A0A087XKI6_POEFO Loading...

Kelch like family member 24

AlphaFold DB , UniProt , Accession A0A087XKI6, Species POEFO (Poecilia formosa, Amazon molly), Gene KLHL24, Length 597 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	28.9	Very low	236 Å²	236	160.5 Å²	160.5	100%	1.163	85%	0.847	S	S	*	*				0	107.8	0	-76.9	172.4	174.8	0	0	106.7
2	V	27.8	Very low	28.9	Very low	136 Å²	136	156.3 Å²	156.3	82%	0.824	84%	0.841	S	S	*	*				90.2	102.5	77	167.5	0	0	0	0	110.1
3	L	27.8	Very low	29	Very low	155 Å²	155	152.5 Å²	152.5	81%	0.812	83%	0.834	S	S	*	*			trans	-50.3	153.5	157.3	-83.3	103.6	0	0	0	111.1
4	L	26.8	Very low	29	Very low	154 Å²	154	151.2 Å²	151.2	81%	0.806	83%	0.833	S	S	*	*				-178.8	129.6	108.7	-99.1	153.7	0	0	0	112.6
5	A	28.6	Very low	29.1	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	83%	0.826	S	S	*	*			trans	-89	122.8	158.6	0	0	0	0	0	109.1
6	L	28.7	Very low	29.1	Very low	175 Å²	175	147.3 Å²	147.3	92%	0.916	82%	0.82	S	S	*	*			trans	-89.7	145.1	162.4	-69.2	156.6	0	0	0	107.8
7	G	26.2	Very low	29.2	Very low	72 Å²	72	144.8 Å²	144.8	74%	0.742	81%	0.809	S	S	*	*			cis	178.7	166.5	-5.7	0	0	0	0	0	110.5
8	R	29.4	Very low	29.3	Very low	255 Å²	255	147.4 Å²	147.4	96%	0.962	81%	0.811	S	S	*	*			trans	-108.1	145.1	166.1	-88.3	-176.4	171.2	179.9	-2.6	110.2
9	R	28.9	Very low	29.2	Very low	235 Å²	235	148.7 Å²	148.7	89%	0.887	81%	0.81	S	S	*	*			trans	-130.1	148.7	164.1	-87.5	-168.7	169.8	-177.6	-1.4	106
10	T	30.3	Very low	29	Very low	100 Å²	100	146.6 Å²	146.6	61%	0.613	81%	0.807	S	S	*	*			cis	-162.1	148.6	8.5	3.7	0	0	0	0	109.6
11	N	30	Very low	29.9	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	80%	0.804	S	S	*	*			trans	52.1	153	143.7	-55.2	-4.3	0	0	0	119.6
12	S	29.6	Very low	29.8	Very low	111 Å²	111	139.7 Å²	139.7	78%	0.776	79%	0.785	S	S	*	*			cis	-144.2	176.3	10.3	58.4	0	0	0	0	109
13	S	29.7	Very low	29.9	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	78%	0.778	S	S	*	*			cis	-155.7	162.8	12.8	39.5	0	0	0	0	110.8
14	T	29.5	Very low	30.2	Very low	135 Å²	135	140.2 Å²	140.2	83%	0.828	78%	0.778	S	S	*	*			trans	-55.4	164.2	166.5	51.6	0	0	0	0	112.7
15	S	30	Very low	30.3	Very low	104 Å²	104	144.5 Å²	144.5	73%	0.727	78%	0.784	S	S	*	*			cis	-150.7	-174.8	15.4	63.4	0	0	0	0	109.9
16	D	29.7	Very low	30.9	Very low	136 Å²	136	149.7 Å²	149.7	73%	0.727	79%	0.789	S	S	*	*			cis	-151.3	-156.1	2.8	-153.5	-99.8	0	0	0	111.6
17	T	29.4	Very low	31	Very low	104 Å²	104	147.7 Å²	147.7	64%	0.638	78%	0.784	S	S	*	*			trans	-77.9	165.1	174.4	63.6	0	0	0	0	113.4
18	K	31.2	Very low	31.1	Very low	192 Å²	192	151.8 Å²	151.8	84%	0.835	79%	0.787	S	S	*	*			cis	-169.9	176	38.7	-142.2	156.9	-169.7	174.8	0	112.3
19	E	27.5	Very low	31.8	Very low	172 Å²	172	144.6 Å²	144.6	80%	0.804	77%	0.774	S	S	*	*			trans	-76.3	138.7	-168.5	-64.7	170.6	116.2	0	0	117.2
20	S	25.7	Very low	32.1	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	77%	0.766	S	S	*	*				63	162.4	121.3	-56.8	0	0	0	0	122.4
21	P	48.2	Very low	32.5	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	78%	0.776	S	S	*	*			cis	-136.7	-164.9	-28.3	26.1	-1.1	0	0	0	114.1
22	V	30.1	Very low	33	Very low	123 Å²	123	145.7 Å²	145.7	75%	0.745	78%	0.778	S	S	*	*			trans	99.2	98.5	149.3	-170.2	0	0	0	0	120.9
23	V	31.1	Very low	33.8	Very low	113 Å²	113	149.7 Å²	149.7	69%	0.685	78%	0.781	S	S	*	*			trans	84.7	121.6	132.3	169.2	0	0	0	0	123.4
24	K	32.8	Very low	34.7	Very low	188 Å²	188	148.7 Å²	148.7	82%	0.817	78%	0.779	S	S	*	*			trans	40.7	133.6	144.3	-57.6	170.2	-168.5	170.7	0	118.2
25	R	29.8	Very low	35.8	Very low	245 Å²	245	145.2 Å²	145.2	93%	0.925	77%	0.77	S	S	*	*			cis	-167.1	164.8	47.2	-143.3	168.2	-175.4	165.5	-1.9	111.5
26	K	40.4	Very low	37.2	Very low	203 Å²	203	148.3 Å²	148.3	88%	0.883	78%	0.779	S	S	*	*			trans	-58.7	158	-177	-67.3	179.6	170.3	-175	0	116.1
27	V	30.5	Very low	38.8	Very low	133 Å²	133	149 Å²	149	81%	0.806	78%	0.783	S	S	*	*			trans	146.2	124.6	156.8	152	0	0	0	0	106.1
28	L	29.2	Very low	41	Very low	157 Å²	157	152.2 Å²	152.2	82%	0.822	79%	0.788	S	S	*	*			cis	-144.5	170.8	13.4	-93.8	147.5	0	0	0	110.9
29	P	44.2	Very low	42.7	Very low	104 Å²	104	150.5 Å²	150.5	68%	0.675	79%	0.788	S	S	*	*			trans	-95.8	148.2	177.5	37	-31	0	0	0	113.8
30	V	36	Very low	45.2	Very low	121 Å²	121	149.7 Å²	149.7	73%	0.733	78%	0.782	S	S	*	*			trans	-143.6	112.8	146.6	-178.3	0	0	0	0	107.5	Y32	V30-Y32 HydrophobicContact CG1-CD2 3.97Å; V30-Y32 HydrophobicContact CG1-CE2 3.81Å; V30-Y32 PolarHBondContact O-N 2.91Å
31	E	37	Very low	47.5	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	78%	0.782	S	S	*	*			trans	-76.8	114.6	167.1	-70.4	179.1	161.8	0	0	109
32	Y	42.1	Very low	48.6	Very low	215 Å²	215	147 Å²	147	84%	0.843	77%	0.765	S	S	*	*			trans	-89.4	113.2	153	-82.6	-90.6	0	0	0	107.1	V30 A34	V30-Y32 HydrophobicContact CG1-CD2 3.97Å; V30-Y32 HydrophobicContact CG1-CE2 3.81Å; V30-Y32 PolarHBondContact O-N 2.91Å; Y32-A34 PolarHBondContact O-N 2.73Å
