å²	64.5	55%	0.551	35%	0.345	S	S	*	.	S	Bend	trans	-75.6	143.5	177.9	-63.1	175.6	-67.6	163	4.2	110.7	R437 D441 S445 S446	R437-R443 WeakPolarHBondContact CD-O 3.5Å; D441-R443 WeakPolarHBondContact OD1-CB 3.4Å; D441-R443 WeakPolarHBondContact OD1-CG 3.19Å; D441-R443 PolarHBondContact OD1-N 3.32Å; D441-R443 IonicContact OD1-NE 2.98Å; D441-R443 PolarHBondContact OD1-NE 2.97Å; D441-R443 VanDerWaalsContact OD1-NE 3.12Å; D441-R443 IonicContact OD2-CZ 3.71Å; D441-R443 IonicContact OD2-NE 3.74Å; D441-R443 PolarHBondContact OD2-NE 3.04Å; D441-R443 IonicContact OD2-NH2 2.76Å; D441-R443 PolarHBondContact OD2-NH2 3.36Å; R443-S445 VanDerWaalsContact C-N 3.26Å; R443-S445 WeakPolarHBondContact CB-O 3.22Å; R443-S445 PolarHBondContact O-N 3.11Å; R443-S446 VanDerWaalsContact CZ-O 3.23Å; R443-S446 PolarHBondContact NH1-O 3.36Å; R443-S446 PolarHBondContact NH2-O 3.09Å
444	Q	61.7	Low	86.6	Confident	179 Å²	179	68 Å²	68	84%	0.836	37%	0.367	S	S	*	.	S	Bend	trans	-60	-37.8	179.1	-71.6	-178.8	-9.6	0	0	112.2	R437	R437-Q444 PolarHBondContact NH1-O 3.29Å
445	S	60.2	Low	86.5	Confident	60 Å²	60	73.8 Å²	73.8	42%	0.42	39%	0.388	S	S	.	.			trans	-125.1	128.7	165.7	-177.7	0	0	0	0	108.6	R443	R443-S445 VanDerWaalsContact C-N 3.26Å; R443-S445 WeakPolarHBondContact CB-O 3.22Å; R443-S445 PolarHBondContact O-N 3.11Å
446	S	68.3	Low	86.5	Confident	10 Å²	10	75.4 Å²	75.4	7%	0.07	39%	0.394	C	S	.	.			trans	-78.2	-39.4	179	-67.6	0	0	0	0	112.3	V436 R437 Q438 D441 R443	V436-S446 WeakPolarHBondContact O-CB 3.37Å; V436-S446 PolarHBondContact O-N 3.03Å; R437-S446 WeakPolarHBondContact CA-OG 3.39Å; R437-S446 WeakPolarHBondContact CG-OG 3.36Å; Q438-S446 PolarHBondContact N-OG 2.86Å; D441-S446 VanDerWaalsContact CB-OG 3.28Å; D441-S446 WeakPolarHBondContact CB-OG 3.27Å; D441-S446 WeakPolarHBondContact OD2-CA 3.23Å; D441-S446 WeakPolarHBondContact OD2-CB 3.42Å; D441-S446 PolarHBondContact OD2-OG 3.47Å; R443-S446 VanDerWaalsContact CZ-O 3.23Å; R443-S446 PolarHBondContact NH1-O 3.36Å; R443-S446 PolarHBondContact NH2-O 3.09Å
447	F	82.2	Confident	86.7	Confident	50 Å²	50	79.3 Å²	79.3	22%	0.219	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	138.2	-160.1	-177.1	-90.1	0	0	0	109.7	G435 V436 R449 L472	G435-F447 WeakPolarHBondContact CA-O 3.48Å; V436-F447 HydrophobicContact CG2-CB 4.19Å; V436-F447 HydrophobicContact CG2-CD1 4.41Å; V436-F447 PolarHBondContact N-O 3.45Å; V436-F447 PolarHBondContact O-N 3.16Å; F447-R449 HydrophobicContact CD1-CG 4.35Å; F447-R449 HydrophobicContact CE1-CB 4.4Å; F447-R449 HydrophobicContact CE1-CG 3.38Å; F447-R449 VanDerWaalsContact CE2-CZ 3.48Å; F447-R449 HydrophobicContact CZ-CG 3.67Å; F447-L472 HydrophobicContact CD1-CD1 3.53Å; F447-L472 HydrophobicContact CD1-CD2 3.95Å; F447-L472 HydrophobicContact CD1-CG 4.21Å; F447-L472 HydrophobicContact CD2-CD2 4Å; F447-L472 HydrophobicContact CE1-CD1 3.65Å; F447-L472 HydrophobicContact CE1-CD2 3.68Å; F447-L472 HydrophobicContact CE1-CG 3.92Å; F447-L472 HydrophobicContact CE2-CD2 3.77Å; F447-L472 HydrophobicContact CG-CD1 4.19Å; F447-L472 HydrophobicContact CG-CD2 4.07Å; F447-L472 HydrophobicContact CZ-CD1 4.43Å; F447-L472 HydrophobicContact CZ-CD2 3.59Å; F447-L472 HydrophobicContact CZ-CG 4.25Å
448	S	90.8	Very high	86.9	Confident	64 Å²	64	77.4 Å²	77.4	45%	0.448	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.2	170.2	55.5	0	0	0	0	111.6	V434	V434-S448 VanDerWaalsContact O-CA 3.23Å; V434-S448 WeakPolarHBondContact O-CA 3.49Å
449	R	94.4	Very high	87.1	Confident	130 Å²	130	78.8 Å²	78.8	49%	0.491	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	161.4	166.7	-73.6	-68	178.8	-90.1	8	108.8	T433 V434 F447 I468	T433-R449 CarbonylContact C-O 3.55Å; T433-R449 WeakPolarHBondContact CA-O 3.33Å; V434-R449 PolarHBondContact N-O 3.42Å; V434-R449 PolarHBondContact O-N 2.9Å; F447-R449 HydrophobicContact CD1-CG 4.35Å; F447-R449 HydrophobicContact CE1-CB 4.4Å; F447-R449 HydrophobicContact CE1-CG 3.38Å; F447-R449 VanDerWaalsContact CE2-CZ 3.48Å; F447-R449 HydrophobicContact CZ-CG 3.67Å; R449-I468 HydrophobicContact CB-CB 4.38Å; R449-I468 HydrophobicContact CB-CD1 3.8Å; R449-I468 HydrophobicContact CB-CG1 4.18Å
450	C	96	Very high	87.5	Confident	72 Å²	72	78.1 Å²	78.1	49%	0.486	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	155.3	176.6	59.4	0	0	0	0	111.8	L431 L432	L431-C450 HydrophobicContact CD1-CB 3.92Å; L431-C450 HydrophobicContact CD2-CB 4.26Å; L431-C450 HydrophobicContact CG-CB 4.08Å; L432-C450 CarbonylContact O-C 3.53Å; L432-C450 WeakPolarHBondContact O-CA 3.24Å; L432-C450 VanDerWaalsContact O-CB 3.31Å; L432-C450 WeakPolarHBondContact O-CB 3.44Å
451	C	96.8	Very high	88.2	Confident	27 Å²	27	74.7 Å²	74.7	18%	0.182	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	169.5	175.3	57	0	0	0	0	110.1	L432 L453 I468	L432-C451 PolarHBondContact N-O 3.19Å; L432-C451 PolarHBondContact O-N 3.3Å; C451-L453 PolarHBondContact O-N 3.33Å; C451-I468 HydrophobicContact CB-CD1 4.32Å; C451-I468 HydrophobicContact CB-CG2 4.24Å
452	A	97.4	Very high	88.9	Confident	62 Å²	62	73.2 Å²	73.2	51%	0.512	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130.1	175.2	0	0	0	0	0	110.7	V454	A452-V454 HydrophobicContact CB-CG2 4.11Å; A452-V454 PolarHBondContact O-N 2.98Å
453	L	97.3	Very high	90	Very high	10 Å²	10	66.7 Å²	66.7	5%	0.052	35%	0.349	C	S	.	.			trans	-91.4	94.2	172.2	-176	56.9	0	0	0	108.4	L418 A429 K430 L432 C451 Y456 I461 A493	L418-L453 HydrophobicContact CD1-CD2 3.91Å; A429-L453 HydrophobicContact CB-CD2 4.07Å; K430-L453 PolarHBondContact O-N 3.36Å; L432-L453 HydrophobicContact CB-CB 4.05Å; L432-L453 HydrophobicContact CB-CD1 4.31Å; C451-L453 PolarHBondContact O-N 3.33Å; L453-Y456 HydrophobicContact CD1-CD1 4.38Å; L453-Y456 HydrophobicContact CD2-CD1 4.26Å; L453-Y456 HydrophobicContact CD2-CE1 3.74Å; L453-Y456 HydrophobicContact CG-CD1 4.2Å; L453-Y456 HydrophobicContact CG-CE1 3.89Å; L453-I461 HydrophobicContact CD1-CD1 4.06Å; L453-I461 HydrophobicContact CD1-CG1 3.79Å; L453-A493 HydrophobicContact CD2-CB 3.63Å
454	V	93.4	Very high	91.1	Very high	108 Å²	108	61.3 Å²	61.3	66%	0.655	33%	0.332	S	S	*	.			trans	-87.4	-36.5	-170.9	-172.3	0	0	0	0	112.5	A452	A452-V454 HydrophobicContact CB-CG2 4.11Å; A452-V454 PolarHBondContact O-N 2.98Å
455	R	93.8	Very high	92.8	Very high	122 Å²	122	52.8 Å²	52.8	46%	0.46	29%	0.292	S	S	.	.			trans	-139.8	155.9	-178.6	-66.3	-175.6	172.1	-139.8	-14	110.2	D512	R455-D512 IonicContact CZ-OD1 3.59Å; R455-D512 IonicContact CZ-OD2 2.78Å; R455-D512 VanDerWaalsContact CZ-OD2 3.26Å; R455-D512 IonicContact NH1-OD1 2.69Å; R455-D512 PolarHBondContact NH1-OD1 3.4Å; R455-D512 IonicContact NH1-OD2 3.14Å; R455-D512 PolarHBondContact NH1-OD2 2.9Å; R455-D512 IonicContact NH2-OD1 2.65Å; R455-D512 PolarHBondContact NH2-OD1 2.91Å; R455-D512 IonicContact NH2-OD2 2.64Å; R455-D512 PolarHBondContact NH2-OD2 2.96Å
456	Y	96.7	Very high	94.5	Very high	34 Å²	34	51.8 Å²	51.8	13%	0.133	28%	0.28	C	S	.	.			trans	-97.6	94.8	170.4	-58.7	-15.2	0	0	0	107.3	L418 R422 V428 A429 L453	L418-Y456 HydrophobicContact CB-CD1 4.33Å; L418-Y456 HydrophobicContact CB-CD2 3.68Å; L418-Y456 HydrophobicContact CB-CE1 4.39Å; L418-Y456 HydrophobicContact CB-CE2 3.71Å; L418-Y456 HydrophobicContact CB-CG 4.02Å; L418-Y456 HydrophobicContact CD1-CD1 3.9Å; L418-Y456 HydrophobicContact CD1-CE1 3.9Å; L418-Y456 HydrophobicContact CD1-CG 4.35Å; L418-Y456 HydrophobicContact CD2-CE1 4.49Å; L418-Y456 HydrophobicContact CD2-CE2 4.47Å; R422-Y456 HydrophobicContact CB-CE2 4.34Å; V428-Y456 WeakPolarHBondContact CA-OH 3.16Å; V428-Y456 WeakPolarHBondContact CB-OH 3.41Å; V428-Y456 HydrophobicContact CG1-CE2 4.25Å; A429-Y456 PolarHBondContact N-OH 3.14Å; A429-Y456 PolarHBondContact O-OH 2.89Å; L453-Y456 HydrophobicContact CD1-CD1 4.38Å; L453-Y456 HydrophobicContact CD2-CD1 4.26Å; L453-Y456 HydrophobicContact CD2-CE1 3.74Å; L453-Y456 HydrophobicContact CG-CD1 4.2Å; L453-Y456 HydrophobicContact CG-CE1 3.89Å
457	E	97.9	Very high	95.8	Very high	83 Å²	83	53.4 Å²	53.4	39%	0.388	29%	0.294	S	S	.	.			trans	-156.8	114.5	-175.2	-164.8	-154	155	0	0	107	T459 K460 I461	E457-T459 VanDerWaalsContact C-N 3.29Å; E457-T459 WeakPolarHBondContact CG-OG1 3.09Å; E457-T459 PolarHBondContact O-N 2.84Å; E457-T459 PolarHBondContact OE1-OG1 2.96Å; E457-K460 HydrophobicContact CB-CB 4.09Å; E457-K460 PolarHBondContact O-N 3.45Å; E457-I461 WeakPolarHBondContact O-CG1 3.28Å; E457-I461 PolarHBondContact O-N 2.91Å
458	A	97.9	Very high	96.4	Very high	3 Å²	3	53 Å²	53	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-31.3	-167.1	0	0	0	0	0	113.3	A411 L412 E415 S462	A411-A458 HydrophobicContact CB-CB 3.83Å; A411-A458 WeakPolarHBondContact CB-O 3.26Å; L412-A458 HydrophobicContact CD2-CB 3.65Å; L412-A458 HydrophobicContact CG-CB 3.92Å; E415-A458 WeakPolarHBondContact OE2-CA 3.49Å; E415-A458 WeakPolarHBondContact OE2-CB 3.39Å; E415-A458 PolarHBondContact OE2-N 3.05Å; A458-S462 VanDerWaalsContact O-CB 3.22Å; A458-S462 WeakPolarHBondContact O-CB 3.44Å; A458-S462 PolarHBondContact O-N 2.91Å; A458-S462 PolarHBondContact O-OG 3.36Å
459	T	98	Very high	96.6	Very high	73 Å²	73	50 Å²	50	45%	0.448	27%	0.273	S	S	.	.	H	α-helix	trans	-55.4	-53.5	167.9	45.9	0	0	0	0	111.1	E457 S462 S463	E457-T459 VanDerWaalsContact C-N 3.29Å; E457-T459 WeakPolarHBondContact CG-OG1 3.09Å; E457-T459 PolarHBondContact O-N 2.84Å; E457-T459 PolarHBondContact OE1-OG1 2.96Å; T459-S462 PolarHBondContact O-OG 3.47Å; T459-S463 WeakPolarHBondContact O-CB 3.31Å; T459-S463 PolarHBondContact O-N 2.73Å
460	K	97.9	Very high	96.5	Very high	78 Å²	78	48.6 Å²	48.6	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-47.5	-179.8	-170.8	65.3	171.5	71.9	0	111.7	E457 S462 S463 D464	E457-K460 HydrophobicContact CB-CB 4.09Å; E457-K460 PolarHBondContact O-N 3.45Å; K460-S462 PolarHBondContact O-N 3.46Å; K460-S463 PolarHBondContact O-N 2.94Å; K460-D464 IonicContact NZ-OD1 3.22Å; K460-D464 PolarHBondContact NZ-OD1 3.14Å; K460-D464 IonicContact NZ-OD2 3.12Å; K460-D464 PolarHBondContact NZ-OD2 3.4Å; K460-D464 WeakPolarHBondContact O-CB 3.2Å; K460-D464 VanDerWaalsContact O-CG 3.26Å; K460-D464 PolarHBondContact O-N 2.96Å
461	I	98.4	Very high	96.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-46.5	178	-70.2	170.4	0	0	0	110.8	A411 L414 L432 L453 E457 S465 L491	A411-I461 HydrophobicContact CB-CB 3.97Å; A411-I461 HydrophobicContact CB-CG2 3.61Å; L414-I461 HydrophobicContact CD2-CG2 4.28Å; L432-I461 HydrophobicContact CD1-CG2 4.4Å; L432-I461 HydrophobicContact CD2-CG2 3.93Å; L453-I461 HydrophobicContact CD1-CD1 4.06Å; L453-I461 HydrophobicContact CD1-CG1 3.79Å; E457-I461 WeakPolarHBondContact O-CG1 3.28Å; E457-I461 PolarHBondContact O-N 2.91Å; I461-S465 VanDerWaalsContact O-CB 3.23Å; I461-S465 WeakPolarHBondContact O-CB 3.48Å; I461-S465 PolarHBondContact O-N 2.98Å; I461-S465 PolarHBondContact O-OG 3.14Å; I461-L491 HydrophobicContact CG2-CD1 4.1Å
462	S	97.9	Very high	96	Very high	15 Å²	15	49.6 Å²	49.6	11%	0.105	28%	0.276	C	S	.	.	H	α-helix	trans	-72.8	-36.2	179.8	59.3	0	0	0	0	113.2	H408 A458 T459 K460 S465 F466	H408-S462 PolarHBondContact ND1-OG 3.04Å; A458-S462 VanDerWaalsContact O-CB 3.22Å; A458-S462 WeakPolarHBondContact O-CB 3.44Å; A458-S462 PolarHBondContact O-N 2.91Å; A458-S462 PolarHBondContact O-OG 3.36Å; T459-S462 PolarHBondContact O-OG 3.47Å; K460-S462 PolarHBondContact O-N 3.46Å; S462-S465 PolarHBondContact O-N 3.1Å; S462-F466 WeakPolarHBondContact O-CB 3.41Å; S462-F466 PolarHBondContact O-N 3.03Å
463	S	97.8	Very high	95.7	Very high	73 Å²	73	47.1 Å²	47.1	51%	0.51	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-51.6	173.1	-175.7	0	0	0	0	111.9	T459 K460 S465 F466 A467	T459-S463 WeakPolarHBondContact O-CB 3.31Å; T459-S463 PolarHBondContact O-N 2.73Å; K460-S463 PolarHBondContact O-N 2.94Å; S463-S465 VanDerWaalsContact C-N 3.3Å; S463-S465 PolarHBondContact O-N 3.42Å; S463-F466 PolarHBondContact O-N 2.97Å; S463-A467 WeakPolarHBondContact O-CB 3.25Å; S463-A467 PolarHBondContact O-N 2.73Å
464	D	97.7	Very high	95.5	Very high	34 Å²	34	51.9 Å²	51.9	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-41.1	176.5	-69	-18	0	0	0	111	K460 A467 I468	K460-D464 IonicContact NZ-OD1 3.22Å; K460-D464 PolarHBondContact NZ-OD1 3.14Å; K460-D464 IonicContact NZ-OD2 3.12Å; K460-D464 PolarHBondContact NZ-OD2 3.4Å; K460-D464 WeakPolarHBondContact O-CB 3.2Å; K460-D464 VanDerWaalsContact O-CG 3.26Å; K460-D464 PolarHBondContact O-N 2.96Å; D464-A467 PolarHBondContact O-N 3.08Å; D464-I468 PolarHBondContact O-N 3.15Å; D464-I468 VanDerWaalsContact O-N 3.1Å
465	S	97.3	Very high	95.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-47.4	177.4	-62.9	0	0	0	0	111.9	V434 I461 S462 S463 A467 I468 I469 L491	V434-S465 WeakPolarHBondContact CG2-OG 3.26Å; I461-S465 VanDerWaalsContact O-CB 3.23Å; I461-S465 WeakPolarHBondContact O-CB 3.48Å; I461-S465 PolarHBondContact O-N 2.98Å; I461-S465 PolarHBondContact O-OG 3.14Å; S462-S465 PolarHBondContact O-N 3.1Å; S463-S465 VanDerWaalsContact C-N 3.3Å; S463-S465 PolarHBondContact O-N 3.42Å; S465-A467 VanDerWaalsContact C-N 3.32Å; S465-A467 PolarHBondContact O-N 3Å; S465-I468 WeakPolarHBondContact O-CG1 3.4Å; S465-I468 PolarHBondContact O-N 3.47Å; S465-I469 WeakPolarHBondContact O-CG1 3.49Å; S465-I469 PolarHBondContact O-N 3.07Å; S465-L491 WeakPolarHBondContact OG-CD2 3.39Å
466	F	96.7	Very high	94.3	Very high	39 Å²	39	43.1 Å²	43.1	17%	0.171	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-41	175.9	-175	-102.3	0	0	0	111.2	K400 V403 Q404 L407 S462 S463 I468 I469 K470 W482	K400-F466 HydrophobicContact CB-CZ 4.35Å; K400-F466 HydrophobicContact CG-CZ 4.3Å; V403-F466 HydrophobicContact CG1-CD2 4.28Å; V403-F466 HydrophobicContact CG1-CE2 4.47Å; Q404-F466 HydrophobicContact CG-CD1 4.36Å; Q404-F466 HydrophobicContact CG-CD2 3.48Å; Q404-F466 VanDerWaalsContact CG-CD2 3.48Å; Q404-F466 HydrophobicContact CG-CE1 4.35Å; Q404-F466 HydrophobicContact CG-CE2 3.46Å; Q404-F466 VanDerWaalsContact CG-CE2 3.46Å; Q404-F466 HydrophobicContact CG-CG 3.94Å; Q404-F466 HydrophobicContact CG-CZ 3.92Å; L407-F466 HydrophobicContact CD1-CB 3.77Å; L407-F466 HydrophobicContact CD1-CD2 4.12Å; L407-F466 HydrophobicContact CD1-CG 4.47Å; S462-F466 WeakPolarHBondContact O-CB 3.41Å; S462-F466 PolarHBondContact O-N 3.03Å; S463-F466 PolarHBondContact O-N 2.97Å; F466-I468 VanDerWaalsContact C-N 3.3Å; F466-I468 PolarHBondContact O-N 2.91Å; F466-I469 PolarHBondContact O-N 2.9Å; F466-K470 HydrophobicContact CE1-CB 4.47Å; F466-K470 WeakPolarHBondContact O-CB 3.4Å; F466-K470 PolarHBondContact O-N 3.21Å; F466-W482 HydrophobicContact CD2-CZ3 4.34Å; F466-W482 HydrophobicContact CE2-CE3 4.39Å; F466-W482 AromaticContact CE2-CZ3 3.69Å; F466-W482 HydrophobicContact CE2-CZ3 3.69Å; F466-W482 HydrophobicContact CZ-CZ3 4.36Å
467	A	96	Very high	93.2	Very high	44 Å²	44	47.5 Å²	47.5	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-34.1	179.8	0	0	0	0	0	113.4	S463 D464 S465 K470	S463-A467 WeakPolarHBondContact O-CB 3.25Å; S463-A467 PolarHBondContact O-N 2.73Å; D464-A467 PolarHBondContact O-N 3.08Å; S465-A467 VanDerWaalsContact C-N 3.32Å; S465-A467 PolarHBondContact O-N 3Å; A467-K470 VanDerWaalsContact O-CE 3.3Å; A467-K470 WeakPolarHBondContact O-CE 3.43Å; A467-K470 WeakPolarHBondContact O-CG 3.37Å
468	I	94.8	Very high	92.1	Very high	42 Å²	42	53 Å²	53	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-88.7	-15.7	177.8	71.2	175.8	0	0	0	114.8	V434 R449 C451 D464 S465 F466	V434-I468 HydrophobicContact CB-CD1 4.14Å; V434-I468 HydrophobicContact CB-CG1 4.47Å; V434-I468 HydrophobicContact CG2-CD1 3.75Å; V434-I468 HydrophobicContact CG2-CG1 4.18Å; R449-I468 HydrophobicContact CB-CB 4.38Å; R449-I468 HydrophobicContact CB-CD1 3.8Å; R449-I468 HydrophobicContact CB-CG1 4.18Å; C451-I468 HydrophobicContact CB-CD1 4.32Å; C451-I468 HydrophobicContact CB-CG2 4.24Å; D464-I468 PolarHBondContact O-N 3.15Å; D464-I468 VanDerWaalsContact O-N 3.1Å; S465-I468 WeakPolarHBondContact O-CG1 3.4Å; S465-I468 PolarHBondContact O-N 3.47Å; F466-I468 VanDerWaalsContact C-N 3.3Å; F466-I468 PolarHBondContact O-N 2.91Å
469	I	94.4	Very high	91.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-103.4	-13.6	175.3	71.3	161	0	0	0	114.9	V403 L407 V434 V436 S465 F466 S471 L472 W482 L486 L489	V403-I469 HydrophobicContact CG1-CD1 3.95Å; L407-I469 HydrophobicContact CD1-CD1 4.14Å; V434-I469 HydrophobicContact CB-CG2 4.19Å; V434-I469 HydrophobicContact CG1-CG2 3.59Å; V436-I469 HydrophobicContact CG1-CD1 3.92Å; V436-I469 HydrophobicContact CG1-CG2 4.15Å; S465-I469 WeakPolarHBondContact O-CG1 3.49Å; S465-I469 PolarHBondContact O-N 3.07Å; F466-I469 PolarHBondContact O-N 2.9Å; I469-S471 PolarHBondContact O-N 2.84Å; I469-L472 HydrophobicContact CB-CD1 4.14Å; I469-L472 VanDerWaalsContact O-CB 3.26Å; I469-L472 WeakPolarHBondContact O-CB 3.27Å; I469-L472 WeakPolarHBondContact O-CG 3.46Å; I469-L472 PolarHBondContact O-N 3.36Å; I469-W482 HydrophobicContact CD1-CH2 4.02Å; I469-W482 HydrophobicContact CD1-CZ2 4.28Å; I469-W482 HydrophobicContact CG1-CH2 3.96Å; I469-W482 WeakPolarHBondContact O-CH2 3.43Å; I469-L486 HydrophobicContact CD1-CD1 4.38Å; I469-L489 HydrophobicContact CD1-CD2 4.28Å
470	K	92.4	Very high	91	Very high	100 Å²	100	59 Å²	59	44%	0.435	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-54.4	-29.8	-178	67.7	-172.5	175	-175.2	0	114.4	F466 A467 L472 N473	F466-K470 HydrophobicContact CE1-CB 4.47Å; F466-K470 WeakPolarHBondContact O-CB 3.4Å; F466-K470 PolarHBondContact O-N 3.21Å; A467-K470 VanDerWaalsContact O-CE 3.3Å; A467-K470 WeakPolarHBondContact O-CE 3.43Å; A467-K470 WeakPolarHBondContact O-CG 3.37Å; K470-L472 PolarHBondContact O-N 3.26Å; K470-N473 WeakPolarHBondContact O-CB 3.37Å; K470-N473 PolarHBondContact O-N 3.23Å
471	S	91.6	Very high	90.9	Very high	97 Å²	97	56.9 Å²	56.9	68%	0.678	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-68.7	-10.4	177.1	50.2	0	0	0	0	114.4	I469 N473	I469-S471 PolarHBondContact O-N 2.84Å; S471-N473 VanDerWaalsContact C-N 3.3Å
472	L	90.4	Very high	90.7	Very high	23 Å²	23	56.9 Å²	56.9	12%	0.12	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-80.5	-10.3	172.5	-62.8	177.1	0	0	0	113.7	V436 Q438 F447 I469 K470 T474 W482	V436-L472 HydrophobicContact CG2-CD1 3.48Å; V436-L472 VanDerWaalsContact CG2-CD1 3.48Å; Q438-L472 PolarHBondContact NE2-O 3.29Å; F447-L472 HydrophobicContact CD1-CD1 3.53Å; F447-L472 HydrophobicContact CD1-CD2 3.95Å; F447-L472 HydrophobicContact CD1-CG 4.21Å; F447-L472 HydrophobicContact CD2-CD2 4Å; F447-L472 HydrophobicContact CE1-CD1 3.65Å; F447-L472 HydrophobicContact CE1-CD2 3.68Å; F447-L472 HydrophobicContact CE1-CG 3.92Å; F447-L472 HydrophobicContact CE2-CD2 3.77Å; F447-L472 HydrophobicContact CG-CD1 4.19Å; F447-L472 HydrophobicContact CG-CD2 4.07Å; F447-L472 HydrophobicContact CZ-CD1 4.43Å; F447-L472 HydrophobicContact CZ-CD2 3.59Å; F447-L472 HydrophobicContact CZ-CG 4.25Å; I469-L472 HydrophobicContact CB-CD1 4.14Å; I469-L472 VanDerWaalsContact O-CB 3.26Å; I469-L472 WeakPolarHBondContact O-CB 3.27Å; I469-L472 WeakPolarHBondContact O-CG 3.46Å; I469-L472 PolarHBondContact O-N 3.36Å; K470-L472 PolarHBondContact O-N 3.26Å; L472-T474 PolarHBondContact O-N 2.94Å; L472-W482 HydrophobicContact CB-CZ2 4.24Å
473	N	92.8	Very high	90.5	Very high	11 Å²	11	59 Å²	59	6%	0.059	35%	0.349	C	S	.	.			trans	-88.6	104	-176.4	-174.9	-0.5	0	0	0	111.2	K400 K470 S471 A475 G476 A481 W482 T483	K400-N473 WeakPolarHBondContact CE-ND2 3.24Å; K470-N473 WeakPolarHBondContact O-CB 3.37Å; K470-N473 PolarHBondContact O-N 3.23Å; S471-N473 VanDerWaalsContact C-N 3.3Å; N473-A475 PolarHBondContact O-N 2.65Å; N473-A475 VanDerWaalsContact OD1-CB 3.3Å; N473-A475 WeakPolarHBondContact OD1-CB 3.44Å; N473-A475 PolarHBondContact OD1-N 2.93Å; N473-G476 PolarHBondContact O-N 2.97Å; N473-A481 PolarHBondContact ND2-O 3.17Å; N473-W482 HydrophobicContact CB-CD2 3.93Å; N473-W482 HydrophobicContact CB-CE3 4.01Å; N473-W482 HydrophobicContact CB-CH2 4.24Å; N473-W482 HydrophobicContact CB-CZ2 4.17Å; N473-W482 HydrophobicContact CB-CZ3 4.16Å; N473-W482 WeakPolarHBondContact OD1-CA 3.44Å; N473-T483 CarbonylContact C-O 3.53Å; N473-T483 WeakPolarHBondContact CA-O 3.23Å; N473-T483 PolarHBondContact OD1-N 3.05Å; N473-T483 PolarHBondContact OD1-O 3.19Å
474	T	91.8	Very high	90.3	Very high	110 Å²	110	57.3 Å²	57.3	68%	0.675	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-9.2	-179.7	63.3	0	0	0	0	113.9	L472 G476 T483	L472-T474 PolarHBondContact O-N 2.94Å; T474-G476 PolarHBondContact O-N 3.16Å; T474-T483 PolarHBondContact N-O 2.65Å; T474-T483 PolarHBondContact OG1-O 2.69Å; T474-T483 VanDerWaalsContact OG1-O 3.1Å
475	A	86.3	Confident	90.2	Very high	14 Å²	14	57.1 Å²	57.1	12%	0.116	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.7	170.3	0	0	0	0	0	113.2	N473 Q479 A481	N473-A475 PolarHBondContact O-N 2.65Å; N473-A475 VanDerWaalsContact OD1-CB 3.3Å; N473-A475 WeakPolarHBondContact OD1-CB 3.44Å; N473-A475 PolarHBondContact OD1-N 2.93Å; A475-Q479 HydrophobicContact CB-CB 4.46Å; A475-Q479 WeakPolarHBondContact O-CB 3.41Å; A475-Q479 VanDerWaalsContact O-CG 3.25Å; A475-Q479 WeakPolarHBondContact O-CG 3.33Å; A475-Q479 PolarHBondContact O-OE1 3.43Å; A475-A481 HydrophobicContact CB-CB 4.02Å
476	G	76.5	Confident	90.1	Very high	31 Å²	31	57.1 Å²	57.1	32%	0.32	34%	0.337	S	S	.	.			trans	82.6	163.7	175.5	0	0	0	0	0	114.4	K400 N473 T474 Q478	K400-G476 PolarHBondContact NZ-O 3.07Å; N473-G476 PolarHBondContact O-N 2.97Å; T474-G476 PolarHBondContact O-N 3.16Å; G476-Q478 VanDerWaalsContact C-N 3.34Å; G476-Q478 PolarHBondContact O-N 2.64Å
477	N	73.3	Confident	90.1	Very high	127 Å²	127	56 Å²	56	68%	0.679	33%	0.333	S	S	*	.	S	Bend	trans	-71.1	-22.5	-165.1	-74.5	-32	0	0	0	114.9	K400	K400-N477 PolarHBondContact NZ-O 2.96Å
478	Q	74.9	Confident	90	Very high	199 Å²	199	54.8 Å²	54.8	93%	0.93	32%	0.32	S	S	*	.	S	Bend	trans	-94.4	-24.5	-178	-69.8	174	-17.5	0	0	114.8	G476	G476-Q478 VanDerWaalsContact C-N 3.34Å; G476-Q478 PolarHBondContact O-N 2.64Å
479	Q	82.4	Confident	90.1	Very high	120 Å²	120	52.8 Å²	52.8	56%	0.561	31%	0.31	S	S	*	.	S	Bend	trans	-74	146.9	-178.4	-60.1	-172	10.1	0	0	112.2	K400 A475 A481	K400-Q479 WeakPolarHBondContact CD-O 3.45Å; K400-Q479 WeakPolarHBondContact CE-O 3.42Å; K400-Q479 PolarHBondContact NZ-O 2.84Å; A475-Q479 HydrophobicContact CB-CB 4.46Å; A475-Q479 WeakPolarHBondContact O-CB 3.41Å; A475-Q479 VanDerWaalsContact O-CG 3.25Å; A475-Q479 WeakPolarHBondContact O-CG 3.33Å; A475-Q479 PolarHBondContact O-OE1 3.43Å; Q479-A481 PolarHBondContact O-N 2.78Å
480	A	90.9	Very high	90.2	Very high	80 Å²	80	55.6 Å²	55.6	66%	0.661	32%	0.323	S	S	*	.	S	Bend	trans	-69.3	-22.1	177.4	0	0	0	0	0	113.8	T399 K400	T399-A480 WeakPolarHBondContact CA-O 3.39Å; K400-A480 PolarHBondContact N-O 2.84Å
481	A	94.6	Very high	90.5	Very high	35 Å²	35	50.9 Å²	50.9	29%	0.289	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	159.1	-178	0	0	0	0	0	113.7	A398 N473 A475 Q479	A398-A481 CarbonylContact O-C 3.6Å; N473-A481 PolarHBondContact ND2-O 3.17Å; A475-A481 HydrophobicContact CB-CB 4.02Å; Q479-A481 PolarHBondContact O-N 2.78Å
482	W	95.1	Very high	90.8	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	111.6	168	-170.2	-70.8	0	0	0	110.6	A398 K400 V403 F466 I469 L472 N473 L486	A398-W482 PolarHBondContact O-N 3.08Å; K400-W482 HydrophobicContact CG-CE3 4.07Å; V403-W482 HydrophobicContact CB-CE3 4.23Å; V403-W482 HydrophobicContact CB-CZ3 4.5Å; V403-W482 HydrophobicContact CG1-CE3 4.33Å; V403-W482 HydrophobicContact CG1-CH2 4.37Å; V403-W482 HydrophobicContact CG1-CZ3 4.15Å; V403-W482 HydrophobicContact CG2-CB 4.47Å; V403-W482 HydrophobicContact CG2-CD2 3.89Å; V403-W482 HydrophobicContact CG2-CE3 3.99Å; V403-W482 HydrophobicContact CG2-CG 4.07Å; F466-W482 HydrophobicContact CD2-CZ3 4.34Å; F466-W482 HydrophobicContact CE2-CE3 4.39Å; F466-W482 AromaticContact CE2-CZ3 3.69Å; F466-W482 HydrophobicContact CE2-CZ3 3.69Å; F466-W482 HydrophobicContact CZ-CZ3 4.36Å; I469-W482 HydrophobicContact CD1-CH2 4.02Å; I469-W482 HydrophobicContact CD1-CZ2 4.28Å; I469-W482 HydrophobicContact CG1-CH2 3.96Å; I469-W482 WeakPolarHBondContact O-CH2 3.43Å; L472-W482 HydrophobicContact CB-CZ2 4.24Å; N473-W482 HydrophobicContact CB-CD2 3.93Å; N473-W482 HydrophobicContact CB-CE3 4.01Å; N473-W482 HydrophobicContact CB-CH2 4.24Å; N473-W482 HydrophobicContact CB-CZ2 4.17Å; N473-W482 HydrophobicContact CB-CZ3 4.16Å; N473-W482 WeakPolarHBondContact OD1-CA 3.44Å; W482-L486 HydrophobicContact CZ2-CD1 4.08Å