33	K	45.6	Very low	50.8	Low	194 Å²	194	143.3 Å²	143.3	84%	0.843	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-61.1	117.6	169.7	-71.5	-172.2	174.2	-170.3	0	108.6
34	A	49.7	Very low	52.7	Low	85 Å²	85	141.6 Å²	141.6	70%	0.702	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-62	146	155.5	0	0	0	0	0	108.1	Y32 D36	Y32-A34 PolarHBondContact O-N 2.73Å; A34-D36 PolarHBondContact O-N 3.15Å
35	G	52.4	Low	54.9	Low	63 Å²	63	136.5 Å²	136.5	65%	0.649	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-67.3	130.8	173.6	0	0	0	0	0	110.2	D37	G35-D37 VanDerWaalsContact C-N 3.27Å; G35-D37 PolarHBondContact O-N 3.37Å; G35-D37 VanDerWaalsContact O-N 3.08Å
36	D	58.3	Low	57.4	Low	168 Å²	168	130.6 Å²	130.6	90%	0.898	72%	0.72	S	S	*	*			trans	-78.3	80	167.3	-70.4	-44.4	0	0	0	108.5	A34 F38	A34-D36 PolarHBondContact O-N 3.15Å; D36-F38 PolarHBondContact O-N 2.91Å
37	D	64.2	Low	59.5	Low	152 Å²	152	124 Å²	124	81%	0.813	70%	0.7	S	S	*	*			trans	-68.9	122.1	172.5	-73.4	-28.2	0	0	0	109.6	G35	G35-D37 VanDerWaalsContact C-N 3.27Å; G35-D37 PolarHBondContact O-N 3.37Å; G35-D37 VanDerWaalsContact O-N 3.08Å
38	F	74.7	Confident	62	Low	170 Å²	170	122.5 Å²	122.5	75%	0.746	68%	0.683	S	S	*	*			trans	-106.8	100.6	-179.9	178.8	-101.6	0	0	0	111.2	D36 F40	D36-F38 PolarHBondContact O-N 2.91Å; F38-F40 HydrophobicContact CD1-CB 4.24Å; F38-F40 HydrophobicContact CE1-CB 3.88Å; F38-F40 HydrophobicContact CE1-CD2 4.28Å; F38-F40 PolarHBondContact O-N 2.96Å; F38-F40 VanDerWaalsContact O-N 3.07Å
39	D	67.9	Low	64.6	Low	157 Å²	157	116.6 Å²	116.6	84%	0.84	66%	0.661	S	S	*	*			trans	-73.9	94.1	175.3	-77.1	-34.4	0	0	0	111.6
40	F	80.3	Confident	66.7	Low	155 Å²	155	115.1 Å²	115.1	68%	0.68	65%	0.646	S	S	*	*			trans	-76.5	122.7	171.8	176.7	-103.3	0	0	0	111.6	F38	F38-F40 HydrophobicContact CD1-CB 4.24Å; F38-F40 HydrophobicContact CE1-CB 3.88Å; F38-F40 HydrophobicContact CE1-CD2 4.28Å; F38-F40 PolarHBondContact O-N 2.96Å; F38-F40 VanDerWaalsContact O-N 3.07Å
41	C	72.4	Confident	69.3	Low	110 Å²	110	112.3 Å²	112.3	74%	0.743	63%	0.627	S	S	*	*			trans	-119.3	117.4	171.4	-175.3	0	0	0	0	110.9	G43	C41-G43 PolarHBondContact O-N 2.91Å
42	S	72.6	Confident	71.7	Confident	56 Å²	56	109.6 Å²	109.6	39%	0.392	61%	0.614	S	S	.	*			trans	-71.4	-7.8	178.7	-172.8	0	0	0	0	114.3	S45	S42-S45 PolarHBondContact O-OG 3.22Å; S42-S45 VanDerWaalsContact O-OG 3.09Å
43	G	75.3	Confident	74	Confident	45 Å²	45	102.2 Å²	102.2	46%	0.464	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	64.9	-163.2	-176.8	0	0	0	0	0	114.3	C41 S45 H46	C41-G43 PolarHBondContact O-N 2.91Å; G43-S45 VanDerWaalsContact C-N 3.26Å; G43-S45 PolarHBondContact O-N 2.82Å; G43-H46 PolarHBondContact O-N 2.83Å
44	A	72.3	Confident	76.2	Confident	77 Å²	77	96.5 Å²	96.5	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-68	-18	-171.3	0	0	0	0	0	115.2	H46 S47 E48	A44-H46 VanDerWaalsContact C-N 3.31Å; A44-H46 PolarHBondContact O-N 2.88Å; A44-S47 WeakPolarHBondContact CA-OG 3.48Å; A44-S47 PolarHBondContact O-N 3.17Å; A44-S47 PolarHBondContact O-OG 3.42Å; A44-E48 PolarHBondContact O-N 3.32Å; A44-E48 VanDerWaalsContact O-N 3.11Å
45	S	77.4	Confident	78.2	Confident	81 Å²	81	93.7 Å²	93.7	57%	0.566	54%	0.54	S	S	*	.	H	α-helix	trans	-65.5	-32.3	180	53.9	0	0	0	0	112.8	S42 G43 G49	S42-S45 PolarHBondContact O-OG 3.22Å; S42-S45 VanDerWaalsContact O-OG 3.09Å; G43-S45 VanDerWaalsContact C-N 3.26Å; G43-S45 PolarHBondContact O-N 2.82Å; S45-G49 PolarHBondContact O-N 2.81Å
46	H	83.8	Confident	80	Confident	121 Å²	121	95.6 Å²	95.6	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-65.2	-44.3	176	-174.7	56.4	0	0	0	111.6	G43 A44 I50	G43-H46 PolarHBondContact O-N 2.83Å; A44-H46 VanDerWaalsContact C-N 3.31Å; A44-H46 PolarHBondContact O-N 2.88Å; H46-I50 WeakPolarHBondContact NE2-CD1 3.39Å; H46-I50 WeakPolarHBondContact O-CG1 3.38Å; H46-I50 PolarHBondContact O-N 2.9Å
47	S	83.3	Confident	81.6	Confident	65 Å²	65	90.6 Å²	90.6	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-67.4	-38.2	177.4	35.9	0	0	0	0	113.6	A44 L51	A44-S47 WeakPolarHBondContact CA-OG 3.48Å; A44-S47 PolarHBondContact O-N 3.17Å; A44-S47 PolarHBondContact O-OG 3.42Å; S47-L51 PolarHBondContact O-N 2.61Å
48	E	83.6	Confident	82.9	Confident	100 Å²	100	84.4 Å²	84.4	47%	0.467	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-42.6	176.1	-168.7	169.2	-159.7	0	0	111.1	A44 I50 L51 Q52 R126	A44-E48 PolarHBondContact O-N 3.32Å; A44-E48 VanDerWaalsContact O-N 3.11Å; E48-I50 PolarHBondContact O-N 2.99Å; E48-L51 PolarHBondContact O-N 3.25Å; E48-Q52 PolarHBondContact O-N 2.76Å; E48-R126 IonicContact OE1-CZ 2.67Å; E48-R126 IonicContact OE1-NE 2.98Å; E48-R126 IonicContact OE1-NH2 3.56Å; E48-R126 PolarHBondContact OE1-NH2 3.47Å