483	T	93.3	Very high	91.1	Very high	60 Å²	60	45.8 Å²	45.8	37%	0.368	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.9	-175.6	-56.4	0	0	0	0	110.6	N473 T474	N473-T483 CarbonylContact C-O 3.53Å; N473-T483 WeakPolarHBondContact CA-O 3.23Å; N473-T483 PolarHBondContact OD1-N 3.05Å; N473-T483 PolarHBondContact OD1-O 3.19Å; T474-T483 PolarHBondContact N-O 2.65Å; T474-T483 PolarHBondContact OG1-O 2.69Å; T474-T483 VanDerWaalsContact OG1-O 3.1Å
484	P	93.3	Very high	91.4	Very high	37 Å²	37	46.3 Å²	46.3	24%	0.24	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-63.9	150.6	-20.1	29.4	-35.6	0	0	0	111.3	Q438	Q438-P484 HydrophobicContact CB-CG 3.9Å; Q438-P484 HydrophobicContact CG-CG 3.84Å
485	P	95.4	Very high	91.6	Very high	30 Å²	30	48.1 Å²	48.1	20%	0.195	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	149	-177.8	-28.1	36.2	0	0	0	114.1	L397 A398 L439	L397-P485 CarbonylContact O-C 3.57Å; L397-P485 WeakPolarHBondContact O-CA 3.41Å; L397-P485 WeakPolarHBondContact O-CB 3.41Å; A398-P485 HydrophobicContact CB-CB 4.28Å; A398-P485 HydrophobicContact CB-CG 4.1Å; L439-P485 HydrophobicContact CB-CB 4.49Å; L439-P485 WeakPolarHBondContact CB-O 3.35Å; L439-P485 HydrophobicContact CD2-CG 4.46Å; L439-P485 PolarHBondContact N-O 2.87Å
486	L	95.1	Very high	92.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.6	-179.8	-56.1	-173.7	0	0	0	112.2	S396 L397 V403 V436 R437 Q438 I469 W482 L489	S396-L486 CarbonylContact C-O 3.53Å; S396-L486 VanDerWaalsContact CA-O 3.26Å; S396-L486 WeakPolarHBondContact CA-O 3.49Å; S396-L486 WeakPolarHBondContact CB-O 3.38Å; L397-L486 HydrophobicContact CB-CB 4.27Å; L397-L486 PolarHBondContact N-O 3.39Å; L397-L486 PolarHBondContact O-N 2.93Å; V403-L486 HydrophobicContact CG1-CD1 4.14Å; V403-L486 HydrophobicContact CG2-CD1 3.88Å; V403-L486 HydrophobicContact CG2-CG 4.43Å; V436-L486 HydrophobicContact CB-CD2 4.44Å; V436-L486 HydrophobicContact CG1-CD1 4.39Å; V436-L486 HydrophobicContact CG2-CD2 4.47Å; R437-L486 CarbonylContact O-C 3.55Å; R437-L486 WeakPolarHBondContact O-CA 3.14Å; Q438-L486 HydrophobicContact CG-CD2 3.72Å; I469-L486 HydrophobicContact CD1-CD1 4.38Å; W482-L486 HydrophobicContact CZ2-CD1 4.08Å; L486-L489 HydrophobicContact CD1-CD2 3.65Å
487	T	95.9	Very high	93	Very high	14 Å²	14	50.6 Å²	50.6	9%	0.086	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-2.5	177.7	67.5	0	0	0	0	113.6	F391 R437 L439	F391-T487 PolarHBondContact N-O 2.97Å; F391-T487 WeakPolarHBondContact O-CA 3.37Å; R437-T487 WeakPolarHBondContact CG-OG1 3.34Å; R437-T487 PolarHBondContact NE-OG1 2.89Å; R437-T487 PolarHBondContact NH2-O 3.11Å; R437-T487 PolarHBondContact O-N 3.49Å; R437-T487 PolarHBondContact O-OG1 3.11Å; L439-T487 HydrophobicContact CB-CG2 4.05Å; L439-T487 HydrophobicContact CD1-CG2 3.84Å
488	L	95.9	Very high	94	Very high	19 Å²	19	51 Å²	51	10%	0.099	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	142.6	169.4	171.2	153.3	0	0	0	110.1	K389 V436 R437 H490	K389-L488 WeakPolarHBondContact O-CA 3.5Å; V436-L488 WeakPolarHBondContact CA-O 3.26Å; R437-L488 HydrophobicContact CB-CB 3.69Å; R437-L488 PolarHBondContact N-O 3.35Å; R437-L488 PolarHBondContact O-N 2.97Å; L488-H490 HydrophobicContact CD2-CB 3.87Å
489	L	96.8	Very high	94.5	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.6	157.5	-67.7	176.9	0	0	0	109.5	S388 K389 F391 L397 W406 L407 L410 V436 I469 L486	S388-L489 CarbonylContact C-O 3.33Å; S388-L489 VanDerWaalsContact CA-O 3.25Å; S388-L489 WeakPolarHBondContact CA-O 3.3Å; S388-L489 WeakPolarHBondContact CB-O 3.2Å; K389-L489 PolarHBondContact N-O 3.48Å; K389-L489 PolarHBondContact O-N 3.22Å; F391-L489 HydrophobicContact CE2-CB 4.08Å; F391-L489 HydrophobicContact CE2-CD1 4.19Å; F391-L489 HydrophobicContact CE2-CG 4Å; L397-L489 HydrophobicContact CD1-CD1 3.65Å; L397-L489 HydrophobicContact CD1-CG 4.18Å; W406-L489 HydrophobicContact CB-CD1 3.69Å; L407-L489 HydrophobicContact CD2-CD1 4.23Å; L407-L489 HydrophobicContact CD2-CD2 4.28Å; L407-L489 HydrophobicContact CG-CD1 4.16Å; L410-L489 HydrophobicContact CD1-CB 3.57Å; V436-L489 HydrophobicContact CG1-CD2 3.78Å; I469-L489 HydrophobicContact CD1-CD2 4.28Å; L486-L489 HydrophobicContact CD1-CD2 3.65Å
490	H	95.9	Very high	94.1	Very high	60 Å²	60	41.1 Å²	41.1	28%	0.278	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	131.5	177.9	164.2	-115.6	0	0	0	109.9	C387 V434 G435 L488	C387-H490 WeakPolarHBondContact O-CA 3.43Å; C387-H490 PolarHBondContact O-CD2 3.32Å; V434-H490 CarbonylContact C-O 3.49Å; V434-H490 WeakPolarHBondContact CA-O 3.27Å; G435-H490 PolarHBondContact N-O 2.7Å; G435-H490 PolarHBondContact O-N 2.91Å; L488-H490 HydrophobicContact CD2-CB 3.87Å
491	L	97.8	Very high	92.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.5	169.3	-54.5	-178.3	0	0	0	108.7	G386 C387 L407 L410 A411 L414 L432 T433 V434 I461 S465	G386-L491 CarbonylContact C-O 3.59Å; G386-L491 WeakPolarHBondContact CA-O 3.27Å; C387-L491 PolarHBondContact N-O 2.89Å; C387-L491 PolarHBondContact O-N 2.66Å; L407-L491 HydrophobicContact CD2-CD2 3.97Å; L410-L491 HydrophobicContact CB-CD1 3.68Å; L410-L491 HydrophobicContact CB-CG 4.02Å; A411-L491 HydrophobicContact CB-CD1 4.17Å; L414-L491 HydrophobicContact CD2-CB 3.73Å; L414-L491 HydrophobicContact CD2-CD1 4.32Å; L432-L491 HydrophobicContact CD1-CB 4.34Å; T433-L491 CarbonylContact O-C 3.51Å; T433-L491 WeakPolarHBondContact O-CA 3.47Å; V434-L491 HydrophobicContact CB-CD2 4.34Å; V434-L491 HydrophobicContact CG1-CD2 4.03Å; V434-L491 HydrophobicContact CG2-CD2 3.8Å; I461-L491 HydrophobicContact CG2-CD1 4.1Å; S465-L491 WeakPolarHBondContact OG-CD2 3.39Å
492	S	97.6	Very high	90.9	Very high	14 Å²	14	47.6 Å²	47.6	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	116.2	178.6	-172.7	0	0	0	0	111.4	T433	T433-S492 PolarHBondContact N-O 2.79Å; T433-S492 PolarHBondContact O-N 2.86Å
493	A	98.4	Very high	88.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.9	171.2	0	0	0	0	0	110.3	S384 I385 L414 L418 A429 L431 L453	S384-A493 CarbonylContact C-O 3.55Å; S384-A493 WeakPolarHBondContact CA-O 3.44Å; S384-A493 WeakPolarHBondContact CB-O 3.09Å; I385-A493 PolarHBondContact N-O 2.95Å; I385-A493 PolarHBondContact O-N 2.89Å; L414-A493 HydrophobicContact CD1-CB 4.06Å; L418-A493 HydrophobicContact CD1-CB 3.74Å; L418-A493 HydrophobicContact CD2-CB 3.76Å; L418-A493 HydrophobicContact CG-CB 4.21Å; A429-A493 HydrophobicContact CB-CB 3.82Å; L431-A493 CarbonylContact O-C 3.58Å; L431-A493 WeakPolarHBondContact O-CA 3.49Å; L453-A493 HydrophobicContact CD2-CB 3.63Å
494	S	97.8	Very high	86.8	Confident	22 Å²	22	49.9 Å²	49.9	15%	0.154	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	-176.3	-172.2	62	0	0	0	0	111	K430 L431	K430-S494 PolarHBondContact N-O 3.21Å; K430-S494 VanDerWaalsContact N-O 3.11Å; L431-S494 PolarHBondContact N-O 3.07Å; L431-S494 PolarHBondContact O-N 2.92Å; L431-S494 PolarHBondContact O-OG 3.25Å
495	K	96.8	Very high	85.1	Confident	148 Å²	148	54.7 Å²	54.7	64%	0.643	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.1	65.5	-169.7	-63.3	-169.2	176.5	-177.7	0	110.7	K430 L431	K430-K495 WeakPolarHBondContact CB-O 3.43Å; K430-K495 PolarHBondContact N-O 3.45Å; L431-K495 HydrophobicContact CB-CB 4.03Å; L431-K495 HydrophobicContact CB-CD 4.08Å; L431-K495 HydrophobicContact CB-CG 4.03Å; L431-K495 HydrophobicContact CD2-CD 4.07Å; L431-K495 HydrophobicContact CD2-CG 4.23Å
496	F	97.1	Very high	82.8	Confident	47 Å²	47	56.4 Å²	56.4	21%	0.206	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	135.4	172.1	-70.5	-92.8	0	0	0	110.3	I385 L418 D421 R427 V428 A429	I385-F496 HydrophobicContact CB-CZ 4.4Å; I385-F496 HydrophobicContact CD1-CE1 4.47Å; I385-F496 HydrophobicContact CD1-CZ 3.91Å; I385-F496 HydrophobicContact CG1-CZ 3.93Å; L418-F496 HydrophobicContact CD2-CE1 4.27Å; L418-F496 HydrophobicContact CD2-CZ 4.24Å; D421-F496 WeakPolarHBondContact OD2-CE1 3.38Å; R427-F496 HydrophobicContact CB-CD1 4.28Å; R427-F496 HydrophobicContact CG-CD1 3.75Å; R427-F496 HydrophobicContact CG-CE1 4.29Å; V428-F496 WeakPolarHBondContact O-CA 3.35Å; A429-F496 HydrophobicContact CB-CD1 3.93Å; A429-F496 HydrophobicContact CB-CD2 4.36Å; A429-F496 HydrophobicContact CB-CE1 3.69Å; A429-F496 HydrophobicContact CB-CE2 4.14Å; A429-F496 HydrophobicContact CB-CG 4.26Å; A429-F496 HydrophobicContact CB-CZ 3.8Å
497	S	95	Very high	80.6	Confident	50 Å²	50	56.8 Å²	56.8	35%	0.35	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	172.5	157.1	72.5	0	0	0	0	108.7	R427 V428 K430	R427-S497 CarbonylContact C-O 3.48Å; R427-S497 WeakPolarHBondContact CA-O 3.39Å; R427-S497 WeakPolarHBondContact CB-O 3.48Å; V428-S497 PolarHBondContact N-O 3.04Å; V428-S497 PolarHBondContact O-N 2.92Å; K430-S497 WeakPolarHBondContact CE-OG 3.21Å
498	D	93.4	Very high	78.4	Confident	136 Å²	136	64.2 Å²	64.2	73%	0.727	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	153.5	165.2	-47.8	-57.2	0	0	0	110.6
499	A	85.3	Confident	76.5	Confident	31 Å²	31	69.8 Å²	69.8	26%	0.256	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-74.2	141.4	172.6	0	0	0	0	0	110.2	G426 V428 T501	G426-A499 VanDerWaalsContact O-CB 3.23Å; G426-A499 WeakPolarHBondContact O-CB 3.29Å; G426-A499 PolarHBondContact O-N 2.86Å; V428-A499 HydrophobicContact CG1-CB 4.34Å; A499-T501 PolarHBondContact O-N 3.05Å
500	P	75.6	Confident	74.2	Confident	80 Å²	80	73.8 Å²	73.8	52%	0.519	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-61.1	127.7	174.4	26.8	-33.6	0	0	0	109.5	T502	P500-T502 PolarHBondContact O-N 3.2Å
501	T	62.5	Low	71.5	Confident	114 Å²	114	75.1 Å²	75.1	70%	0.699	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-64.7	125.7	-177.1	43.8	0	0	0	0	110.9	A499 G503 G504	A499-T501 PolarHBondContact O-N 3.05Å; T501-G503 PolarHBondContact O-N 2.87Å; T501-G503 VanDerWaalsContact O-N 3.11Å; T501-G504 PolarHBondContact O-N 2.96Å
502	T	56.2	Low	68.7	Low	136 Å²	136	79.2 Å²	79.2	83%	0.834	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.4	-176.5	41.3	0	0	0	0	114.2	P500	P500-T502 PolarHBondContact O-N 3.2Å
503	G	51	Low	65.9	Low	82 Å²	82	84.3 Å²	84.3	85%	0.845	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.6	172.9	0	0	0	0	0	115.5	T501	T501-G503 PolarHBondContact O-N 2.87Å; T501-G503 VanDerWaalsContact O-N 3.11Å
504	G	49.2	Very low	62.9	Low	27 Å²	27	90.5 Å²	90.5	28%	0.278	55%	0.55	S	S	.	*	S	Bend	trans	-92.2	153.4	177.7	0	0	0	0	0	113.4	T501 A506 G507 F508	T501-G504 PolarHBondContact O-N 2.96Å; G504-A506 PolarHBondContact O-N 3.12Å; G504-A506 VanDerWaalsContact O-N 3.16Å; G504-G507 WeakPolarHBondContact O-CA 3.43Å; G504-G507 PolarHBondContact O-N 3.27Å; G504-F508 PolarHBondContact O-N 3.36Å
505	I	57.8	Low	60.1	Low	139 Å²	139	94.6 Å²	94.6	71%	0.713	58%	0.579	S	S	*	*	H	α-helix	trans	-54.9	-34.8	173.6	-59.6	171.6	0	0	0	111.1	G507 F508 L509	I505-G507 VanDerWaalsContact C-N 3.31Å; I505-G507 PolarHBondContact O-N 3.05Å; I505-F508 WeakPolarHBondContact O-CB 3.42Å; I505-F508 PolarHBondContact O-N 3.23Å; I505-L509 HydrophobicContact CG2-CD1 4.09Å; I505-L509 HydrophobicContact CG2-CG 4.47Å; I505-L509 WeakPolarHBondContact O-CG 3.35Å; I505-L509 PolarHBondContact O-N 3.07Å
506	A	48.3	Very low	56.9	Low	66 Å²	66	94 Å²	94	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-63.6	-32.2	173.4	0	0	0	0	0	113.5	G504 S510	G504-A506 PolarHBondContact O-N 3.12Å; G504-A506 VanDerWaalsContact O-N 3.16Å; A506-S510 VanDerWaalsContact O-CB 3.25Å; A506-S510 WeakPolarHBondContact O-CB 3.09Å; A506-S510 PolarHBondContact O-N 2.88Å; A506-S510 VanDerWaalsContact O-N 3.13Å; A506-S510 PolarHBondContact O-OG 3.35Å
507	G	48.6	Very low	53.8	Low	8 Å²	8	101.5 Å²	101.5	8%	0.082	62%	0.624	C	S	.	*	H	α-helix	trans	-70.4	-43.2	173.3	0	0	0	0	0	112	G504 I505 L509 S510 S511	G504-G507 WeakPolarHBondContact O-CA 3.43Å; G504-G507 PolarHBondContact O-N 3.27Å; I505-G507 VanDerWaalsContact C-N 3.31Å; I505-G507 PolarHBondContact O-N 3.05Å; G507-L509 VanDerWaalsContact C-N 3.31Å; G507-L509 PolarHBondContact O-N 2.96Å; G507-S510 PolarHBondContact O-N 2.98Å; G507-S511 PolarHBondContact O-N 3.45Å; G507-S511 PolarHBondContact O-OG 3.41Å
508	F	50.1	Low	50.7	Low	170 Å²	170	105.1 Å²	105.1	75%	0.746	65%	0.649	S	S	*	*	H	α-helix	trans	-57.3	-43.3	173.3	-172.5	-95.8	0	0	0	111.7	G504 I505 S510	G504-F508 PolarHBondContact O-N 3.36Å; I505-F508 WeakPolarHBondContact O-CB 3.42Å; I505-F508 PolarHBondContact O-N 3.23Å; F508-S510 VanDerWaalsContact C-N 3.3Å; F508-S510 PolarHBondContact O-N 3.48Å
509	L	55.7	Low	47.6	Very low	136 Å²	136	103.5 Å²	103.5	71%	0.712	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-7.8	176.2	-65.1	173.5	0	0	0	115	I505 G507	I505-L509 HydrophobicContact CG2-CD1 4.09Å; I505-L509 HydrophobicContact CG2-CG 4.47Å; I505-L509 WeakPolarHBondContact O-CG 3.35Å; I505-L509 PolarHBondContact O-N 3.07Å; G507-L509 VanDerWaalsContact C-N 3.31Å; G507-L509 PolarHBondContact O-N 2.96Å
510	S	47.3	Very low	44.9	Very low	83 Å²	83	112.1 Å²	112.1	58%	0.58	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	4.1	-179.9	-59.3	0	0	0	0	113.4	A506 G507 F508	A506-S510 VanDerWaalsContact O-CB 3.25Å; A506-S510 WeakPolarHBondContact O-CB 3.09Å; A506-S510 PolarHBondContact O-N 2.88Å; A506-S510 VanDerWaalsContact O-N 3.13Å; A506-S510 PolarHBondContact O-OG 3.35Å; G507-S510 PolarHBondContact O-N 2.98Å; F508-S510 VanDerWaalsContact C-N 3.3Å; F508-S510 PolarHBondContact O-N 3.48Å
511	S	39.8	Very low	42.5	Very low	88 Å²	88	114.4 Å²	114.4	62%	0.615	70%	0.698	S	S	*	*			trans	-81.9	120.6	-179.5	-61.4	0	0	0	0	110.8	G507	G507-S511 PolarHBondContact O-N 3.45Å; G507-S511 PolarHBondContact O-OG 3.41Å
512	D	39.7	Very low	41	Very low	86 Å²	86	113.3 Å²	113.3	46%	0.46	70%	0.701	S	S	.	*			trans	-67.9	143	172	-85.5	-52.5	0	0	0	111	R455 T514	R455-D512 IonicContact CZ-OD1 3.59Å; R455-D512 IonicContact CZ-OD2 2.78Å; R455-D512 VanDerWaalsContact CZ-OD2 3.26Å; R455-D512 IonicContact NH1-OD1 2.69Å; R455-D512 PolarHBondContact NH1-OD1 3.4Å; R455-D512 IonicContact NH1-OD2 3.14Å; R455-D512 PolarHBondContact NH1-OD2 2.9Å; R455-D512 IonicContact NH2-OD1 2.65Å; R455-D512 PolarHBondContact NH2-OD1 2.91Å; R455-D512 IonicContact NH2-OD2 2.64Å; R455-D512 PolarHBondContact NH2-OD2 2.96Å; D512-T514 PolarHBondContact O-N 3.33Å
513	P	39.3	Very low	39.6	Very low	121 Å²	121	112.3 Å²	112.3	79%	0.786	70%	0.695	S	S	*	*	S	Bend	trans	-78	16.8	-163.6	32.4	-38.4	0	0	0	115.7	S515	P513-S515 PolarHBondContact O-N 2.92Å
514	T	35.7	Very low	38.7	Very low	130 Å²	130	116.5 Å²	116.5	80%	0.798	69%	0.692	S	S	*	*			trans	-96.7	25	-159.4	-24.2	0	0	0	0	115	D512	D512-T514 PolarHBondContact O-N 3.33Å
515	S	37.6	Very low	37.4	Very low	109 Å²	109	121.2 Å²	121.2	76%	0.762	72%	0.716	S	S	*	*			trans	-153.4	63.7	179.8	-173.3	0	0	0	0	115.7	P513	P513-S515 PolarHBondContact O-N 2.92Å
516	T	29.9	Very low	36.8	Very low	136 Å²	136	120.1 Å²	120.1	83%	0.834	72%	0.718	S	S	*	*			trans	-145.7	68.6	165.7	-29.1	0	0	0	0	113.8
517	Q	32.7	Very low	35.7	Very low	204 Å²	204	122.2 Å²	122.2	95%	0.953	73%	0.728	S	S	*	*			trans	-139.3	90.6	159.3	-75.4	-160.9	1.1	0	0	112.3
518	S	28.3	Very low	34.7	Very low	126 Å²	126	128.9 Å²	128.9	88%	0.881	76%	0.762	S	S	*	*			trans	-140.8	103.3	149.1	51.8	0	0	0	0	108.3
519	S	29.5	Very low	33.6	Very low	102 Å²	102	125 Å²	125	71%	0.713	75%	0.753	S	S	*	*			trans	-99.5	116.5	-178.1	54	0	0	0	0	110.6
520	F	27.7	Very low	32.4	Very low	211 Å²	211	127 Å²	127	93%	0.925	76%	0.758	S	S	*	*			trans	-163.1	127.8	145.7	-87.6	-58.3	0	0	0	110.7
521	S	26.7	Very low	31.5	Very low	129 Å²	129	127.4 Å²	127.4	90%	0.902	76%	0.761	S	S	*	*			trans	-161.6	144.1	158.8	-80.2	0	0	0	0	107.7
522	A	30	Very low	31	Very low	90 Å²	90	130.1 Å²	130.1	74%	0.744	77%	0.768	S	S	*	*			trans	-130.4	147	-168.2	0	0	0	0	0	112.2
523	T	28	Very low	30.5	Very low	116 Å²	116	132.3 Å²	132.3	71%	0.712	78%	0.78	S	S	*	*			trans	65.7	96.2	147.4	-48.8	0	0	0	0	119.4
524	Q	30.9	Very low	29.9	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.794	79%	0.785	S	S	*	*			trans	64.9	116.4	132.8	-56.9	179.3	48.4	0	0	122.1
525	T	21.8	Very low	29.5	Very low	126 Å²	126	137 Å²	137	77%	0.773	78%	0.783	S	S	*	*				-8	166.3	123.7	47.4	0	0	0	0	120.1
526	P	44.9	Very low	29	Very low	116 Å²	116	138.6 Å²	138.6	75%	0.753	79%	0.788	S	S	*	*			cis	-140.9	-170.9	13.2	34	-11	0	0	0	117.3
527	S	25.5	Very low	29	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	78%	0.784	S	S	*	*			trans	119.3	118.5	153.1	69.9	0	0	0	0	115.5
528	N	28.1	Very low	29.7	Very low	147 Å²	147	134 Å²	134	79%	0.786	78%	0.781	S	S	*	*				79.8	136.9	68.5	-107.1	24.4	0	0	0	112.8
529	T	26.9	Very low	29.5	Very low	90 Å²	90	131.3 Å²	131.3	55%	0.552	77%	0.773	S	S	*	*			cis	-163.2	158.5	6.8	-17.4	0	0	0	0	111.6
530	Q	30.6	Very low	29.5	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	78%	0.783	S	S	*	*			trans	60.4	161.6	146.7	-78.5	160.6	-7.6	0	0	120.3
531	S	28.9	Very low	30	Very low	91 Å²	91	133.4 Å²	133.4	64%	0.636	78%	0.78	S	S	*	*			cis	-167.2	136.2	-21.2	51.4	0	0	0	0	114
532	D	28.8	Very low	30.9	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	77%	0.772	S	S	*	*			trans	60.7	131.6	132.8	-72.7	-54.7	0	0	0	127.1
533	L	29	Very low	30.8	Very low	133 Å²	133	131.8 Å²	131.8	70%	0.696	77%	0.772	S	S	*	*			trans	75.8	115.3	136.3	-69.5	167.7	0	0	0	123
534	K	26.7	Very low	31.2	Very low	208 Å²	208	132.1 Å²	132.1	90%	0.904	77%	0.774	S	S	*	*				-165	159	97.4	-104.1	168.2	-176.1	172.8	0	114.2
535	N	27.2	Very low	31.5	Very low	140 Å²	140	132.2 Å²	132.2	75%	0.749	78%	0.779	S	S	*	*			trans	-100.6	151.6	-169.1	-56.8	-32.7	0	0	0	114.2
536	V	27.4	Very low	32.1	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	79%	0.786	S	S	*	*			trans	-147.2	143.5	132.3	-176.8	0	0	0	0	109.5
537	S	30.2	Very low	31.7	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	78%	0.781	S	S	*	*			trans	-154.9	159.4	169.4	-48.7	0	0	0	0	107.6
538	P	45.8	Very low	32	Very low	135 Å²	135	138 Å²	138	88%	0.877	78%	0.782	S	S	*	*				-148.7	178.9	62.4	40.6	-20.6	0	0	0	116.4
539	G	24.9	Very low	32.4	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	79%	0.787	S	S	*	*			trans	165.4	81.7	165.1	0	0	0	0	0	119
540	N	30.2	Very low	32.6	Very low	171 Å²	171	145.2 Å²	145.2	91%	0.914	80%	0.802	S	S	*	*			trans	66	169.3	162.9	-66.2	-11.8	0	0	0	119.5
541	Q	38.2	Very low	32.5	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	81%	0.806	S	S	*	*			trans	-132.3	165.8	-148.4	-83.8	-84.1	-39.9	0	0	114
542	P	44.7	Very low	32.6	Very low	114 Å²	114	147.5 Å²	147.5	74%	0.74	82%	0.818	S	S	*	*			trans	-106	177	-155.7	41.4	-37.2	0	0	0	116.1
543	G	28.7	Very low	32.6	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	82%	0.823	S	S	*	*			trans	-119.8	104.5	173	0	0	0	0	0	114.4
544	T	36.6	Very low	32.6	Very low	122 Å²	122	143.9 Å²	143.9	75%	0.748	83%	0.827	S	S	*	*			trans	38.3	105.6	142.2	-46.5	0	0	0	0	120.5
545	I	36	Very low	32.8	Very low	173 Å²	173	142.9 Å²	142.9	89%	0.887	82%	0.822	S	S	*	*				-151.7	80.2	129.9	-96.4	148.2	0	0	0	107.7
546	Q	34.6	Very low	32.9	Very low	197 Å²	197	144.6 Å²	144.6	92%	0.921	83%	0.826	S	S	*	*			trans	-157.1	63	173	-148.8	176.7	32.1	0	0	112.2
547	S	36.5	Very low	33	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	82%	0.823	S	S	*	*			trans	-146.6	-11	-178.2	58.4	0	0	0	0	116.5
548	F	32.6	Very low	32.9	Very low	182 Å²	182	150.4 Å²	150.4	80%	0.798	83%	0.829	S	S	*	*	S	Bend	trans	-94.1	-5.4	-158.7	-118.5	-87.6	0	0	0	117.8
549	F	35.2	Very low	32.1	Very low	203 Å²	203	148 Å²	148	89%	0.89	82%	0.82	S	S	*	*	S	Bend	trans	-135.4	47.4	-175.8	-79.7	-73.6	0	0	0	114.6
550	Q	31.9	Very low	32.2	Very low	186 Å²	186	154 Å²	154	87%	0.869	83%	0.826	S	S	*	*	S	Bend	trans	-153	54.7	168.2	-135.3	176.5	25.4	0	0	116.6
551	K	29.1	Very low	32	Very low	211 Å²	211	151.4 Å²	151.4	92%	0.917	81%	0.807	S	S	*	*			trans	-168.7	102.8	159.1	-114.9	166.8	-175.7	175.7	0	113.6
552	A	31.1	Very low	31.4	Very low	106 Å²	106	149.7 Å²	149.7	88%	0.876	80%	0.799	S	S	*	*			trans	-172.6	65.2	159.7	0	0	0	0	0	112.4
553	S	28.8	Very low	30.7	Very low	124 Å²	124	150.6 Å²	150.6	87%	0.867	79%	0.793	S	S	*	*			trans	-147.7	124.8	168.7	54.8	0	0	0	0	112.6
554	G	28.9	Very low	30.6	Very low	76 Å²	76	154.2 Å²	154.2	78%	0.784	80%	0.796	S	S	*	*			trans	85.2	148.9	-173.1	0	0	0	0	0	114
555	K	30.5	Very low	30.3	Very low	187 Å²	187	156.8 Å²	156.8	81%	0.813	80%	0.799	S	S	*	*			cis	-164	150.4	-3.1	-135.2	178	-175.2	175.5	0	110.5
556	Q	29.8	Very low	29.8	Very low	177 Å²	177	153.9 Å²	153.9	83%	0.827	79%	0.793	S	S	*	*			trans	64.2	172.5	163.4	-66.1	166.4	-47.7	0	0	117.8
557	K	28.3	Very low	29.4	Very low	186 Å²	186	148 Å²	148	81%	0.809	79%	0.785	S	S	*	*				-172.4	158.7	-59	-137.7	-178.1	-178.5	-175.5	0	108.4
558	Q	28.2	Very low	29	Very low	186 Å²	186	151.2 Å²	151.2	87%	0.869	80%	0.795	S	S	*	*			trans	71.7	150	167.6	-69.1	-177.4	-28.6	0	0	117.7
559	A	30	Very low	28.8	Very low	84 Å²	84	146.5 Å²	146.5	69%	0.694	79%	0.785	S	S	*	*			cis	-166.2	167.1	-16.4	0	0	0	0	0	113.2
560	K	26.2	Very low	28.5	Very low	197 Å²	197	148.4 Å²	148.4	86%	0.857	79%	0.786	S	S	*	*			trans	71.1	139.6	177.5	-74.2	-169.6	177.4	-174.3	0	115.7
561	K	26.6	Very low	28.3	Very low	118 Å²	118	148.1 Å²	148.1	51%	0.513	78%	0.784	S	S	.	*			cis	-134.5	-122.8	-19.9	-153.5	167.3	135.1	-83.6	0	107.7	E563	K561-E563 WeakPolarHBondContact CE-OE1 3.33Å; K561-E563 IonicContact NZ-OE1 2.65Å; K561-E563 PolarHBondContact NZ-OE1 3.44Å; K561-E563 IonicContact NZ-OE2 2.73Å; K561-E563 PolarHBondContact NZ-OE2 3.27Å
562	E	25.2	Very low	28.1	Very low	148 Å²	148	144.9 Å²	144.9	69%	0.692	78%	0.782	S	S	*	*			cis	-136.1	-156.3	-3.6	-146.4	79.6	-118	0	0	107.7
563	E	30.1	Very low	28	Very low	134 Å²	134	144.9 Å²	144.9	63%	0.626	78%	0.775	S	S	*	*			trans	-100.9	163.1	-175.6	-87.5	101.8	-130.7	0	0	112.6	K561	K561-E563 WeakPolarHBondContact CE-OE1 3.33Å; K561-E563 IonicContact NZ-OE1 2.65Å; K561-E563 PolarHBondContact NZ-OE1 3.44Å; K561-E563 IonicContact NZ-OE2 2.73Å; K561-E563 PolarHBondContact NZ-OE2 3.27Å
564	D	25.2	Very low	27.8	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	78%	0.775	S	S	*	*			cis	-148.9	-174.8	28.1	-119.9	-28.7	0	0	0	116
565	E	32.3	Very low	27.7	Very low	176 Å²	176	146.7 Å²	146.7	82%	0.822	78%	0.776	S	S	*	*			trans	-62.7	-178.4	-169.2	-47.2	-167.3	108.8	0	0	118.8
566	C	23.7	Very low	27.5	Very low	112 Å²	112	144.5 Å²	144.5	76%	0.757	78%	0.778	S	S	*	*			cis	-162.3	144.6	17.5	-165.5	0	0	0	0	115.9
567	G	27.2	Very low	27.4	Very low	73 Å²	73	143.5 Å²	143.5	75%	0.753	78%	0.777	S	S	*	*			trans	68.2	152.1	145.1	0	0	0	0	0	121.7
568	N	26.9	Very low	27.3	Very low	161 Å²	161	142.9 Å²	142.9	86%	0.861	78%	0.782	S	S	*	*			cis	-155.9	163.6	-15.1	-166.8	9.6	0	0	0	111.3
569	S	29.9	Very low	27.2	Very low	84 Å²	84	140 Å²	140	59%	0.587	77%	0.772	S	S	*	*			trans	-70.2	155.5	-169.4	61.2	0	0	0	0	119
570	R	27.8	Very low	26.9	Very low	242 Å²	242	145.1 Å²	145.1	91%	0.913	78%	0.781	S	S	*	*				-174.1	151.4	102.3	-100.5	175.3	-178.8	165.4	1.6	115.1
571	E	27.8	Very low	27	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	78%	0.776	S	S	*	*			trans	-100.1	171.7	174.5	-53.9	171.7	121.1	0	0	111.3
572	V	26.3	Very low	26.7	Very low	143 Å²	143	148 Å²	148	87%	0.867	80%	0.795	S	S	*	*				-172.7	140.8	118.2	144.7	0	0	0	0	110.1