49	G	83.9	Confident	83.6	Confident	34 Å²	34	81.4 Å²	81.4	35%	0.351	46%	0.459	S	S	.	.	H	α-helix	trans	-62.3	-39.9	175.3	0	0	0	0	0	114	S45 Q52 V53	S45-G49 PolarHBondContact O-N 2.81Å; G49-Q52 PolarHBondContact O-N 2.8Å; G49-V53 WeakPolarHBondContact O-CG2 3.38Å; G49-V53 PolarHBondContact O-N 2.92Å; G49-V53 VanDerWaalsContact O-N 3.13Å
50	I	88.8	Confident	84.7	Confident	72 Å²	72	78 Å²	78	37%	0.369	45%	0.447	S	S	.	.	H	α-helix	trans	-62.5	-46	175.1	-74.8	168.5	0	0	0	111.3	H46 E48 Q52 V53 F54	H46-I50 WeakPolarHBondContact NE2-CD1 3.39Å; H46-I50 WeakPolarHBondContact O-CG1 3.38Å; H46-I50 PolarHBondContact O-N 2.9Å; E48-I50 PolarHBondContact O-N 2.99Å; I50-Q52 VanDerWaalsContact C-N 3.33Å; I50-Q52 PolarHBondContact O-N 2.79Å; I50-V53 PolarHBondContact O-N 3.49Å; I50-F54 HydrophobicContact CG2-CD2 3.64Å; I50-F54 HydrophobicContact CG2-CE2 3.58Å; I50-F54 VanDerWaalsContact O-CD2 3.31Å; I50-F54 WeakPolarHBondContact O-CD2 3.32Å; I50-F54 PolarHBondContact O-N 2.83Å
51	L	89.4	Confident	85.2	Confident	62 Å²	62	78.8 Å²	78.8	33%	0.325	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-38.9	179.1	-78	171.8	0	0	0	112.1	S47 E48 F54 N55	S47-L51 PolarHBondContact O-N 2.61Å; E48-L51 PolarHBondContact O-N 3.25Å; L51-F54 PolarHBondContact O-N 3.27Å; L51-N55 PolarHBondContact O-N 3.29Å
52	Q	88.1	Confident	86	Confident	119 Å²	119	77.5 Å²	77.5	56%	0.556	43%	0.431	S	S	*	.	H	α-helix	trans	-60	-46.5	174.8	-173.2	172.6	-10.1	0	0	112.1	E48 G49 I50 F54 N55 E56	E48-Q52 PolarHBondContact O-N 2.76Å; G49-Q52 PolarHBondContact O-N 2.8Å; I50-Q52 VanDerWaalsContact C-N 3.33Å; I50-Q52 PolarHBondContact O-N 2.79Å; Q52-F54 VanDerWaalsContact C-N 3.34Å; Q52-F54 PolarHBondContact O-N 2.78Å; Q52-N55 WeakPolarHBondContact O-CB 3.31Å; Q52-N55 PolarHBondContact O-N 2.83Å; Q52-N55 VanDerWaalsContact O-N 3.1Å; Q52-E56 PolarHBondContact O-N 2.72Å
53	V	89.9	Confident	86.8	Confident	61 Å²	61	82.2 Å²	82.2	37%	0.37	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-38.7	175.4	173.8	0	0	0	0	111.7	G49 I50 N55 E56 F57	G49-V53 WeakPolarHBondContact O-CG2 3.38Å; G49-V53 PolarHBondContact O-N 2.92Å; G49-V53 VanDerWaalsContact O-N 3.13Å; I50-V53 PolarHBondContact O-N 3.49Å; V53-N55 VanDerWaalsContact C-N 3.28Å; V53-N55 PolarHBondContact O-N 2.99Å; V53-E56 PolarHBondContact O-N 3.3Å; V53-F57 HydrophobicContact CG1-CD1 4.34Å; V53-F57 HydrophobicContact CG1-CD2 4.41Å; V53-F57 HydrophobicContact CG1-CE1 3.81Å; V53-F57 HydrophobicContact CG1-CE2 3.89Å; V53-F57 HydrophobicContact CG1-CZ 3.57Å; V53-F57 WeakPolarHBondContact O-CG 3.44Å; V53-F57 PolarHBondContact O-N 3.46Å
54	F	91.5	Very high	87.5	Confident	74 Å²	74	81.3 Å²	81.3	33%	0.325	43%	0.43	S	S	.	.	H	α-helix	trans	-65.4	-28.8	173.8	-85.3	-61.3	0	0	0	113.4	I50 L51 Q52 F57 R58 V81 Y123	I50-F54 HydrophobicContact CG2-CD2 3.64Å; I50-F54 HydrophobicContact CG2-CE2 3.58Å; I50-F54 VanDerWaalsContact O-CD2 3.31Å; I50-F54 WeakPolarHBondContact O-CD2 3.32Å; I50-F54 PolarHBondContact O-N 2.83Å; L51-F54 PolarHBondContact O-N 3.27Å; Q52-F54 VanDerWaalsContact C-N 3.34Å; Q52-F54 PolarHBondContact O-N 2.78Å; F54-F57 HydrophobicContact CD1-CD2 4.14Å; F54-F57 HydrophobicContact CE1-CD2 4.47Å; F54-R58 PolarHBondContact O-N 3Å; F54-R58 VanDerWaalsContact O-N 3.08Å; F54-V81 HydrophobicContact CD1-CG2 4.44Å; F54-V81 HydrophobicContact CG-CG2 4.38Å; F54-Y123 HydrophobicContact CB-CD1 4.09Å; F54-Y123 HydrophobicContact CB-CE1 4.06Å
55	N	91.7	Very high	88.4	Confident	26 Å²	26	81.3 Å²	81.3	14%	0.139	42%	0.419	C	S	.	.	H	α-helix	trans	-70.7	-42.6	171.6	-163.3	76.4	0	0	0	111.5	L51 Q52 V53 F57 R58 D59 Y123	L51-N55 PolarHBondContact O-N 3.29Å; Q52-N55 WeakPolarHBondContact O-CB 3.31Å; Q52-N55 PolarHBondContact O-N 2.83Å; Q52-N55 VanDerWaalsContact O-N 3.1Å; V53-N55 VanDerWaalsContact C-N 3.28Å; V53-N55 PolarHBondContact O-N 2.99Å; N55-F57 VanDerWaalsContact C-N 3.29Å; N55-F57 PolarHBondContact O-N 3.39Å; N55-R58 WeakPolarHBondContact O-CB 3.43Å; N55-R58 PolarHBondContact O-N 3.19Å; N55-R58 VanDerWaalsContact O-N 3.1Å; N55-D59 PolarHBondContact ND2-OD2 3.35Å; N55-D59 PolarHBondContact O-N 3.36Å; N55-Y123 HydrophobicContact CB-CD1 4.35Å; N55-Y123 WeakPolarHBondContact OD1-CB 3.09Å
56	E	90.6	Very high	89	Confident	102 Å²	102	77.4 Å²	77.4	48%	0.477	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-38	174.5	-67.7	172.7	-169	0	0	112	Q52 V53 D59 C60	Q52-E56 PolarHBondContact O-N 2.72Å; V53-E56 PolarHBondContact O-N 3.3Å; E56-D59 PolarHBondContact O-N 3.33Å; E56-C60 WeakPolarHBondContact O-CB 3.3Å; E56-C60 PolarHBondContact O-N 3.34Å; E56-C60 PolarHBondContact O-SG 3.35Å; E56-C60 VanDerWaalsContact O-SG 3.34Å