573	S	27.1	Very low	26.7	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	79%	0.793	S	S	*	*			trans	-92.1	162.6	-179.6	-49.1	0	0	0	0	113
574	S	25.4	Very low	26.5	Very low	124 Å²	124	145.2 Å²	145.2	87%	0.867	80%	0.801	S	S	*	*				179.2	160.1	122.8	41	0	0	0	0	112.7
575	S	27.2	Very low	26.4	Very low	115 Å²	115	144 Å²	144	80%	0.804	79%	0.794	S	S	*	*			trans	-134.4	142.6	-178.7	51.3	0	0	0	0	110.2
576	V	25.4	Very low	26.1	Very low	141 Å²	141	145.6 Å²	145.6	86%	0.855	79%	0.793	S	S	*	*			trans	-142.6	138.5	166.2	-170.6	0	0	0	0	108.9
577	I	27.9	Very low	26.1	Very low	156 Å²	156	152.3 Å²	152.3	80%	0.8	80%	0.802	S	S	*	*			trans	-108	142.6	169.8	-64.8	169.2	0	0	0	107.2
578	L	26.3	Very low	26	Very low	173 Å²	173	154 Å²	154	91%	0.906	80%	0.802	S	S	*	*			trans	-152.9	158.9	146.7	-111.4	171.1	0	0	0	110.9
579	D	26	Very low	25.9	Very low	124 Å²	124	151.5 Å²	151.5	66%	0.663	80%	0.798	S	S	*	*			trans	-125.7	140.3	-169.8	175.4	29.9	0	0	0	108.6
580	E	24.9	Very low	25.6	Very low	192 Å²	192	153.1 Å²	153.1	90%	0.897	80%	0.804	S	S	*	*			trans	-158.9	150.6	157.9	-132	175	-165.1	0	0	113.1
581	K	26.8	Very low	25.5	Very low	169 Å²	169	150.3 Å²	150.3	74%	0.735	80%	0.798	S	S	*	*			trans	-114.5	147.2	-176.7	-59.8	166.7	-175.6	164.9	0	110.1
582	F	22.1	Very low	25.3	Very low	208 Å²	208	148.7 Å²	148.7	91%	0.912	79%	0.794	S	S	*	*			trans	-143.7	167.2	145.4	-122.8	-88.2	0	0	0	111.3
583	S	24.1	Very low	25.2	Very low	94 Å²	94	148.9 Å²	148.9	66%	0.657	79%	0.789	S	S	*	*			trans	-139.8	-173	-171.3	-64.2	0	0	0	0	111.4
584	T	25.4	Very low	25.1	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	79%	0.792	S	S	*	*			trans	82.5	143.2	175.6	79.3	0	0	0	0	115.2
585	D	24	Very low	24.9	Very low	123 Å²	123	152.7 Å²	152.7	66%	0.658	79%	0.794	S	S	*	*			cis	-152.1	166.3	-12.3	-140.2	-9	0	0	0	115.4
586	R	25.2	Very low	24.9	Very low	209 Å²	209	152.8 Å²	152.8	79%	0.789	80%	0.795	S	S	*	*			trans	2.3	137.8	157.5	-67.1	149.6	-158.4	-118.6	-3.3	121
587	R	24.8	Very low	25.3	Very low	254 Å²	254	151.9 Å²	151.9	96%	0.958	79%	0.792	S	S	*	*				-156.6	165.1	96.4	-108.6	179.6	-177	-163.7	0.4	112.6
588	S	24.4	Very low	25.2	Very low	107 Å²	107	156.4 Å²	156.4	75%	0.748	80%	0.799	S	S	*	*			trans	-152.3	146.4	-167	178.4	0	0	0	0	112.6
589	S	25.4	Very low	25.4	Very low	110 Å²	110	154 Å²	154	77%	0.769	80%	0.796	S	S	*	*			trans	-155.8	104.6	161.8	-67.5	0	0	0	0	108.4
590	T	24	Very low	25.3	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.724	80%	0.801	S	S	*	*				44.9	133.3	82.5	48.9	0	0	0	0	116.2
591	K	25.1	Very low	25.5	Very low	182 Å²	182	150.8 Å²	150.8	79%	0.791	80%	0.801	S	S	*	*			cis	-167.5	-171.6	-0	-145	177	-179.2	-178.4	0	110.9
592	I	23.6	Very low	25.5	Very low	147 Å²	147	148 Å²	148	75%	0.754	80%	0.802	S	S	*	*			trans	79.7	107.2	169.1	-48.2	-176.5	0	0	0	113.4
593	I	24.3	Very low	25.8	Very low	147 Å²	147	143.4 Å²	143.4	75%	0.754	80%	0.796	S	S	*	*				89.3	109.9	53.6	-64.3	160.8	0	0	0	113.8
594	S	23.9	Very low	26	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	81%	0.806	S	S	*	*			trans	-169.3	132.7	134	57	0	0	0	0	111.2
595	E	22.6	Very low	26.2	Very low	194 Å²	194	152.1 Å²	152.1	91%	0.907	81%	0.812	S	S	*	*			trans	-129	152.3	172.7	-73.2	-170.7	123.2	0	0	110.3
596	S	27.6	Very low	26.3	Very low	118 Å²	118	155.8 Å²	155.8	83%	0.825	83%	0.825	S	S	*	*			trans	157	172	149.3	58.8	0	0	0	0	109.7
597	P	32.4	Very low	26.3	Very low	122 Å²	122	155.5 Å²	155.5	79%	0.792	83%	0.83	S	S	*	*				-123.6	163.5	-80.5	34.7	-19.4	0	0	0	113.3
598	R	26.1	Very low	26.3	Very low	251 Å²	251	153 Å²	153	95%	0.947	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-95	118	167.9	-73.3	-177.7	174.5	179.5	-1.5	110.4
599	S	30.3	Very low	26.3	Very low	121 Å²	121	153.3 Å²	153.3	85%	0.846	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-79.2	123.5	163.5	46.6	0	0	0	0	110.1
600	G	24.7	Very low	26.4	Very low	74 Å²	74	155.7 Å²	155.7	76%	0.763	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-90.5	148.5	169.8	0	0	0	0	0	111.2
601	I	28.8	Very low	26.4	Very low	176 Å²	176	159 Å²	159	90%	0.903	84%	0.839	S	S	*	*			trans	-117.6	128.9	165.5	-59.1	177.3	0	0	0	106.9
602	S	26.7	Very low	26.4	Very low	109 Å²	109	153.8 Å²	153.8	76%	0.762	84%	0.836	S	S	*	*			trans	-115.9	145.6	-172.4	54.6	0	0	0	0	112.4
603	S	28.3	Very low	26.4	Very low	112 Å²	112	152.7 Å²	152.7	78%	0.783	84%	0.842	S	S	*	*			trans	52.9	106.6	157.2	-162	0	0	0	0	118.5
604	F	27.8	Very low	26.3	Very low	199 Å²	199	156.1 Å²	156.1	87%	0.873	85%	0.851	S	S	*	*			trans	-142.7	101.8	150.6	-135.6	-90.1	0	0	0	109.3
605	F	30.1	Very low	26.3	Very low	207 Å²	207	154.2 Å²	154.2	91%	0.908	85%	0.849	S	S	*	*			trans	175.5	102.2	151.2	-92.5	-56	0	0	0	109.2
606	Q	26.6	Very low	26.7	Very low	199 Å²	199	151.1 Å²	151.1	93%	0.93	85%	0.846	S	S	*	*			trans	-117.4	128	165.9	-156.2	174.5	23.5	0	0	109.2
607	K	25	Very low	26.5	Very low	204 Å²	204	151 Å²	151	89%	0.887	85%	0.845	S	S	*	*			trans	-85.1	123.6	-166.1	-169	176.6	-175.2	176.6	0	110.7
608	K	24.5	Very low	26.1	Very low	202 Å²	202	149.2 Å²	149.2	88%	0.878	84%	0.841	S	S	*	*			trans	-121.9	124.7	162.2	-89	-171.5	173.5	-178.9	0	110.2
609	S	24.5	Very low	26	Very low	112 Å²	112	145.3 Å²	145.3	78%	0.783	84%	0.838	S	S	*	*			trans	-103.8	140.2	167.7	-167.1	0	0	0	0	107.4
610	L	27.5	Very low	25.8	Very low	160 Å²	160	145.2 Å²	145.2	84%	0.838	84%	0.835	S	S	*	*			trans	-150.1	115.6	174.1	-103.9	167.7	0	0	0	110.1
611	E	23.4	Very low	25.8	Very low	189 Å²	189	148.6 Å²	148.6	88%	0.883	83%	0.834	S	S	*	*			trans	-82.6	152.2	154.1	-65.9	172.4	124.3	0	0	107.9
612	G	25.1	Very low	25.6	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	83%	0.826	S	S	*	*			trans	-102.1	163.8	-169.1	0	0	0	0	0	115.4
613	S	23.7	Very low	25.3	Very low	125 Å²	125	146 Å²	146	87%	0.874	82%	0.824	S	S	*	*			trans	-164.4	161.5	158.2	-83.6	0	0	0	0	110.9
614	F	22.9	Very low	25.2	Very low	219 Å²	219	144.7 Å²	144.7	96%	0.961	82%	0.815	S	S	*	*			trans	-96.9	112	-164.8	-74.7	-102.9	0	0	0	114.9
615	G	23.3	Very low	25	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	81%	0.812	S	S	*	*			trans	47.4	-166.5	150.6	0	0	0	0	0	120.4
616	P	31.8	Very low	24.7	Very low	129 Å²	129	139 Å²	139	84%	0.838	81%	0.806	S	S	*	*			cis	-119.3	-170.7	-25.3	40.9	-28.4	0	0	0	112.3
617	S	22.2	Very low	24.6	Very low	115 Å²	115	138 Å²	138	80%	0.804	80%	0.801	S	S	*	*			trans	100.3	141.7	154.8	-151.8	0	0	0	0	120.7
618	A	23.9	Very low	25.6	Very low	86 Å²	86	132.8 Å²	132.8	71%	0.711	79%	0.789	S	S	*	*			trans	45	120.8	152.3	0	0	0	0	0	122.6
619	L	24.8	Very low	25.6	Very low	169 Å²	169	132 Å²	132	89%	0.885	79%	0.788	S	S	*	*			trans	-74	151.9	148.6	-68.1	167.2	0	0	0	110.9
620	P	25.9	Very low	25.7	Very low	119 Å²	119	133.3 Å²	133.3	77%	0.773	79%	0.785	S	S	*	*			trans	-117.5	165.7	141.1	-2.8	23.9	0	0	0	113.3
621	I	25.6	Very low	25.7	Very low	144 Å²	144	132.7 Å²	132.7	74%	0.738	78%	0.781	S	S	*	*			trans	-102.6	149.3	-173.3	-61	156.7	0	0	0	110.4	T623	I621-T623 HydrophobicContact CG2-CG2 3.89Å
622	P	24	Very low	25.9	Very low	115 Å²	115	131 Å²	131	75%	0.747	78%	0.778	S	S	*	*				-131.4	139.1	124.8	35.3	-25.1	0	0	0	110.6
623	T	21.3	Very low	25.9	Very low	115 Å²	115	131.1 Å²	131.1	71%	0.706	78%	0.779	S	S	*	*			cis	56	127	37.7	62.2	0	0	0	0	114.6	I621	I621-T623 HydrophobicContact CG2-CG2 3.89Å
624	S	25.2	Very low	26.1	Very low	86 Å²	86	131.8 Å²	131.8	60%	0.601	77%	0.773	S	S	*	*			cis	-167.1	-176.2	4.6	34.7	0	0	0	0	110.5
625	E	23.9	Very low	26.3	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	76%	0.761	S	S	*	*			trans	71	146.2	163.4	-71.5	134.7	-103.6	0	0	118.2
626	S	23.9	Very low	26.5	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	76%	0.761	S	S	*	*			cis	-158.4	159.6	-6.9	50.5	0	0	0	0	112.3
627	E	24.4	Very low	26.4	Very low	178 Å²	178	134 Å²	134	83%	0.832	77%	0.766	S	S	*	*			trans	-85.9	-162.6	166.8	-40.6	-177.7	127.9	0	0	111.1
628	P	46.6	Very low	26.6	Very low	95 Å²	95	136 Å²	136	62%	0.617	77%	0.767	S	S	*	*			cis	-135.5	-179.1	-16.5	36.5	-16.7	0	0	0	115.1
629	E	23.8	Very low	27.9	Very low	186 Å²	186	136.1 Å²	136.1	87%	0.869	76%	0.761	S	S	*	*			trans	168.2	105.4	148.2	-97.9	171.7	-166.9	0	0	107.2
630	I	26.7	Very low	28	Very low	139 Å²	139	135.1 Å²	135.1	71%	0.713	76%	0.757	S	S	*	*				65.6	111.2	62.4	-46.1	173.1	0	0	0	114.2
631	I	27.9	Very low	28.2	Very low	146 Å²	146	133.4 Å²	133.4	75%	0.749	75%	0.753	S	S	*	*				169.5	132.5	127.5	-86.7	170.5	0	0	0	111
632	D	26.7	Very low	28.3	Very low	155 Å²	155	133 Å²	133	83%	0.829	76%	0.756	S	S	*	*			trans	5	149.8	158	-43.1	-30.2	0	0	0	122.3
633	G	26.3	Very low	28.5	Very low	73 Å²	73	131.2 Å²	131.2	75%	0.753	75%	0.751	S	S	*	*			cis	158	-170.6	-5	0	0	0	0	0	115.5
634	D	26.3	Very low	28.8	Very low	139 Å²	139	133.3 Å²	133.3	74%	0.743	75%	0.753	S	S	*	*			trans	91.8	143.8	156.7	-138.1	10.4	0	0	0	123
635	H	28.7	Very low	28.8	Very low	153 Å²	153	137.6 Å²	137.6	71%	0.708	76%	0.763	S	S	*	*			trans	28.3	128	174.5	-66.5	-29	0	0	0	122.6
636	C	26.9	Very low	28.7	Very low	113 Å²	113	137.1 Å²	137.1	76%	0.764	76%	0.761	S	S	*	*			cis	99.5	112.2	34.5	-74.6	0	0	0	0	114.1
637	E	29.4	Very low	29	Very low	202 Å²	202	136.9 Å²	136.9	94%	0.944	76%	0.757	S	S	*	*				-169.8	159.3	120.9	-104.5	175.9	-172.4	0	0	111.2
638	D	27	Very low	28.9	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	76%	0.757	S	S	*	*			trans	-150.3	-172.5	-167.5	-148.5	20.5	0	0	0	106.1
639	P	50.3	Low	27.9	Very low	89 Å²	89	139.7 Å²	139.7	58%	0.578	77%	0.767	S	S	*	*			cis	-134	-176.1	-11.6	43.7	-26.8	0	0	0	114.4
640	D	27.2	Very low	28.6	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	76%	0.76	S	S	*	*				179.2	106.3	126.6	-96.2	-20.1	0	0	0	108.6
641	A	30.1	Very low	28.4	Very low	83 Å²	83	141.6 Å²	141.6	69%	0.686	77%	0.771	S	S	*	*				75.1	119.7	66.8	0	0	0	0	0	112.9
642	V	28.2	Very low	28.1	Very low	135 Å²	135	143.4 Å²	143.4	82%	0.818	77%	0.774	S	S	*	*			cis	-142.9	-157.4	-7.4	-146.1	0	0	0	0	106.1
643	A	28.4	Very low	27.9	Very low	78 Å²	78	144.5 Å²	144.5	65%	0.645	77%	0.771	S	S	*	*			cis	-170.9	165.9	0.2	0	0	0	0	0	107.3
644	E	26.8	Very low	27.7	Very low	159 Å²	159	147.2 Å²	147.2	74%	0.743	77%	0.769	S	S	*	*			cis	-167.9	-178.5	-16.3	-105.4	174.9	107.5	0	0	108.9
645	H	25.4	Very low	27.5	Very low	175 Å²	175	146.5 Å²	146.5	81%	0.81	77%	0.769	S	S	*	*			trans	71.2	98.9	161.4	-83.2	-63.3	0	0	0	122.7
646	E	21.2	Very low	27.2	Very low	165 Å²	165	150.2 Å²	150.2	77%	0.771	78%	0.777	S	S	*	*				-32.8	163.3	129.8	-82.8	-91.8	148.6	0	0	115.8
647	P	30.4	Very low	26.9	Very low	107 Å²	107	151 Å²	151	70%	0.695	78%	0.778	S	S	*	*			cis	-140.9	-177.5	20	37.8	-16.9	0	0	0	118.2
648	D	23.7	Very low	26.6	Very low	154 Å²	154	150.7 Å²	150.7	82%	0.824	77%	0.774	S	S	*	*				128	153.5	125.9	-145.9	4.2	0	0	0	117.8
649	Q	24.1	Very low	26.7	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	76%	0.764	S	S	*	*			trans	-107	169.8	-160.7	-99.6	-159	22.5	0	0	115
650	P	39.2	Very low	25.3	Very low	111 Å²	111	152.1 Å²	152.1	72%	0.721	78%	0.776	S	S	*	*			trans	-93.7	158.2	-154.4	35.9	-37.8	0	0	0	115.5
651	R	21.4	Very low	25.1	Very low	254 Å²	254	150.8 Å²	150.8	96%	0.958	77%	0.774	S	S	*	*			trans	-152.7	165.6	152.1	-119.8	169.2	-171.2	-171.6	2.3	115.6
652	F	21.9	Very low	25	Very low	185 Å²	185	154.6 Å²	154.6	81%	0.811	78%	0.777	S	S	*	*			trans	-90.4	159.1	-171.3	-98.4	-106.1	0	0	0	113.5
653	K	23.5	Very low	24.9	Very low	177 Å²	177	153.9 Å²	153.9	77%	0.77	78%	0.776	S	S	*	*			trans	74.9	149.6	157.1	-73.9	172.4	-175.4	-176.7	0	116.6
654	D	21.5	Very low	25.1	Very low	131 Å²	131	159.2 Å²	159.2	70%	0.701	79%	0.787	S	S	*	*			cis	-146.7	151.4	14	-111.2	-30.9	0	0	0	114.8
655	V	23.2	Very low	25.2	Very low	124 Å²	124	157.8 Å²	157.8	75%	0.752	79%	0.785	S	S	*	*			trans	41.4	108.9	137.2	177.6	0	0	0	0	121.8
656	R	21.5	Very low	25.4	Very low	231 Å²	231	161.1 Å²	161.1	87%	0.872	79%	0.79	S	S	*	*			trans	111.8	142.9	130.4	-152.5	177.6	-170.5	173.6	2.7	120.7
657	T	21.5	Very low	26	Very low	129 Å²	129	161.2 Å²	161.2	79%	0.791	79%	0.791	S	S	*	*			trans	102	131.1	153.2	-18.1	0	0	0	0	118
658	K	21.5	Very low	25.9	Very low	195 Å²	195	161.6 Å²	161.6	85%	0.848	79%	0.793	S	S	*	*			trans	-74.6	168.8	171	-93.5	-172.5	177.1	-167.8	0	110.8
659	P	29	Very low	26.5	Very low	98 Å²	98	159 Å²	159	64%	0.636	79%	0.785	S	S	*	*			cis	-143.7	-160.2	36.8	43.9	-23.6	0	0	0	116.7
660	E	21.3	Very low	27.1	Very low	177 Å²	177	154.8 Å²	154.8	83%	0.827	78%	0.775	S	S	*	*			trans	73.3	132.9	161.5	-77.7	164.6	-129.7	0	0	117.5
661	T	24.3	Very low	27.2	Very low	122 Å²	122	153.4 Å²	153.4	75%	0.748	76%	0.764	S	S	*	*			cis	-148.8	154.9	-5.9	-55.3	0	0	0	0	110.4
662	E	27.2	Very low	28.4	Very low	162 Å²	162	144.6 Å²	144.6	76%	0.757	74%	0.736	S	S	*	*			trans	-65.1	156.1	168.6	-68.1	-77.3	140.4	0	0	112.6
663	P	26.9	Very low	29.9	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	73%	0.73	S	S	*	*			trans	-116.5	112.2	140.4	33.1	-26.1	0	0	0	111.1	D665	P663-D665 PolarHBondContact O-N 3.25Å
664	E	30.9	Very low	31.3	Very low	189 Å²	189	139.9 Å²	139.9	88%	0.883	73%	0.726	S	S	*	*			trans	-67.8	117	164.9	-64.3	-176.8	120.7	0	0	110.1
665	D	28.9	Very low	33.5	Very low	130 Å²	130	134 Å²	134	70%	0.695	70%	0.695	S	S	*	*				-162.6	126.8	122.1	-162.1	-13.6	0	0	0	109.8	P663	P663-D665 PolarHBondContact O-N 3.25Å
666	R	30.5	Very low	35.9	Very low	245 Å²	245	130.5 Å²	130.5	93%	0.925	67%	0.672	S	S	*	*			trans	-145.1	93.9	168.3	-75.7	-163.5	178.3	-169.1	1.1	109.7
667	Q	33.3	Very low	38.8	Very low	166 Å²	166	123 Å²	123	78%	0.776	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-48.6	146	173.8	-66.3	177	-23.1	0	0	112.8
668	P	29.4	Very low	41.8	Very low	115 Å²	115	120.8 Å²	120.8	75%	0.747	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-66.3	154.3	176.2	29.7	-35.6	0	0	0	111.4	S670	P668-S670 PolarHBondContact O-N 3.4Å
669	P	36.4	Very low	44.8	Very low	100 Å²	100	111.6 Å²	111.6	65%	0.649	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-65.8	132.6	179.1	29	-35.6	0	0	0	111.1
670	S	36.3	Very low	47.4	Very low	88 Å²	88	116.4 Å²	116.4	62%	0.615	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.1	-176.4	58	0	0	0	0	113.4	P668 L672	P668-S670 PolarHBondContact O-N 3.4Å; S670-L672 PolarHBondContact O-N 3.49Å
671	V	40.8	Very low	50.3	Low	83 Å²	83	114.6 Å²	114.6	50%	0.503	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-56.6	122.9	130.9	176.5	0	0	0	0	105.2	V673 L676 L687	V671-V673 PolarHBondContact O-N 2.98Å; V671-L676 HydrophobicContact CG1-CD1 3.97Å; V671-L676 HydrophobicContact CG1-CD2 4.24Å; V671-L676 HydrophobicContact CG1-CG 3.9Å; V671-L687 HydrophobicContact CG1-CD2 3.79Å
672	L	47	Very low	53.3	Low	69 Å²	69	111.3 Å²	111.3	36%	0.361	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-58.6	129.3	178.2	-66.2	178	0	0	0	107.9	S670 E674 D675	S670-L672 PolarHBondContact O-N 3.49Å; L672-E674 HydrophobicContact CB-CB 4.41Å; L672-E674 PolarHBondContact O-N 2.8Å; L672-E674 VanDerWaalsContact O-N 3.09Å; L672-D675 HydrophobicContact CB-CB 4.49Å; L672-D675 WeakPolarHBondContact O-CB 3.4Å; L672-D675 PolarHBondContact O-N 3.4Å
673	V	53.9	Low	55.9	Low	115 Å²	115	106.2 Å²	106.2	70%	0.697	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-58.6	-25.7	177.3	-176.3	0	0	0	0	110.5	V671 D675 L676	V671-V673 PolarHBondContact O-N 2.98Å; V673-D675 VanDerWaalsContact C-N 3.27Å; V673-D675 PolarHBondContact O-N 2.85Å; V673-L676 PolarHBondContact O-N 3.2Å
674	E	51.9	Low	58.5	Low	147 Å²	147	107.1 Å²	107.1	69%	0.687	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-65	-19.4	172.1	-54.6	178.6	174.3	0	0	114.6	N90 L672	N90-E674 VanDerWaalsContact ND2-C 3.25Å; N90-E674 PolarHBondContact ND2-O 3.01Å; L672-E674 HydrophobicContact CB-CB 4.41Å; L672-E674 PolarHBondContact O-N 2.8Å; L672-E674 VanDerWaalsContact O-N 3.09Å
675	D	66.8	Low	60.9	Low	9 Å²	9	104.1 Å²	104.1	5%	0.048	55%	0.545	C	S	.	.	G	3₁₀ helix	trans	-94.6	-2.2	-179.9	-68.1	2.1	0	0	0	112.4	N90 R277 L672 V673 L687 V688 W689	N90-D675 PolarHBondContact ND2-OD1 3.07Å; R277-D675 IonicContact CZ-OD2 2.8Å; R277-D675 IonicContact NH1-OD1 2.84Å; R277-D675 IonicContact NH1-OD2 3.81Å; R277-D675 PolarHBondContact NH1-OD2 3.44Å; R277-D675 IonicContact NH2-OD2 3.72Å; R277-D675 PolarHBondContact NH2-OD2 3.44Å; L672-D675 HydrophobicContact CB-CB 4.49Å; L672-D675 WeakPolarHBondContact O-CB 3.4Å; L672-D675 PolarHBondContact O-N 3.4Å; V673-D675 VanDerWaalsContact C-N 3.27Å; V673-D675 PolarHBondContact O-N 2.85Å; D675-L687 HydrophobicContact CB-CD2 4.37Å; D675-V688 PolarHBondContact O-N 3.44Å; D675-W689 HydrophobicContact CB-CH2 4.1Å; D675-W689 HydrophobicContact CB-CZ3 4.39Å
676	L	75.6	Confident	63.4	Low	49 Å²	49	98.7 Å²	98.7	26%	0.257	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	146.8	-177	-71.2	166.4	0	0	0	112.3	V671 V673 E685 L687	V671-L676 HydrophobicContact CG1-CD1 3.97Å; V671-L676 HydrophobicContact CG1-CD2 4.24Å; V671-L676 HydrophobicContact CG1-CG 3.9Å; V673-L676 PolarHBondContact O-N 3.2Å; L676-E685 HydrophobicContact CD2-CB 4.38Å; L676-L687 HydrophobicContact CD2-CD2 3.84Å; L676-L687 HydrophobicContact CD2-CG 4.19Å; L676-L687 HydrophobicContact CG-CD2 4.42Å
677	I	81.3	Confident	65.5	Low	73 Å²	73	88.2 Å²	88.2	37%	0.374	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.1	172.6	-172.7	168.8	0	0	0	110.8	V686 V688 L691	I677-V686 WeakPolarHBondContact CG2-O 3.13Å; I677-V686 PolarHBondContact N-O 3.19Å; I677-V686 PolarHBondContact O-N 3.05Å; I677-V688 HydrophobicContact CB-CG2 4.15Å; I677-V688 HydrophobicContact CG2-CB 4.47Å; I677-V688 HydrophobicContact CG2-CG2 3.94Å; I677-L691 HydrophobicContact CD1-CD2 4.46Å; I677-L691 HydrophobicContact CG2-CD2 4.15Å
678	T	84.6	Confident	67.7	Low	83 Å²	83	81.8 Å²	81.8	51%	0.509	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.8	176.7	-41.4	0	0	0	0	110.6	E680 K684	T678-E680 PolarHBondContact O-N 2.86Å; T678-K684 WeakPolarHBondContact CA-O 3.32Å
679	C	83.6	Confident	69.7	Low	3 Å²	3	78.6 Å²	78.6	2%	0.02	42%	0.423	C	S	.	.			trans	-74.4	118.3	175.8	-179.6	0	0	0	0	111.3	R681 C682 G683 K684 V686 H694	C679-R681 PolarHBondContact O-N 2.71Å; C679-R681 VanDerWaalsContact O-N 3.08Å; C679-C682 PolarHBondContact O-N 3.26Å; C679-G683 PolarHBondContact O-N 3.34Å; C679-K684 PolarHBondContact N-O 3.38Å; C679-V686 HydrophobicContact CB-CG2 4.29Å; C679-H694 VanDerWaalsContact SG-CD2 3.51Å
680	E	83.6	Confident	71.6	Confident	199 Å²	199	75.5 Å²	75.5	93%	0.93	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.4	-179.7	-60	-177.2	162.9	0	0	114.2	T678	T678-E680 PolarHBondContact O-N 2.86Å
681	R	82.8	Confident	73.7	Confident	138 Å²	138	73.2 Å²	73.2	52%	0.521	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-26.7	-178.5	-73	178.1	165.3	-116.7	11.2	114.3	C679 D702	C679-R681 PolarHBondContact O-N 2.71Å; C679-R681 VanDerWaalsContact O-N 3.08Å; R681-D702 IonicContact CZ-OD2 3.72Å; R681-D702 IonicContact NH1-OD1 3.73Å; R681-D702 PolarHBondContact NH1-OD1 3.03Å; R681-D702 IonicContact NH1-OD2 3Å; R681-D702 PolarHBondContact NH1-OD2 2.64Å; R681-D702 IonicContact NH2-OD2 3.44Å; R681-D702 PolarHBondContact NH2-OD2 3.1Å
682	C	86.8	Confident	75.3	Confident	54 Å²	54	71 Å²	71	37%	0.365	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.6	-2.3	-168.9	70.3	0	0	0	0	115.7	C679 K684 H694	C679-C682 PolarHBondContact O-N 3.26Å; C682-K684 PolarHBondContact O-N 3.28Å; C682-K684 VanDerWaalsContact O-N 3.17Å; C682-H694 PolarHBondContact SG-NE2 3.37Å
683	G	82.1	Confident	76.5	Confident	54 Å²	54	73.3 Å²	73.3	56%	0.557	38%	0.377	S	S	*	.			trans	71.2	1.1	178.6	0	0	0	0	0	115.6	C679	C679-G683 PolarHBondContact O-N 3.34Å
684	K	81.3	Confident	78	Confident	140 Å²	140	69.5 Å²	69.5	61%	0.609	35%	0.352	S	S	*	.			trans	-73.8	141.3	175.5	-66.4	-174.4	176.1	-174.4	0	110.8	T678 C679 C682 V686	T678-K684 WeakPolarHBondContact CA-O 3.32Å; C679-K684 PolarHBondContact N-O 3.38Å; C682-K684 PolarHBondContact O-N 3.28Å; C682-K684 VanDerWaalsContact O-N 3.17Å; K684-V686 HydrophobicContact CB-CG2 4.47Å
685	E	81.4	Confident	79.2	Confident	127 Å²	127	65.6 Å²	65.6	59%	0.593	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.2	164.8	-61.3	-176.2	148.6	0	0	109.5	L676	L676-E685 HydrophobicContact CD2-CB 4.38Å
686	V	81.3	Confident	79.9	Confident	16 Å²	16	70.3 Å²	70.3	10%	0.097	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.4	-176.1	-173.9	0	0	0	0	108.2	I677 C679 K684 E690 H694	I677-V686 WeakPolarHBondContact CG2-O 3.13Å; I677-V686 PolarHBondContact N-O 3.19Å; I677-V686 PolarHBondContact O-N 3.05Å; C679-V686 HydrophobicContact CB-CG2 4.29Å; K684-V686 HydrophobicContact CB-CG2 4.47Å; V686-E690 HydrophobicContact CG1-CB 4.15Å; V686-H694 HydrophobicContact CG1-CB 4.06Å
687	L	75.5	Confident	80.4	Confident	25 Å²	25	73.8 Å²	73.8	13%	0.131	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	136.6	173.3	-68.6	169.9	0	0	0	110.1	V671 D675 L676 W689 E690 L691	V671-L687 HydrophobicContact CG1-CD2 3.79Å; D675-L687 HydrophobicContact CB-CD2 4.37Å; L676-L687 HydrophobicContact CD2-CD2 3.84Å; L676-L687 HydrophobicContact CD2-CG 4.19Å; L676-L687 HydrophobicContact CG-CD2 4.42Å; L687-W689 HydrophobicContact CB-CD2 4.38Å; L687-W689 HydrophobicContact CB-CZ2 4.08Å; L687-W689 HydrophobicContact CD1-CZ2 3.91Å; L687-W689 HydrophobicContact CD2-CH2 4.14Å; L687-W689 HydrophobicContact CD2-CZ2 3.87Å; L687-W689 HydrophobicContact CG-CZ2 4.18Å; L687-W689 PolarHBondContact O-N 2.95Å; L687-E690 HydrophobicContact CB-CB 4.43Å; L687-E690 HydrophobicContact CB-CG 4.02Å; L687-E690 PolarHBondContact O-N 2.92Å; L687-L691 PolarHBondContact O-N 2.72Å
688	V	79	Confident	80.7	Confident	30 Å²	30	71.1 Å²	71.1	18%	0.182	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-33	-170.7	179.7	0	0	0	0	113.2	E112 D675 I677	E112-V688 HydrophobicContact CB-CG1 3.82Å; E112-V688 HydrophobicContact CG-CB 4.25Å; E112-V688 HydrophobicContact CG-CG1 3.62Å; D675-V688 PolarHBondContact O-N 3.44Å; I677-V688 HydrophobicContact CB-CG2 4.15Å; I677-V688 HydrophobicContact CG2-CB 4.47Å; I677-V688 HydrophobicContact CG2-CG2 3.94Å
689	W	71.1	Confident	80.4	Confident	48 Å²	48	72.8 Å²	72.8	18%	0.182	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-9	178.5	52.2	81.9	0	0	0	114.9	P298 D675 L687	P298-W689 HydrophobicContact CG-CD2 3.95Å; P298-W689 HydrophobicContact CG-CG 4.05Å; P298-W689 HydrophobicContact CG-CZ2 4.4Å; D675-W689 HydrophobicContact CB-CH2 4.1Å; D675-W689 HydrophobicContact CB-CZ3 4.39Å; L687-W689 HydrophobicContact CB-CD2 4.38Å; L687-W689 HydrophobicContact CB-CZ2 4.08Å; L687-W689 HydrophobicContact CD1-CZ2 3.91Å; L687-W689 HydrophobicContact CD2-CH2 4.14Å; L687-W689 HydrophobicContact CD2-CZ2 3.87Å; L687-W689 HydrophobicContact CG-CZ2 4.18Å; L687-W689 PolarHBondContact O-N 2.95Å
690	E	76.9	Confident	80.2	Confident	35 Å²	35	75.2 Å²	75.2	16%	0.164	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-7.8	178.7	-49.3	-163	140.5	0	0	111.9	K226 V686 L687 P692 E693 H694	K226-E690 WeakPolarHBondContact CD-OE1 3.43Å; K226-E690 VanDerWaalsContact CE-OE1 3.31Å; K226-E690 WeakPolarHBondContact CE-OE1 3.26Å; K226-E690 IonicContact NZ-OE1 2.79Å; K226-E690 PolarHBondContact NZ-OE1 3.05Å; V686-E690 HydrophobicContact CG1-CB 4.15Å; L687-E690 HydrophobicContact CB-CB 4.43Å; L687-E690 HydrophobicContact CB-CG 4.02Å; L687-E690 PolarHBondContact O-N 2.92Å; E690-P692 VanDerWaalsContact C-N 3.28Å; E690-E693 PolarHBondContact O-N 3.29Å; E690-E693 VanDerWaalsContact O-N 3.11Å; E690-H694 WeakPolarHBondContact O-CB 3.3Å; E690-H694 PolarHBondContact O-N 2.88Å
691	L	80.9	Confident	80	Confident	40 Å²	40	69.2 Å²	69.2	21%	0.209	36%	0.355	C	S	.	.	H	α-helix	trans	-51.4	-33.5	171.3	-171.3	62.5	0	0	0	114.5	I677 L687 N695	I677-L691 HydrophobicContact CD1-CD2 4.46Å; I677-L691 HydrophobicContact CG2-CD2 4.15Å; L687-L691 PolarHBondContact O-N 2.72Å; L691-N695 WeakPolarHBondContact O-CB 3.39Å; L691-N695 PolarHBondContact O-N 3.18Å; L691-N695 PolarHBondContact O-ND2 3.09Å; L691-N695 VanDerWaalsContact O-ND2 3.1Å