57	F	92.4	Very high	89.4	Confident	64 Å²	64	72.8 Å²	72.8	28%	0.281	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-41.5	172.4	-69	-8.4	0	0	0	112.3	V53 F54 N55 C60 R61 L62 F63	V53-F57 HydrophobicContact CG1-CD1 4.34Å; V53-F57 HydrophobicContact CG1-CD2 4.41Å; V53-F57 HydrophobicContact CG1-CE1 3.81Å; V53-F57 HydrophobicContact CG1-CE2 3.89Å; V53-F57 HydrophobicContact CG1-CZ 3.57Å; V53-F57 WeakPolarHBondContact O-CG 3.44Å; V53-F57 PolarHBondContact O-N 3.46Å; F54-F57 HydrophobicContact CD1-CD2 4.14Å; F54-F57 HydrophobicContact CE1-CD2 4.47Å; N55-F57 VanDerWaalsContact C-N 3.29Å; N55-F57 PolarHBondContact O-N 3.39Å; F57-C60 CarbonylContact O-C 3.55Å; F57-C60 PolarHBondContact O-N 3.33Å; F57-R61 PolarHBondContact O-N 2.9Å; F57-L62 HydrophobicContact CB-CB 4.22Å; F57-L62 HydrophobicContact CD1-CB 4.49Å; F57-L62 HydrophobicContact CD1-CD1 4.21Å; F57-L62 HydrophobicContact CG-CB 4.44Å; F57-L62 PolarHBondContact O-N 3.04Å; F57-F63 AromaticContact CD2-CD2 3.81Å; F57-F63 HydrophobicContact CD2-CD2 3.81Å; F57-F63 HydrophobicContact CD2-CE2 4.27Å; F57-F63 HydrophobicContact CE2-CD2 4.02Å; F57-F63 HydrophobicContact CE2-CE2 4.07Å; F57-F63 HydrophobicContact CG-CD2 4.22Å; F57-F63 HydrophobicContact CZ-CE2 4.25Å
58	R	91.8	Very high	89.8	Confident	21 Å²	21	69.7 Å²	69.7	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-60.1	-47.9	175.5	174.4	-174	168.7	-131.7	-7.2	111.2	F54 N55 C60 R61 P76 L119 N120 Y123	F54-R58 PolarHBondContact O-N 3Å; F54-R58 VanDerWaalsContact O-N 3.08Å; N55-R58 WeakPolarHBondContact O-CB 3.43Å; N55-R58 PolarHBondContact O-N 3.19Å; N55-R58 VanDerWaalsContact O-N 3.1Å; R58-C60 VanDerWaalsContact C-N 3.34Å; R58-C60 PolarHBondContact O-N 3.3Å; R58-R61 PolarHBondContact O-N 2.93Å; R58-R61 VanDerWaalsContact O-N 3.08Å; R58-P76 WeakPolarHBondContact CG-O 3.19Å; R58-L119 VanDerWaalsContact NH2-CB 3.34Å; R58-N120 PolarHBondContact NH1-OD1 3.13Å; R58-Y123 HydrophobicContact CB-CE1 4.34Å
59	D	89.4	Confident	90.2	Very high	107 Å²	107	65.6 Å²	65.6	57%	0.572	33%	0.333	S	S	*	.	H	α-helix	trans	-64.5	-38.5	-179.8	-66.4	-24.6	0	0	0	111.6	N55 E56 R61	N55-D59 PolarHBondContact ND2-OD2 3.35Å; N55-D59 PolarHBondContact O-N 3.36Å; E56-D59 PolarHBondContact O-N 3.33Å; D59-R61 VanDerWaalsContact C-N 3.29Å; D59-R61 PolarHBondContact O-N 2.89Å
60	C	91	Very high	90.6	Very high	87 Å²	87	64 Å²	64	59%	0.588	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.6	173.8	-66.7	0	0	0	0	114.7	E56 F57 R58 L62	E56-C60 WeakPolarHBondContact O-CB 3.3Å; E56-C60 PolarHBondContact O-N 3.34Å; E56-C60 PolarHBondContact O-SG 3.35Å; E56-C60 VanDerWaalsContact O-SG 3.34Å; F57-C60 CarbonylContact O-C 3.55Å; F57-C60 PolarHBondContact O-N 3.33Å; R58-C60 VanDerWaalsContact C-N 3.34Å; R58-C60 PolarHBondContact O-N 3.3Å; C60-L62 HydrophobicContact CB-CD1 3.79Å; C60-L62 HydrophobicContact CB-CG 3.76Å; C60-L62 PolarHBondContact O-N 3.47Å
61	R	90.9	Very high	90.5	Very high	171 Å²	171	67 Å²	67	65%	0.645	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	31.6	-171.8	-51.6	-176.5	179.3	-159.3	-4.3	114.3	F57 R58 D59 P76	F57-R61 PolarHBondContact O-N 2.9Å; R58-R61 PolarHBondContact O-N 2.93Å; R58-R61 VanDerWaalsContact O-N 3.08Å; D59-R61 VanDerWaalsContact C-N 3.29Å; D59-R61 PolarHBondContact O-N 2.89Å; R61-P76 HydrophobicContact CG-CG 4.06Å
62	L	87.8	Confident	90.3	Very high	82 Å²	82	67.3 Å²	67.3	43%	0.429	35%	0.347	S	S	.	.			trans	-86.7	134.5	175.5	-63.2	173.1	0	0	0	109.5	F57 C60 T64 H78	F57-L62 HydrophobicContact CB-CB 4.22Å; F57-L62 HydrophobicContact CD1-CB 4.49Å; F57-L62 HydrophobicContact CD1-CD1 4.21Å; F57-L62 HydrophobicContact CG-CB 4.44Å; F57-L62 PolarHBondContact O-N 3.04Å; C60-L62 HydrophobicContact CB-CD1 3.79Å; C60-L62 HydrophobicContact CB-CG 3.76Å; C60-L62 PolarHBondContact O-N 3.47Å; L62-T64 PolarHBondContact O-N 3.01Å; L62-H78 PolarHBondContact O-NE2 3.16Å; L62-H78 VanDerWaalsContact O-NE2 3.16Å
63	F	89.8	Confident	90.5	Very high	155 Å²	155	68.2 Å²	68.2	68%	0.68	35%	0.345	S	S	*	.	S	Bend	trans	58.1	11.1	176.5	-45.7	-68.4	0	0	0	116.7	F57 D65 H78	F57-F63 AromaticContact CD2-CD2 3.81Å; F57-F63 HydrophobicContact CD2-CD2 3.81Å; F57-F63 HydrophobicContact CD2-CE2 4.27Å; F57-F63 HydrophobicContact CE2-CD2 4.02Å; F57-F63 HydrophobicContact CE2-CE2 4.07Å; F57-F63 HydrophobicContact CG-CD2 4.22Å; F57-F63 HydrophobicContact CZ-CE2 4.25Å; F63-D65 PolarHBondContact O-N 3.1Å; F63-H78 PolarHBondContact O-CD2 3.14Å; F63-H78 VanDerWaalsContact O-CD2 3.3Å
64	T	90.1	Very high	90.7	Very high	27 Å²	27	71 Å²	71	17%	0.166	35%	0.354	C	S	.	.			trans	-71.5	124.2	176.2	56	0	0	0	0	111.3	L62 P76 C77	L62-T64 PolarHBondContact O-N 3.01Å; T64-P76 HydrophobicContact CG2-CB 4.18Å; T64-C77 CarbonylContact C-O 3.54Å; T64-C77 VanDerWaalsContact CA-O 3.3Å; T64-C77 WeakPolarHBondContact CA-O 3.48Å; T64-C77 VanDerWaalsContact CB-O 3.3Å; T64-C77 WeakPolarHBondContact CB-O 3.28Å
65	D	90.4	Very high	90.7	Very high	76 Å²	76	68.3 Å²	68.3	41%	0.406	34%	0.342	S	S	.	.			trans	-115	5.1	-172.7	63.7	-15	0	0	0	113.4	F63 C77 H78 R79	F63-D65 PolarHBondContact O-N 3.1Å; D65-C77 PolarHBondContact N-O 3.38Å; D65-H78 VanDerWaalsContact OD1-CA 3.27Å; D65-H78 WeakPolarHBondContact OD1-CA 3.3Å; D65-R79 PolarHBondContact O-NE 2.69Å; D65-R79 WeakPolarHBondContact OD1-CG 3.27Å; D65-R79 PolarHBondContact OD1-N 2.88Å; D65-R79 WeakPolarHBondContact OD2-CB 3.43Å; D65-R79 WeakPolarHBondContact OD2-CD 3.31Å
66	V	91.1	Very high	90.8	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.9	169.9	66.2	0	0	0	0	111.1	C77 R79 L82 F93 M103 V105	V66-C77 HydrophobicContact CG1-CB 4.02Å; V66-C77 PolarHBondContact N-O 3.45Å; V66-C77 PolarHBondContact O-N 2.97Å; V66-R79 HydrophobicContact CB-CG 3.74Å; V66-R79 HydrophobicContact CG1-CG 3.63Å; V66-L82 HydrophobicContact CG1-CD1 3.96Å; V66-F93 HydrophobicContact CG1-CZ 4.39Å; V66-F93 HydrophobicContact CG2-CE1 4.24Å; V66-F93 HydrophobicContact CG2-CZ 4.04Å; V66-M103 CarbonylContact C-O 3.58Å; V66-V105 HydrophobicContact CG2-CB 4.49Å; V66-V105 HydrophobicContact CG2-CG2 3.9Å
67	V	92	Very high	91	Very high	24 Å²	24	63.3 Å²	63.3	15%	0.145	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120	169.9	-176.9	0	0	0	0	107.6	E74 P76 M103 L104 V105	V67-E74 HydrophobicContact CG1-CB 3.72Å; V67-E74 HydrophobicContact CG1-CG 4.05Å; V67-P76 HydrophobicContact CG2-CB 4.41Å; V67-M103 PolarHBondContact N-O 3.31Å; V67-L104 HydrophobicContact CB-CD1 3.94Å; V67-L104 HydrophobicContact CG1-CD1 3.76Å; V67-L104 CarbonylContact O-C 3.59Å; V67-L104 WeakPolarHBondContact O-CA 3.49Å; V67-V105 PolarHBondContact O-N 3.43Å
68	I	91.8	Very high	91	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.3	174.3	-60.8	176.5	0	0	0	108.3	V70 F75 L82 F89 V105 I107 M115	I68-V70 HydrophobicContact CG2-CG2 4.04Å; I68-F75 HydrophobicContact CB-CB 4.46Å; I68-F75 PolarHBondContact N-O 2.94Å; I68-F75 PolarHBondContact O-N 3.4Å; I68-L82 HydrophobicContact CD1-CD1 3.8Å; I68-L82 HydrophobicContact CD1-CD2 4.41Å; I68-F89 HydrophobicContact CD1-CE1 3.79Å; I68-F89 HydrophobicContact CD1-CZ 3.83Å; I68-V105 CarbonylContact C-O 3.56Å; I68-V105 WeakPolarHBondContact CA-O 3.16Å; I68-I107 HydrophobicContact CG2-CD1 3.66Å; I68-I107 HydrophobicContact CG2-CG1 4.01Å; I68-M115 HydrophobicContact CG2-CE 3.77Å; I68-M115 HydrophobicContact CG2-SD 4.32Å
69	S	91.9	Very high	90.9	Very high	13 Å²	13	61.5 Å²	61.5	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.1	173.6	-175.5	0	0	0	0	110.4	R73 V105 E106 I107	S69-R73 WeakPolarHBondContact CA-O 3.4Å; S69-V105 PolarHBondContact N-O 3.21Å; S69-E106 WeakPolarHBondContact O-CA 3.45Å; S69-I107 PolarHBondContact O-N 3.5Å
70	V	91.3	Very high	90.9	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	122.2	174.5	-179.3	0	0	0	0	108.9	I68 G72 R73 F75 I107 I110 A112 M115	I68-V70 HydrophobicContact CG2-CG2 4.04Å; V70-G72 PolarHBondContact O-N 3.34Å; V70-G72 VanDerWaalsContact O-N 3.15Å; V70-R73 PolarHBondContact N-O 3.08Å; V70-R73 PolarHBondContact O-N 3.02Å; V70-F75 HydrophobicContact CB-CE2 4.31Å; V70-I107 HydrophobicContact CG2-CB 4.26Å; V70-I110 HydrophobicContact CG1-CB 4.15Å; V70-I110 WeakPolarHBondContact CG1-O 3.33Å; V70-A112 HydrophobicContact CG1-CB 4.39Å; V70-M115 HydrophobicContact CB-CB 4.47Å; V70-M115 HydrophobicContact CG2-CB 4.07Å; V70-M115 HydrophobicContact CG2-CE 3.72Å; V70-M115 HydrophobicContact CG2-CG 3.93Å
71	Q	88.6	Confident	91	Very high	137 Å²	137	56.5 Å²	56.5	64%	0.64	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	35.7	-178.1	-61.3	176.5	-33.7	0	0	113.3	R73 A112	Q71-R73 VanDerWaalsContact C-N 3.28Å; Q71-R73 PolarHBondContact O-N 3.46Å; Q71-A112 HydrophobicContact CB-CB 4.5Å
72	G	84.3	Confident	91	Very high	67 Å²	67	48.4 Å²	48.4	69%	0.691	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	8.4	-177	0	0	0	0	0	115.5	V70	V70-G72 PolarHBondContact O-N 3.34Å; V70-G72 VanDerWaalsContact O-N 3.15Å
73	R	92.3	Very high	91.1	Very high	138 Å²	138	45.8 Å²	45.8	52%	0.521	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.5	167.1	-65	-161.8	-173.9	179.7	-3.7	110.7	S69 V70 Q71 F75 A112	S69-R73 WeakPolarHBondContact CA-O 3.4Å; V70-R73 PolarHBondContact N-O 3.08Å; V70-R73 PolarHBondContact O-N 3.02Å; Q71-R73 VanDerWaalsContact C-N 3.28Å; Q71-R73 PolarHBondContact O-N 3.46Å; R73-F75 HydrophobicContact CB-CE2 3.81Å; R73-F75 HydrophobicContact CB-CZ 4.11Å; R73-A112 HydrophobicContact CB-CB 4.19Å; R73-A112 HydrophobicContact CG-CB 4.11Å
74	E	93.1	Very high	91.1	Very high	120 Å²	120	42.7 Å²	42.7	56%	0.561	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.2	179.4	-68.6	-179.5	174.4	0	0	112	V67	V67-E74 HydrophobicContact CG1-CB 3.72Å; V67-E74 HydrophobicContact CG1-CG 4.05Å