692	P	74.1	Confident	80.1	Confident	37 Å²	37	66.3 Å²	66.3	24%	0.24	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-52.2	171.1	-20.8	33.2	0	0	0	112.7	A115 E690 H694 N695 D696	A115-P692 VanDerWaalsContact CA-CG 3.5Å; A115-P692 HydrophobicContact CB-CG 3.44Å; A115-P692 VanDerWaalsContact CB-CG 3.44Å; E690-P692 VanDerWaalsContact C-N 3.28Å; P692-H694 PolarHBondContact O-N 3.47Å; P692-N695 PolarHBondContact O-N 3.13Å; P692-D696 PolarHBondContact O-N 3.32Å
693	E	72.9	Confident	79.6	Confident	118 Å²	118	67.7 Å²	67.7	55%	0.551	35%	0.353	S	S	*	.	H	α-helix	trans	-59.5	-36.5	179	-60.1	178.6	166.5	0	0	110.4	K226 E690 F697	K226-E693 IonicContact NZ-OE1 3.43Å; K226-E693 IonicContact NZ-OE2 2.75Å; K226-E693 PolarHBondContact NZ-OE2 3.42Å; E690-E693 PolarHBondContact O-N 3.29Å; E690-E693 VanDerWaalsContact O-N 3.11Å; E693-F697 PolarHBondContact O-N 3.27Å
694	H	84.6	Confident	79.5	Confident	34 Å²	34	70.9 Å²	70.9	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-70.4	-36.7	175.1	-166.4	88.3	0	0	0	113.7	C679 C682 V686 E690 P692 F697 H698	C679-H694 VanDerWaalsContact SG-CD2 3.51Å; C682-H694 PolarHBondContact SG-NE2 3.37Å; V686-H694 HydrophobicContact CG1-CB 4.06Å; E690-H694 WeakPolarHBondContact O-CB 3.3Å; E690-H694 PolarHBondContact O-N 2.88Å; P692-H694 PolarHBondContact O-N 3.47Å; H694-F697 WeakPolarHBondContact O-CB 3.36Å; H694-F697 PolarHBondContact O-N 2.89Å; H694-H698 AromaticContact CD2-CD2 3.57Å; H694-H698 AromaticContact CD2-NE2 3.22Å; H694-H698 PolarHBondContact CD2-NE2 2.98Å; H694-H698 AromaticContact CE1-NE2 3.95Å; H694-H698 AromaticContact NE2-CD2 3.8Å; H694-H698 AromaticContact NE2-CE1 3.85Å; H694-H698 AromaticContact NE2-NE2 2.94Å; H694-H698 PolarHBondContact NE2-NE2 3.32Å; H694-H698 PolarHBondContact O-CD2 3.5Å; H694-H698 PolarHBondContact O-N 3.4Å; H694-H698 VanDerWaalsContact O-N 3.14Å
695	N	77.7	Confident	79.4	Confident	65 Å²	65	68.2 Å²	68.2	35%	0.348	35%	0.349	S	S	.	.	H	α-helix	trans	-72.7	-35.2	174	-77.3	-33.1	0	0	0	112	L691 P692 F697 H698 F699	L691-N695 WeakPolarHBondContact O-CB 3.39Å; L691-N695 PolarHBondContact O-N 3.18Å; L691-N695 PolarHBondContact O-ND2 3.09Å; L691-N695 VanDerWaalsContact O-ND2 3.1Å; P692-N695 PolarHBondContact O-N 3.13Å; N695-F697 VanDerWaalsContact C-N 3.34Å; N695-H698 PolarHBondContact O-N 3.44Å; N695-F699 PolarHBondContact O-N 2.89Å
696	D	80.9	Confident	79.2	Confident	109 Å²	109	65.2 Å²	65.2	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-66.2	-36.3	172.3	-73.5	-19.1	0	0	0	111.2	P692 F699 A700	P692-D696 PolarHBondContact O-N 3.32Å; D696-F699 PolarHBondContact O-N 2.97Å; D696-A700 WeakPolarHBondContact O-CB 3.47Å; D696-A700 PolarHBondContact O-N 3.32Å
697	F	85.6	Confident	78.9	Confident	121 Å²	121	69.7 Å²	69.7	53%	0.531	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-47.2	168.5	170.3	-89.8	0	0	0	111.9	E693 H694 N695 F699 A700 L701	E693-F697 PolarHBondContact O-N 3.27Å; H694-F697 WeakPolarHBondContact O-CB 3.36Å; H694-F697 PolarHBondContact O-N 2.89Å; N695-F697 VanDerWaalsContact C-N 3.34Å; F697-F699 VanDerWaalsContact C-N 3.32Å; F697-F699 PolarHBondContact O-N 2.95Å; F697-A700 PolarHBondContact O-N 2.84Å; F697-L701 HydrophobicContact CE1-CD2 4.26Å; F697-L701 WeakPolarHBondContact O-CB 3.41Å; F697-L701 PolarHBondContact O-N 2.59Å
698	H	87.4	Confident	78.7	Confident	17 Å²	17	71.2 Å²	71.2	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-62.5	-39	175.7	-72.4	-58.3	0	0	0	112.4	H694 N695 L701 D702	H694-H698 AromaticContact CD2-CD2 3.57Å; H694-H698 AromaticContact CD2-NE2 3.22Å; H694-H698 PolarHBondContact CD2-NE2 2.98Å; H694-H698 AromaticContact CE1-NE2 3.95Å; H694-H698 AromaticContact NE2-CD2 3.8Å; H694-H698 AromaticContact NE2-CE1 3.85Å; H694-H698 AromaticContact NE2-NE2 2.94Å; H694-H698 PolarHBondContact NE2-NE2 3.32Å; H694-H698 PolarHBondContact O-CD2 3.5Å; H694-H698 PolarHBondContact O-N 3.4Å; H694-H698 VanDerWaalsContact O-N 3.14Å; N695-H698 PolarHBondContact O-N 3.44Å; H698-L701 PolarHBondContact O-N 3.49Å; H698-D702 WeakPolarHBondContact O-CB 3.44Å; H698-D702 PolarHBondContact O-N 2.78Å
699	F	79.4	Confident	77.9	Confident	118 Å²	118	72.7 Å²	72.7	52%	0.518	39%	0.389	S	S	.	.	H	α-helix	trans	-66.7	-37.7	175.9	-179.5	-109.5	0	0	0	112.4	N695 D696 F697 D702 L703	N695-F699 PolarHBondContact O-N 2.89Å; D696-F699 PolarHBondContact O-N 2.97Å; F697-F699 VanDerWaalsContact C-N 3.32Å; F697-F699 PolarHBondContact O-N 2.95Å; F699-D702 PolarHBondContact O-N 3.18Å; F699-L703 HydrophobicContact CD1-CD1 3.97Å; F699-L703 HydrophobicContact CE1-CD1 3.54Å; F699-L703 HydrophobicContact CE1-CG 4.29Å; F699-L703 HydrophobicContact CE2-CG 4.49Å; F699-L703 HydrophobicContact CZ-CD1 3.88Å; F699-L703 HydrophobicContact CZ-CD2 4.48Å; F699-L703 HydrophobicContact CZ-CG 4.23Å; F699-L703 WeakPolarHBondContact O-CB 3.42Å; F699-L703 VanDerWaalsContact O-CG 3.32Å; F699-L703 WeakPolarHBondContact O-CG 3.45Å; F699-L703 PolarHBondContact O-N 3.12Å
700	A	78	Confident	77.3	Confident	54 Å²	54	73.7 Å²	73.7	45%	0.446	40%	0.403	S	S	.	.	H	α-helix	trans	-64.9	-39	172.3	0	0	0	0	0	111.9	D696 F697 L703 Q704	D696-A700 WeakPolarHBondContact O-CB 3.47Å; D696-A700 PolarHBondContact O-N 3.32Å; F697-A700 PolarHBondContact O-N 2.84Å; A700-L703 PolarHBondContact O-N 3.34Å; A700-Q704 WeakPolarHBondContact O-CB 3.38Å; A700-Q704 PolarHBondContact O-N 2.9Å
701	L	80	Confident	76.5	Confident	74 Å²	74	76.9 Å²	76.9	39%	0.387	42%	0.421	S	S	.	.	H	α-helix	trans	-69.5	-39.2	175.7	-170.4	65.6	0	0	0	112.3	F697 H698 Q704 T705	F697-L701 HydrophobicContact CE1-CD2 4.26Å; F697-L701 WeakPolarHBondContact O-CB 3.41Å; F697-L701 PolarHBondContact O-N 2.59Å; H698-L701 PolarHBondContact O-N 3.49Å; L701-Q704 PolarHBondContact O-N 2.94Å; L701-T705 WeakPolarHBondContact O-CB 3.2Å; L701-T705 PolarHBondContact O-N 2.93Å; L701-T705 PolarHBondContact O-OG1 2.73Å
702	D	84.3	Confident	75	Confident	76 Å²	76	80 Å²	80	41%	0.406	44%	0.437	S	S	.	.	H	α-helix	trans	-58.4	-47.6	170.7	-71.1	-22.7	0	0	0	110.1	R681 H698 F699 T705 S706	R681-D702 IonicContact CZ-OD2 3.72Å; R681-D702 IonicContact NH1-OD1 3.73Å; R681-D702 PolarHBondContact NH1-OD1 3.03Å; R681-D702 IonicContact NH1-OD2 3Å; R681-D702 PolarHBondContact NH1-OD2 2.64Å; R681-D702 IonicContact NH2-OD2 3.44Å; R681-D702 PolarHBondContact NH2-OD2 3.1Å; H698-D702 WeakPolarHBondContact O-CB 3.44Å; H698-D702 PolarHBondContact O-N 2.78Å; F699-D702 PolarHBondContact O-N 3.18Å; D702-T705 PolarHBondContact O-N 3.07Å; D702-S706 VanDerWaalsContact O-CB 3.28Å; D702-S706 WeakPolarHBondContact O-CB 3.28Å; D702-S706 PolarHBondContact O-N 3.16Å
703	L	77.7	Confident	73.8	Confident	84 Å²	84	81.9 Å²	81.9	44%	0.44	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-45.3	177.2	-76.4	174.3	0	0	0	112.2	F699 A700 T705 S706 L707	F699-L703 HydrophobicContact CD1-CD1 3.97Å; F699-L703 HydrophobicContact CE1-CD1 3.54Å; F699-L703 HydrophobicContact CE1-CG 4.29Å; F699-L703 HydrophobicContact CE2-CG 4.49Å; F699-L703 HydrophobicContact CZ-CD1 3.88Å; F699-L703 HydrophobicContact CZ-CD2 4.48Å; F699-L703 HydrophobicContact CZ-CG 4.23Å; F699-L703 WeakPolarHBondContact O-CB 3.42Å; F699-L703 VanDerWaalsContact O-CG 3.32Å; F699-L703 WeakPolarHBondContact O-CG 3.45Å; F699-L703 PolarHBondContact O-N 3.12Å; A700-L703 PolarHBondContact O-N 3.34Å; L703-T705 VanDerWaalsContact C-N 3.34Å; L703-T705 PolarHBondContact O-N 3.25Å; L703-S706 PolarHBondContact O-N 3.16Å; L703-L707 WeakPolarHBondContact O-CB 3.37Å; L703-L707 VanDerWaalsContact O-CG 3.3Å; L703-L707 WeakPolarHBondContact O-CG 3.17Å; L703-L707 PolarHBondContact O-N 3.15Å
704	Q	80.2	Confident	72.5	Confident	120 Å²	120	79.2 Å²	79.2	56%	0.561	45%	0.449	S	S	*	.	H	α-helix	trans	-60.2	-45.6	176.8	-172.1	179.6	19.1	0	0	110.8	A700 L701 S706 L707 S708	A700-Q704 WeakPolarHBondContact O-CB 3.38Å; A700-Q704 PolarHBondContact O-N 2.9Å; L701-Q704 PolarHBondContact O-N 2.94Å; Q704-S706 PolarHBondContact O-N 3.11Å; Q704-L707 PolarHBondContact O-N 3.33Å; Q704-S708 PolarHBondContact O-N 2.92Å; Q704-S708 PolarHBondContact O-OG 2.82Å; Q704-S708 VanDerWaalsContact O-OG 3.11Å
705	T	77.7	Confident	70.7	Confident	84 Å²	84	82.1 Å²	82.1	52%	0.515	47%	0.47	S	S	.	.	H	α-helix	trans	-65	-39	178.3	-54	0	0	0	0	111.7	L701 D702 L703 S708 S709	L701-T705 WeakPolarHBondContact O-CB 3.2Å; L701-T705 PolarHBondContact O-N 2.93Å; L701-T705 PolarHBondContact O-OG1 2.73Å; D702-T705 PolarHBondContact O-N 3.07Å; L703-T705 VanDerWaalsContact C-N 3.34Å; L703-T705 PolarHBondContact O-N 3.25Å; T705-S708 PolarHBondContact O-N 3.32Å; T705-S709 WeakPolarHBondContact O-CB 3.39Å; T705-S709 PolarHBondContact O-N 3.26Å; T705-S709 PolarHBondContact O-OG 2.93Å
706	S	78.3	Confident	68.8	Low	65 Å²	65	86.1 Å²	86.1	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-41.3	173.8	-174.4	0	0	0	0	112.4	D702 L703 Q704 S709 S710	D702-S706 VanDerWaalsContact O-CB 3.28Å; D702-S706 WeakPolarHBondContact O-CB 3.28Å; D702-S706 PolarHBondContact O-N 3.16Å; L703-S706 PolarHBondContact O-N 3.16Å; Q704-S706 PolarHBondContact O-N 3.11Å; S706-S709 WeakPolarHBondContact CA-OG 3.47Å; S706-S709 PolarHBondContact O-OG 3.23Å; S706-S709 VanDerWaalsContact O-OG 3.11Å; S706-S710 VanDerWaalsContact O-CB 3.32Å; S706-S710 WeakPolarHBondContact O-CB 3.35Å; S706-S710 PolarHBondContact O-N 3.12Å; S706-S710 PolarHBondContact O-OG 3.15Å
707	L	74.9	Confident	67	Low	109 Å²	109	86.7 Å²	86.7	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-66.7	-45.8	174.4	-73.1	164.4	0	0	0	111.6	L703 Q704 S709 S710 I711	L703-L707 WeakPolarHBondContact O-CB 3.37Å; L703-L707 VanDerWaalsContact O-CG 3.3Å; L703-L707 WeakPolarHBondContact O-CG 3.17Å; L703-L707 PolarHBondContact O-N 3.15Å; Q704-L707 PolarHBondContact O-N 3.33Å; L707-S709 PolarHBondContact O-N 3.34Å; L707-S710 WeakPolarHBondContact O-CB 3.46Å; L707-S710 PolarHBondContact O-N 2.92Å; L707-I711 VanDerWaalsContact O-CG1 3.28Å; L707-I711 WeakPolarHBondContact O-CG1 3.17Å; L707-I711 PolarHBondContact O-N 2.8Å
708	S	70.8	Confident	64.7	Low	57 Å²	57	85.5 Å²	85.5	40%	0.399	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-41.5	177.2	-63.5	0	0	0	0	112.7	Q704 T705 I711 N712	Q704-S708 PolarHBondContact O-N 2.92Å; Q704-S708 PolarHBondContact O-OG 2.82Å; Q704-S708 VanDerWaalsContact O-OG 3.11Å; T705-S708 PolarHBondContact O-N 3.32Å; S708-I711 PolarHBondContact O-N 2.85Å; S708-N712 WeakPolarHBondContact O-CB 3.3Å; S708-N712 VanDerWaalsContact O-CG 3.26Å; S708-N712 PolarHBondContact O-N 2.98Å; S708-N712 PolarHBondContact O-ND2 2.79Å
709	S	63.2	Low	62.2	Low	61 Å²	61	90.5 Å²	90.5	43%	0.427	54%	0.542	S	S	.	.	H	α-helix	trans	-70.2	-32.4	175.7	51.4	0	0	0	0	112.7	T705 S706 L707 S713	T705-S709 WeakPolarHBondContact O-CB 3.39Å; T705-S709 PolarHBondContact O-N 3.26Å; T705-S709 PolarHBondContact O-OG 2.93Å; S706-S709 WeakPolarHBondContact CA-OG 3.47Å; S706-S709 PolarHBondContact O-OG 3.23Å; S706-S709 VanDerWaalsContact O-OG 3.11Å; L707-S709 PolarHBondContact O-N 3.34Å; S709-S713 WeakPolarHBondContact O-CB 3.43Å; S709-S713 PolarHBondContact O-N 3.47Å; S709-S713 PolarHBondContact O-OG 3.25Å
710	S	58.4	Low	60	Low	69 Å²	69	89.8 Å²	89.8	48%	0.483	55%	0.552	S	S	.	*	H	α-helix	trans	-65.8	-42.6	170.7	-60.7	0	0	0	0	112.1	S706 L707 S713 A714	S706-S710 VanDerWaalsContact O-CB 3.32Å; S706-S710 WeakPolarHBondContact O-CB 3.35Å; S706-S710 PolarHBondContact O-N 3.12Å; S706-S710 PolarHBondContact O-OG 3.15Å; L707-S710 WeakPolarHBondContact O-CB 3.46Å; L707-S710 PolarHBondContact O-N 2.92Å; S710-S713 PolarHBondContact O-N 2.76Å; S710-A714 PolarHBondContact O-N 3.17Å
711	I	58.4	Low	57.8	Low	103 Å²	103	93 Å²	93	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-64.8	-47.3	176.5	-70	163.6	0	0	0	110.8	L707 S708 S713 A714 V715	L707-I711 VanDerWaalsContact O-CG1 3.28Å; L707-I711 WeakPolarHBondContact O-CG1 3.17Å; L707-I711 PolarHBondContact O-N 2.8Å; S708-I711 PolarHBondContact O-N 2.85Å; I711-S713 PolarHBondContact O-N 3.2Å; I711-A714 WeakPolarHBondContact O-CB 3.49Å; I711-A714 PolarHBondContact O-N 3.21Å; I711-V715 HydrophobicContact CG2-CG2 4.42Å; I711-V715 WeakPolarHBondContact O-CG2 3.25Å; I711-V715 PolarHBondContact O-N 2.68Å
712	N	49.9	Very low	55.5	Low	105 Å²	105	95.4 Å²	95.4	56%	0.561	58%	0.584	S	S	*	*	H	α-helix	trans	-62.5	-32.3	177.3	-70.7	-15.7	0	0	0	112.3	S708 N716	S708-N712 WeakPolarHBondContact O-CB 3.3Å; S708-N712 VanDerWaalsContact O-CG 3.26Å; S708-N712 PolarHBondContact O-N 2.98Å; S708-N712 PolarHBondContact O-ND2 2.79Å; N712-N716 PolarHBondContact O-N 3.24Å
713	S	50.2	Low	53	Low	76 Å²	76	97 Å²	97	53%	0.531	60%	0.601	S	S	.	*	H	α-helix	trans	-68.8	-37.2	172.8	-56.7	0	0	0	0	112.6	S709 S710 I711 T717	S709-S713 WeakPolarHBondContact O-CB 3.43Å; S709-S713 PolarHBondContact O-N 3.47Å; S709-S713 PolarHBondContact O-OG 3.25Å; S710-S713 PolarHBondContact O-N 2.76Å; I711-S713 PolarHBondContact O-N 3.2Å; S713-T717 PolarHBondContact O-OG1 3.1Å
714	A	45.7	Very low	50.8	Low	62 Å²	62	98.2 Å²	98.2	51%	0.512	62%	0.617	S	S	.	*	H	α-helix	trans	-69.1	-40	175.5	0	0	0	0	0	112.8	S710 I711 N716 T717	S710-A714 PolarHBondContact O-N 3.17Å; I711-A714 WeakPolarHBondContact O-CB 3.49Å; I711-A714 PolarHBondContact O-N 3.21Å; A714-N716 PolarHBondContact O-N 2.67Å; A714-T717 PolarHBondContact O-N 3.35Å
715	V	45.3	Very low	48.5	Very low	96 Å²	96	97.4 Å²	97.4	58%	0.582	62%	0.624	S	S	*	*	H	α-helix	trans	-63.6	-40	-179.9	170.6	0	0	0	0	111.9	I711 T717	I711-V715 HydrophobicContact CG2-CG2 4.42Å; I711-V715 WeakPolarHBondContact O-CG2 3.25Å; I711-V715 PolarHBondContact O-N 2.68Å; V715-T717 PolarHBondContact O-N 3.31Å; V715-T717 VanDerWaalsContact O-N 3.11Å
716	N	39.4	Very low	46.3	Very low	148 Å²	148	98.5 Å²	98.5	79%	0.791	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	0.2	-179.8	-83.4	-9.7	0	0	0	115.4	N712 A714	N712-N716 PolarHBondContact O-N 3.24Å; A714-N716 PolarHBondContact O-N 2.67Å
717	T	41.3	Very low	44	Very low	122 Å²	122	100.4 Å²	100.4	75%	0.748	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	13.9	-173	-35.6	0	0	0	0	113.9	S713 A714 V715	S713-T717 PolarHBondContact O-OG1 3.1Å; A714-T717 PolarHBondContact O-N 3.35Å; V715-T717 PolarHBondContact O-N 3.31Å; V715-T717 VanDerWaalsContact O-N 3.11Å
718	S	37.2	Very low	41.9	Very low	95 Å²	95	101.4 Å²	101.4	66%	0.664	66%	0.659	S	S	*	*			trans	-135.8	49.2	-170.3	54.9	0	0	0	0	116.1
719	S	36.8	Very low	40	Very low	122 Å²	122	103.8 Å²	103.8	85%	0.853	68%	0.675	S	S	*	*			trans	-111.8	50.9	176.4	69.2	0	0	0	0	114.5
720	S	32.3	Very low	38.3	Very low	103 Å²	103	109.1 Å²	109.1	72%	0.72	70%	0.698	S	S	*	*			trans	-153.8	136.6	171.4	59	0	0	0	0	114.9
721	T	31.7	Very low	37.2	Very low	123 Å²	123	111.4 Å²	111.4	76%	0.755	71%	0.709	S	S	*	*			trans	59.6	84.8	157.6	52.4	0	0	0	0	120.8
722	T	32	Very low	36.6	Very low	124 Å²	124	112.6 Å²	112.6	76%	0.761	72%	0.724	S	S	*	*				41	116.6	116.3	57.2	0	0	0	0	122.4
723	S	31.9	Very low	35.9	Very low	110 Å²	110	115 Å²	115	77%	0.769	74%	0.736	S	S	*	*				81.8	150.8	125.9	75.7	0	0	0	0	123.3
724	S	31.7	Very low	35	Very low	109 Å²	109	123.4 Å²	123.4	76%	0.762	76%	0.756	S	S	*	*			trans	84.6	104.4	161.8	70.9	0	0	0	0	121.1
725	S	31.2	Very low	34.4	Very low	103 Å²	103	125.1 Å²	125.1	72%	0.72	77%	0.77	S	S	*	*			trans	1.8	146.2	141.1	59.8	0	0	0	0	123.2
726	S	31.2	Very low	33.5	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	78%	0.781	S	S	*	*			trans	109.8	114.9	138.3	-59.7	0	0	0	0	120.5
727	S	30.4	Very low	33	Very low	105 Å²	105	120.6 Å²	120.6	73%	0.734	78%	0.778	S	S	*	*			trans	60	121.8	133.4	66.5	0	0	0	0	123.8
728	V	31.7	Very low	32.4	Very low	130 Å²	130	121 Å²	121	79%	0.788	78%	0.781	S	S	*	*				77.7	99.1	125.9	178.2	0	0	0	0	120.1
729	S	29.2	Very low	32.2	Very low	107 Å²	107	121.9 Å²	121.9	75%	0.748	78%	0.782	S	S	*	*				76.9	154.6	129.3	-62.7	0	0	0	0	124.4
730	L	27.6	Very low	32	Very low	173 Å²	173	124.6 Å²	124.6	91%	0.906	78%	0.781	S	S	*	*			trans	98	147.4	155.9	-76.5	166.4	0	0	0	121.1
731	V	36.3	Very low	31.9	Very low	118 Å²	118	124.4 Å²	124.4	72%	0.715	78%	0.78	S	S	*	*			trans	-120	141.6	-170.2	165.8	0	0	0	0	108.1
732	P	46	Very low	31.8	Very low	128 Å²	128	124.9 Å²	124.9	83%	0.831	78%	0.782	S	S	*	*				-148.1	162.8	121.8	33.7	-15.3	0	0	0	117
733	L	35.5	Very low	31.8	Very low	156 Å²	156	130.4 Å²	130.4	82%	0.817	79%	0.79	S	S	*	*			trans	-90.6	161.7	-177.3	-53.3	109.7	0	0	0	114.7
734	R	31.5	Very low	31.6	Very low	251 Å²	251	128.7 Å²	128.7	95%	0.947	79%	0.789	S	S	*	*			trans	174.9	165.1	132.8	-98.1	167.3	175.2	-162.5	-1.3	110.9
735	A	31.1	Very low	31.6	Very low	98 Å²	98	133.1 Å²	133.1	81%	0.81	80%	0.795	S	S	*	*			cis	177.8	159	-36.5	0	0	0	0	0	109.2
736	G	27.7	Very low	31.5	Very low	80 Å²	80	134.7 Å²	134.7	83%	0.825	80%	0.8	S	S	*	*			trans	167.2	88.2	165.6	0	0	0	0	0	120.4
737	G	27.6	Very low	31.5	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	80%	0.803	S	S	*	*			trans	65.7	176.5	155.1	0	0	0	0	0	119.5
738	T	30.8	Very low	31.6	Very low	131 Å²	131	139 Å²	139	80%	0.804	80%	0.802	S	S	*	*			cis	-178.2	144.6	-13.4	17.2	0	0	0	0	108.2
739	T	31.1	Very low	31.4	Very low	112 Å²	112	144.8 Å²	144.8	69%	0.687	81%	0.81	S	S	*	*			cis	-172.9	148.3	-19.6	11.8	0	0	0	0	110.2
740	Q	32.9	Very low	31.4	Very low	179 Å²	179	142.9 Å²	142.9	84%	0.836	81%	0.807	S	S	*	*			trans	68.1	151.7	164.4	-60.2	178.6	33.7	0	0	116.3
741	S	31.1	Very low	32.1	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	80%	0.802	S	S	*	*			cis	-157.4	178.7	1.3	-131.9	0	0	0	0	108.5
742	T	29.6	Very low	31.8	Very low	133 Å²	133	140.8 Å²	140.8	82%	0.816	81%	0.809	S	S	*	*			cis	-126.6	-109.6	10.7	37	0	0	0	0	113.9
743	R	32.6	Very low	31.1	Very low	241 Å²	241	138.1 Å²	138.1	91%	0.909	81%	0.805	S	S	*	*			trans	-174	120.6	-131	-173.1	-178.6	-175.6	171.1	1.5	114.7
744	G	26.8	Very low	31.1	Very low	74 Å²	74	137.1 Å²	137.1	76%	0.763	81%	0.808	S	S	*	*			trans	-163.4	130.9	160.1	0	0	0	0	0	110.3
745	K	32	Very low	31.2	Very low	202 Å²	202	129.5 Å²	129.5	88%	0.878	80%	0.798	S	S	*	*			trans	-149.1	133.7	-170.1	-76.4	-173.4	176.9	-178.5	0	114.5
746	T	29.1	Very low	31.6	Very low	135 Å²	135	131 Å²	131	83%	0.828	80%	0.8	S	S	*	*			trans	-158.7	118.7	144.6	14.1	0	0	0	0	106.9
747	K	31.1	Very low	31.7	Very low	185 Å²	185	137.3 Å²	137.3	80%	0.804	81%	0.805	S	S	*	*				61.3	134.3	68.9	-86.5	-162.3	171.2	-175.2	0	114.3
748	T	31.4	Very low	31.7	Very low	117 Å²	117	145.6 Å²	145.6	72%	0.718	81%	0.814	S	S	*	*			cis	179.5	136.5	-20.9	15.3	0	0	0	0	108.2
749	R	29	Very low	31.8	Very low	251 Å²	251	148.3 Å²	148.3	95%	0.947	82%	0.817	S	S	*	*			trans	162.9	147.3	138.4	-96.9	172.9	169.4	177.1	-4.6	112.5
750	G	27.6	Very low	31.5	Very low	67 Å²	67	155 Å²	155	69%	0.691	83%	0.83	S	S	*	*			trans	-107.9	-153.1	154.4	0	0	0	0	0	109.9
751	P	43	Very low	31.3	Very low	123 Å²	123	151.6 Å²	151.6	80%	0.799	83%	0.826	S	S	*	*			cis	-137.6	-155.7	8.4	44.1	-25.6	0	0	0	113.7
752	S	30.5	Very low	31.3	Very low	125 Å²	125	156.3 Å²	156.3	87%	0.874	84%	0.837	S	S	*	*			trans	84.8	146.6	160.4	79.2	0	0	0	0	119.7
753	G	31.4	Very low	31.1	Very low	71 Å²	71	153.8 Å²	153.8	73%	0.732	84%	0.838	S	S	*	*			trans	-162.5	166.3	170.1	0	0	0	0	0	109.8
754	P	34.5	Very low	30.7	Very low	135 Å²	135	146.3 Å²	146.3	88%	0.877	84%	0.835	S	S	*	*			trans	-107.4	162.4	-176.9	37.9	-30.7	0	0	0	114.7
755	A	33.6	Very low	30.7	Very low	91 Å²	91	148.6 Å²	148.6	75%	0.752	84%	0.84	S	S	*	*			trans	-86.6	170.5	-176	0	0	0	0	0	113.2
756	P	39.2	Very low	30.8	Very low	129 Å²	129	147.8 Å²	147.8	84%	0.838	84%	0.841	S	S	*	*			trans	-79.7	161.1	-166.5	32.8	-35.6	0	0	0	114.4
757	K	31.4	Very low	30.8	Very low	214 Å²	214	144.8 Å²	144.8	93%	0.93	84%	0.837	S	S	*	*			trans	-111.3	154.8	173.5	-86.6	-175.1	175.2	178.1	0	113.1
758	R	28	Very low	31.4	Very low	244 Å²	244	140.5 Å²	140.5	92%	0.921	83%	0.827	S	S	*	*			trans	-82.2	164	-166.5	-138.4	170.4	176.6	177.8	-3	113.1
759	Q	31.9	Very low	32	Very low	187 Å²	187	139.8 Å²	139.8	87%	0.874	82%	0.818	S	S	*	*			trans	-56	156.2	177.4	-61	160.1	-63	0	0	114.1
760	R	25.4	Very low	32.2	Very low	253 Å²	253	133.1 Å²	133.1	96%	0.955	80%	0.801	S	S	*	*			trans	-142.5	141.9	143.3	-158.8	173.2	-171.3	176.4	2.7	109.3
761	S	28.5	Very low	32.4	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	80%	0.796	S	S	*	*			trans	-105.4	148.9	-172.6	46.6	0	0	0	0	112.7
762	Q	30.5	Very low	32.2	Very low	198 Å²	198	135.6 Å²	135.6	93%	0.925	79%	0.791	S	S	*	*			trans	-158.2	145.1	151.3	-87.6	-145	-12.9	0	0	112.7
763	G	24.7	Very low	32.5	Very low	80 Å²	80	137.1 Å²	137.1	83%	0.825	78%	0.782	S	S	*	*			trans	59.4	91.5	134.9	0	0	0	0	0	118.5
764	G	25.2	Very low	32.5	Very low	83 Å²	83	142.8 Å²	142.8	86%	0.856	79%	0.787	S	S	*	*			trans	-82.4	161.3	172.2	0	0	0	0	0	114.5
765	S	26.5	Very low	32.4	Very low	123 Å²	123	145 Å²	145	86%	0.86	78%	0.782	S	S	*	*			trans	-142.6	110.8	148.4	-173.4	0	0	0	0	107	G767	S765-G767 PolarHBondContact O-N 2.81Å
766	M	33.8	Very low	32.3	Very low	184 Å²	184	151.5 Å²	151.5	91%	0.906	81%	0.805	S	S	*	*			trans	-80.9	101.7	178.3	-71.4	-168.4	72.7	0	0	109.2	T768	M766-T768 PolarHBondContact O-N 3.46Å
767	G	30.6	Very low	31.9	Very low	72 Å²	72	152.6 Å²	152.6	74%	0.742	80%	0.803	S	S	*	*			trans	-67.4	109.1	172.6	0	0	0	0	0	110.7	S765	S765-G767 PolarHBondContact O-N 2.81Å
768	T	41.8	Very low	32	Very low	96 Å²	96	149.4 Å²	149.4	59%	0.589	80%	0.796	S	S	*	*			trans	-70.2	149.4	177.1	52.2	0	0	0	0	111.9	M766 D770 S771	M766-T768 PolarHBondContact O-N 3.46Å; T768-D770 PolarHBondContact O-N 3.34Å; T768-D770 VanDerWaalsContact O-N 3.16Å; T768-S771 WeakPolarHBondContact O-CB 3.41Å; T768-S771 PolarHBondContact O-N 2.97Å; T768-S771 VanDerWaalsContact O-N 3.11Å; T768-S771 PolarHBondContact O-OG 3.45Å
769	L	44.5	Very low	32.2	Very low	101 Å²	101	144.1 Å²	144.1	53%	0.529	79%	0.789	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-20.6	-177.3	-78.6	163.9	0	0	0	114	S771 F772	L769-S771 PolarHBondContact O-N 3.05Å; L769-S771 VanDerWaalsContact O-N 3.16Å; L769-F772 WeakPolarHBondContact O-CB 3.04Å; L769-F772 PolarHBondContact O-N 3.29Å
770	D	33.8	Very low	32.2	Very low	111 Å²	111	141.6 Å²	141.6	59%	0.594	78%	0.784	S	S	*	*	H	α-helix	trans	-57.2	-25.8	172.1	-87.5	-43.5	0	0	0	113.7	T768 F772	T768-D770 PolarHBondContact O-N 3.34Å; T768-D770 VanDerWaalsContact O-N 3.16Å; D770-F772 PolarHBondContact O-N 3.29Å
771	S	32.4	Very low	32.6	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	77%	0.774	S	S	*	*	H	α-helix	trans	-63.4	-22.5	173.5	63.6	0	0	0	0	113.2	T768 L769	T768-S771 WeakPolarHBondContact O-CB 3.41Å; T768-S771 PolarHBondContact O-N 2.97Å; T768-S771 VanDerWaalsContact O-N 3.11Å; T768-S771 PolarHBondContact O-OG 3.45Å; L769-S771 PolarHBondContact O-N 3.05Å; L769-S771 VanDerWaalsContact O-N 3.16Å
772	F	38.3	Very low	32.9	Very low	160 Å²	160	136.4 Å²	136.4	70%	0.702	78%	0.775	S	S	*	*	H	α-helix	trans	-89.8	-37.9	-177	-125	-91	0	0	0	113.1	L769 D770 K774 K775	L769-F772 WeakPolarHBondContact O-CB 3.04Å; L769-F772 PolarHBondContact O-N 3.29Å; D770-F772 PolarHBondContact O-N 3.29Å; F772-K774 PolarHBondContact O-N 3.32Å; F772-K775 PolarHBondContact O-N 2.65Å
773	F	36	Very low	33.1	Very low	156 Å²	156	132 Å²	132	68%	0.684	76%	0.764	S	S	*	*	H	α-helix	trans	-72.1	-13.3	-178	-78	-77.1	0	0	0	114.4	K775	F773-K775 VanDerWaalsContact C-N 3.26Å; F773-K775 PolarHBondContact O-N 2.73Å
774	K	32.3	Very low	33.7	Very low	191 Å²	191	136 Å²	136	83%	0.83	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	10.9	173.2	-74	-177.2	175.5	175.3	0	114.8	F772	F772-K774 PolarHBondContact O-N 3.32Å
775	K	33	Very low	34.4	Very low	180 Å²	180	140.4 Å²	140.4	78%	0.783	75%	0.752	S	S	*	*			trans	-139.9	77.7	175.3	-74.8	-175.8	177.3	170.1	0	113.6	F772 F773	F772-K775 PolarHBondContact O-N 2.65Å; F773-K775 VanDerWaalsContact C-N 3.26Å; F773-K775 PolarHBondContact O-N 2.73Å
776	N	30	Very low	35.1	Very low	228 Å²	228	142 Å²	142	100%	1.219	74%	0.742	S	S	*	*			trans	-144.7	0	152.2	-80.7	-63	0	0	0	109.1

Retrieved 776 of 776 residues in 798.3 ms (Link to these results)

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