75	F	93.3	Very high	91.1	Very high	18 Å²	18	43.7 Å²	43.7	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	96.2	178.9	-61.3	-85.9	0	0	0	110.1	I68 V70 R73 C77 A112 M115 E116 L119	I68-F75 HydrophobicContact CB-CB 4.46Å; I68-F75 PolarHBondContact N-O 2.94Å; I68-F75 PolarHBondContact O-N 3.4Å; V70-F75 HydrophobicContact CB-CE2 4.31Å; R73-F75 HydrophobicContact CB-CE2 3.81Å; R73-F75 HydrophobicContact CB-CZ 4.11Å; F75-C77 PolarHBondContact O-N 3.08Å; F75-C77 PolarHBondContact O-SG 2.93Å; F75-A112 HydrophobicContact CE2-CB 4.35Å; F75-A112 HydrophobicContact CZ-CB 4.25Å; F75-A112 WeakPolarHBondContact CZ-O 3.3Å; F75-M115 HydrophobicContact CD2-CG 3.76Å; F75-M115 HydrophobicContact CE2-CB 4.19Å; F75-M115 HydrophobicContact CE2-CG 3.83Å; F75-M115 HydrophobicContact CG-CG 4.16Å; F75-M115 HydrophobicContact CZ-CB 4.4Å; F75-M115 HydrophobicContact CZ-CG 4.27Å; F75-E116 HydrophobicContact CE1-CB 4Å; F75-E116 HydrophobicContact CE1-CG 4.43Å; F75-E116 HydrophobicContact CZ-CB 4.41Å; F75-L119 HydrophobicContact CB-CD1 3.57Å; F75-L119 HydrophobicContact CD1-CD1 3.84Å; F75-L119 HydrophobicContact CG-CD1 3.84Å
76	P	93.1	Very high	91.1	Very high	22 Å²	22	40.2 Å²	40.2	14%	0.143	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.8	174	29	-33.9	0	0	0	109.9	R58 R61 T64 V67	R58-P76 WeakPolarHBondContact CG-O 3.19Å; R61-P76 HydrophobicContact CG-CG 4.06Å; T64-P76 HydrophobicContact CG2-CB 4.18Å; V67-P76 HydrophobicContact CG2-CB 4.41Å
77	C	93.9	Very high	91.1	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	175	-170.9	-63.3	0	0	0	0	111.3	T64 D65 V66 F75 L82 L119	T64-C77 CarbonylContact C-O 3.54Å; T64-C77 VanDerWaalsContact CA-O 3.3Å; T64-C77 WeakPolarHBondContact CA-O 3.48Å; T64-C77 VanDerWaalsContact CB-O 3.3Å; T64-C77 WeakPolarHBondContact CB-O 3.28Å; D65-C77 PolarHBondContact N-O 3.38Å; V66-C77 HydrophobicContact CG1-CB 4.02Å; V66-C77 PolarHBondContact N-O 3.45Å; V66-C77 PolarHBondContact O-N 2.97Å; F75-C77 PolarHBondContact O-N 3.08Å; F75-C77 PolarHBondContact O-SG 2.93Å; C77-L82 HydrophobicContact CB-CD1 3.79Å; C77-L82 HydrophobicContact CB-CG 4.43Å; C77-L119 VanDerWaalsContact SG-CD2 3.56Å
78	H	93.2	Very high	91	Very high	10 Å²	10	44.8 Å²	44.8	5%	0.046	26%	0.264	C	S	.	.			trans	-112.1	119.4	174.3	-54.2	81.7	0	0	0	110	L62 F63 D65 A80 V81 L82 Y123	L62-H78 PolarHBondContact O-NE2 3.16Å; L62-H78 VanDerWaalsContact O-NE2 3.16Å; F63-H78 PolarHBondContact O-CD2 3.14Å; F63-H78 VanDerWaalsContact O-CD2 3.3Å; D65-H78 VanDerWaalsContact OD1-CA 3.27Å; D65-H78 WeakPolarHBondContact OD1-CA 3.3Å; H78-A80 VanDerWaalsContact C-N 3.26Å; H78-A80 PolarHBondContact O-N 3.11Å; H78-V81 HydrophobicContact CB-CB 4.33Å; H78-V81 HydrophobicContact CB-CG2 3.89Å; H78-V81 PolarHBondContact O-N 3.26Å; H78-V81 VanDerWaalsContact O-N 3.11Å; H78-L82 PolarHBondContact O-N 3.14Å; H78-L82 VanDerWaalsContact O-N 3.14Å; H78-Y123 VanDerWaalsContact CB-OH 3.29Å; H78-Y123 WeakPolarHBondContact CB-OH 3.27Å; H78-Y123 PolarHBondContact N-OH 3.43Å; H78-Y123 AromaticContact ND1-CE1 3.73Å; H78-Y123 AromaticContact ND1-CZ 3.72Å; H78-Y123 PolarHBondContact ND1-OH 3.07Å
79	R	90.5	Very high	90.9	Very high	38 Å²	38	44.8 Å²	44.8	14%	0.143	26%	0.264	C	S	.	.	H	α-helix	trans	-54	-42.4	179.6	-68.7	170.6	165.7	-115.2	-8.8	111.6	D65 V66 V81 L82 C83 F93 E99 S100 E102	D65-R79 PolarHBondContact O-NE 2.69Å; D65-R79 WeakPolarHBondContact OD1-CG 3.27Å; D65-R79 PolarHBondContact OD1-N 2.88Å; D65-R79 WeakPolarHBondContact OD2-CB 3.43Å; D65-R79 WeakPolarHBondContact OD2-CD 3.31Å; V66-R79 HydrophobicContact CB-CG 3.74Å; V66-R79 HydrophobicContact CG1-CG 3.63Å; R79-V81 VanDerWaalsContact C-N 3.35Å; R79-V81 PolarHBondContact O-N 2.91Å; R79-L82 PolarHBondContact O-N 3.18Å; R79-C83 WeakPolarHBondContact O-CB 3.47Å; R79-C83 PolarHBondContact O-N 3.29Å; R79-C83 PolarHBondContact O-SG 3.42Å; R79-F93 HydrophobicContact CB-CD2 4.23Å; R79-F93 HydrophobicContact CB-CE2 4.4Å; R79-F93 HydrophobicContact CG-CD2 4.21Å; R79-F93 HydrophobicContact CG-CE1 4.44Å; R79-F93 HydrophobicContact CG-CE2 4.12Å; R79-F93 HydrophobicContact CG-CG 4.43Å; R79-F93 HydrophobicContact CG-CZ 4.25Å; R79-E99 PolarHBondContact NH2-O 2.8Å; R79-S100 PolarHBondContact NH1-O 3.18Å; R79-S100 PolarHBondContact NH2-O 3.43Å; R79-E102 PolarHBondContact NH2-O 3.34Å
80	A	89.6	Confident	90.7	Very high	74 Å²	74	50.1 Å²	50.1	61%	0.612	29%	0.285	S	S	*	.	H	α-helix	trans	-58.4	-42.4	178.9	0	0	0	0	0	113.2	H78 A84	H78-A80 VanDerWaalsContact C-N 3.26Å; H78-A80 PolarHBondContact O-N 3.11Å; A80-A84 WeakPolarHBondContact O-CB 3.34Å; A80-A84 PolarHBondContact O-N 3.04Å
81	V	91.7	Very high	90.4	Very high	15 Å²	15	52.2 Å²	52.2	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-72.6	-41.3	-179.6	-173.8	0	0	0	0	110.5	F54 H78 R79 A84 C85 V122 Y123	F54-V81 HydrophobicContact CD1-CG2 4.44Å; F54-V81 HydrophobicContact CG-CG2 4.38Å; H78-V81 HydrophobicContact CB-CB 4.33Å; H78-V81 HydrophobicContact CB-CG2 3.89Å; H78-V81 PolarHBondContact O-N 3.26Å; H78-V81 VanDerWaalsContact O-N 3.11Å; R79-V81 VanDerWaalsContact C-N 3.35Å; R79-V81 PolarHBondContact O-N 2.91Å; V81-A84 PolarHBondContact O-N 3.47Å; V81-C85 PolarHBondContact O-N 3.24Å; V81-C85 VanDerWaalsContact O-N 3.12Å; V81-V122 HydrophobicContact CG1-CG1 3.71Å; V81-Y123 HydrophobicContact CB-CE1 4.13Å; V81-Y123 HydrophobicContact CG1-CD1 4.24Å; V81-Y123 HydrophobicContact CG1-CE1 3.88Å; V81-Y123 HydrophobicContact CG1-CE2 4.28Å; V81-Y123 HydrophobicContact CG2-CE1 4.03Å
82	L	91.4	Very high	90.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-47.3	174.4	-68	168.7	0	0	0	111.9	V66 I68 C77 H78 R79 A84 C85 S86 F89 F93 F118 L119 V122	V66-L82 HydrophobicContact CG1-CD1 3.96Å; I68-L82 HydrophobicContact CD1-CD1 3.8Å; I68-L82 HydrophobicContact CD1-CD2 4.41Å; C77-L82 HydrophobicContact CB-CD1 3.79Å; C77-L82 HydrophobicContact CB-CG 4.43Å; H78-L82 PolarHBondContact O-N 3.14Å; H78-L82 VanDerWaalsContact O-N 3.14Å; R79-L82 PolarHBondContact O-N 3.18Å; L82-A84 VanDerWaalsContact C-N 3.29Å; L82-A84 PolarHBondContact O-N 2.93Å; L82-C85 PolarHBondContact O-N 2.86Å; L82-S86 WeakPolarHBondContact O-CB 3.47Å; L82-S86 PolarHBondContact O-N 3.04Å; L82-F89 HydrophobicContact CB-CB 3.94Å; L82-F89 HydrophobicContact CB-CD2 4.31Å; L82-F89 HydrophobicContact CB-CG 4.02Å; L82-F89 HydrophobicContact CD2-CD2 4.27Å; L82-F89 HydrophobicContact CD2-CE2 4.33Å; L82-F93 HydrophobicContact CB-CE2 4.45Å; L82-F93 HydrophobicContact CD1-CE2 4.18Å; L82-F118 HydrophobicContact CD2-CE1 4.14Å; L82-L119 HydrophobicContact CD2-CD2 3.78Å; L82-V122 HydrophobicContact CD2-CG1 4.49Å
83	C	90.6	Very high	90.3	Very high	28 Å²	28	44.5 Å²	44.5	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-31.2	175.8	-73	0	0	0	0	113.8	R79 K90	R79-C83 WeakPolarHBondContact O-CB 3.47Å; R79-C83 PolarHBondContact O-N 3.29Å; R79-C83 PolarHBondContact O-SG 3.42Å; C83-K90 HydrophobicContact CB-CB 4.28Å
84	A	89.8	Confident	89.7	Confident	89 Å²	89	42.4 Å²	42.4	74%	0.736	25%	0.254	S	S	*	.	H	α-helix	trans	-73.3	-35.7	177.9	0	0	0	0	0	112	A80 V81 L82	A80-A84 WeakPolarHBondContact O-CB 3.34Å; A80-A84 PolarHBondContact O-N 3.04Å; V81-A84 PolarHBondContact O-N 3.47Å; L82-A84 VanDerWaalsContact C-N 3.29Å; L82-A84 PolarHBondContact O-N 2.93Å
85	C	88.6	Confident	88.7	Confident	48 Å²	48	40.6 Å²	40.6	32%	0.324	25%	0.248	S	C	.	.	H	α-helix	trans	-89.5	-28	-177.9	-160.5	0	0	0	0	113.6	V81 L82 V122	V81-C85 PolarHBondContact O-N 3.24Å; V81-C85 VanDerWaalsContact O-N 3.12Å; L82-C85 PolarHBondContact O-N 2.86Å; C85-V122 HydrophobicContact CB-CG1 4.05Å; C85-V122 HydrophobicContact CB-CG2 4.11Å
86	S	92.1	Very high	87.4	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.021	28%	0.279	C	S	.	.			trans	-133.4	125.2	-171.4	172.2	0	0	0	0	113.1	L82 Y88 F89 K90 F144	L82-S86 WeakPolarHBondContact O-CB 3.47Å; L82-S86 PolarHBondContact O-N 3.04Å; S86-Y88 VanDerWaalsContact C-N 3.27Å; S86-Y88 PolarHBondContact O-N 3.37Å; S86-Y88 WeakPolarHBondContact OG-CB 3.48Å; S86-Y88 PolarHBondContact OG-N 3Å; S86-F89 PolarHBondContact O-N 2.76Å; S86-F89 PolarHBondContact OG-N 3.11Å; S86-K90 WeakPolarHBondContact O-CB 3.46Å; S86-K90 PolarHBondContact O-N 3.42Å; S86-F144 WeakPolarHBondContact CB-O 3.31Å; S86-F144 PolarHBondContact OG-O 2.84Å
87	S	89.4	Confident	86.1	Confident	58 Å²	58	49.8 Å²	49.8	41%	0.406	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-26.8	171.5	43.9	0	0	0	0	113.3	A91 Q145	S87-A91 WeakPolarHBondContact O-CB 3.29Å; S87-A91 PolarHBondContact O-N 2.79Å; S87-Q145 VanDerWaalsContact OG-CB 3.28Å; S87-Q145 WeakPolarHBondContact OG-CB 3.35Å; S87-Q145 PolarHBondContact OG-OE1 3.32Å
88	Y	90.1	Very high	84.7	Confident	63 Å²	63	58.5 Å²	58.5	25%	0.247	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-53.4	173.5	173.3	-91.2	0	0	0	110.9	S86 K90 A91 M92 L143 F144	S86-Y88 VanDerWaalsContact C-N 3.27Å; S86-Y88 PolarHBondContact O-N 3.37Å; S86-Y88 WeakPolarHBondContact OG-CB 3.48Å; S86-Y88 PolarHBondContact OG-N 3Å; Y88-K90 VanDerWaalsContact C-N 3.31Å; Y88-K90 PolarHBondContact O-N 3.16Å; Y88-A91 PolarHBondContact O-N 3.31Å; Y88-M92 HydrophobicContact CE1-CE 3.51Å; Y88-M92 HydrophobicContact CE1-SD 4.47Å; Y88-M92 WeakPolarHBondContact O-CB 3.4Å; Y88-M92 PolarHBondContact O-N 3.4Å; Y88-M92 VanDerWaalsContact OH-CE 3.28Å; Y88-M92 WeakPolarHBondContact OH-CE 3.32Å; Y88-L143 HydrophobicContact CE2-CD1 4.49Å; Y88-F144 AromaticContact CD1-CD1 3.49Å; Y88-F144 HydrophobicContact CD1-CD1 3.49Å; Y88-F144 VanDerWaalsContact CD1-CD1 3.49Å; Y88-F144 AromaticContact CD1-CE1 3.91Å; Y88-F144 HydrophobicContact CD1-CE1 3.91Å; Y88-F144 AromaticContact CE1-CD1 3.78Å; Y88-F144 HydrophobicContact CE1-CD1 3.78Å; Y88-F144 AromaticContact CE1-CE1 3.7Å; Y88-F144 HydrophobicContact CE1-CE1 3.7Å; Y88-F144 HydrophobicContact CG-CD1 4.05Å
89	F	89.7	Confident	83.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-35.6	177.7	-75.2	-68.7	0	0	0	112.2	I68 L82 S86 A91 M92 F93 I107 F118 F144	I68-F89 HydrophobicContact CD1-CE1 3.79Å; I68-F89 HydrophobicContact CD1-CZ 3.83Å; L82-F89 HydrophobicContact CB-CB 3.94Å; L82-F89 HydrophobicContact CB-CD2 4.31Å; L82-F89 HydrophobicContact CB-CG 4.02Å; L82-F89 HydrophobicContact CD2-CD2 4.27Å; L82-F89 HydrophobicContact CD2-CE2 4.33Å; S86-F89 PolarHBondContact O-N 2.76Å; S86-F89 PolarHBondContact OG-N 3.11Å; F89-A91 PolarHBondContact O-N 2.93Å; F89-M92 HydrophobicContact CD1-SD 4.08Å; F89-M92 HydrophobicContact CE1-SD 4.25Å; F89-M92 PolarHBondContact O-N 3.31Å; F89-F93 HydrophobicContact CB-CD2 4.17Å; F89-F93 HydrophobicContact CB-CE2 4.02Å; F89-F93 HydrophobicContact CD1-CD2 4.47Å; F89-F93 AromaticContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD1-CE2 3.64Å; F89-F93 AromaticContact CD1-CZ 3.98Å; F89-F93 HydrophobicContact CD1-CZ 3.98Å; F89-F93 HydrophobicContact CG-CE2 4.24Å; F89-F93 WeakPolarHBondContact O-CD2 3.38Å; F89-F93 PolarHBondContact O-N 3.24Å; F89-I107 HydrophobicContact CE1-CD1 3.79Å; F89-I107 HydrophobicContact CZ-CD1 3.72Å; F89-F118 HydrophobicContact CD2-CZ 4.19Å; F89-F118 AromaticContact CE2-CE1 3.77Å; F89-F118 HydrophobicContact CE2-CE1 3.77Å; F89-F118 AromaticContact CE2-CZ 3.71Å; F89-F118 HydrophobicContact CE2-CZ 3.71Å; F89-F144 HydrophobicContact CD2-CD1 4.49Å; F89-F144 HydrophobicContact CE2-CB 4.5Å; F89-F144 AromaticContact CE2-CD1 3.7Å; F89-F144 HydrophobicContact CE2-CD1 3.7Å; F89-F144 HydrophobicContact CE2-CD2 4.15Å; F89-F144 AromaticContact CE2-CE1 3.82Å; F89-F144 HydrophobicContact CE2-CE1 3.82Å; F89-F144 HydrophobicContact CE2-CE2 4.23Å; F89-F144 AromaticContact CE2-CG 3.87Å; F89-F144 HydrophobicContact CE2-CG 3.87Å; F89-F144 HydrophobicContact CE2-CZ 4.07Å; F89-F144 HydrophobicContact CZ-CD1 4.06Å; F89-F144 AromaticContact CZ-CE1 3.69Å; F89-F144 HydrophobicContact CZ-CE1 3.69Å; F89-F144 HydrophobicContact CZ-CE2 4.37Å; F89-F144 AromaticContact CZ-CZ 3.85Å; F89-F144 HydrophobicContact CZ-CZ 3.85Å
90	K	87.6	Confident	82.6	Confident	124 Å²	124	60.9 Å²	60.9	54%	0.539	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-44.9	171.5	-169.1	176	-179.1	176.4	0	112.4	C83 S86 Y88 C94	C83-K90 HydrophobicContact CB-CB 4.28Å; S86-K90 WeakPolarHBondContact O-CB 3.46Å; S86-K90 PolarHBondContact O-N 3.42Å; Y88-K90 VanDerWaalsContact C-N 3.31Å; Y88-K90 PolarHBondContact O-N 3.16Å; K90-C94 WeakPolarHBondContact O-CB 3.49Å; K90-C94 PolarHBondContact O-N 3.29Å; K90-C94 PolarHBondContact O-SG 3.32Å; K90-C94 VanDerWaalsContact O-SG 3.37Å
91	A	86.3	Confident	81.7	Confident	45 Å²	45	66.6 Å²	66.6	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-37.2	176.3	0	0	0	0	0	112.5	S87 Y88 F89 N95	S87-A91 WeakPolarHBondContact O-CB 3.29Å; S87-A91 PolarHBondContact O-N 2.79Å; Y88-A91 PolarHBondContact O-N 3.31Å; F89-A91 PolarHBondContact O-N 2.93Å; A91-N95 VanDerWaalsContact O-CB 3.3Å; A91-N95 WeakPolarHBondContact O-CB 3.4Å; A91-N95 VanDerWaalsContact O-CG 3.27Å; A91-N95 PolarHBondContact O-N 3.16Å; A91-N95 PolarHBondContact O-ND2 3.23Å
92	M	85.3	Confident	81.2	Confident	20 Å²	20	69.4 Å²	69.4	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-64.3	-43.7	177.3	178	-177.6	-82	0	0	112.6	Y88 F89 E99 V105	Y88-M92 HydrophobicContact CE1-CE 3.51Å; Y88-M92 HydrophobicContact CE1-SD 4.47Å; Y88-M92 WeakPolarHBondContact O-CB 3.4Å; Y88-M92 PolarHBondContact O-N 3.4Å; Y88-M92 VanDerWaalsContact OH-CE 3.28Å; Y88-M92 WeakPolarHBondContact OH-CE 3.32Å; F89-M92 HydrophobicContact CD1-SD 4.08Å; F89-M92 HydrophobicContact CE1-SD 4.25Å; F89-M92 PolarHBondContact O-N 3.31Å; M92-E99 HydrophobicContact CG-CB 3.86Å; M92-E99 HydrophobicContact CG-CG 4.46Å; M92-E99 HydrophobicContact SD-CB 4.4Å; M92-V105 HydrophobicContact CE-CG1 4.28Å; M92-V105 HydrophobicContact SD-CG1 3.87Å
93	F	85.6	Confident	80.7	Confident	21 Å²	21	75.3 Å²	75.3	9%	0.092	39%	0.389	C	S	.	.	H	α-helix	trans	-93.2	-21.8	-173.9	-61.3	-47.2	0	0	0	114.7	V66 R79 L82 F89 V105	V66-F93 HydrophobicContact CG1-CZ 4.39Å; V66-F93 HydrophobicContact CG2-CE1 4.24Å; V66-F93 HydrophobicContact CG2-CZ 4.04Å; R79-F93 HydrophobicContact CB-CD2 4.23Å; R79-F93 HydrophobicContact CB-CE2 4.4Å; R79-F93 HydrophobicContact CG-CD2 4.21Å; R79-F93 HydrophobicContact CG-CE1 4.44Å; R79-F93 HydrophobicContact CG-CE2 4.12Å; R79-F93 HydrophobicContact CG-CG 4.43Å; R79-F93 HydrophobicContact CG-CZ 4.25Å; L82-F93 HydrophobicContact CB-CE2 4.45Å; L82-F93 HydrophobicContact CD1-CE2 4.18Å; F89-F93 HydrophobicContact CB-CD2 4.17Å; F89-F93 HydrophobicContact CB-CE2 4.02Å; F89-F93 HydrophobicContact CD1-CD2 4.47Å; F89-F93 AromaticContact CD1-CE2 3.64Å; F89-F93 HydrophobicContact CD1-CE2 3.64Å; F89-F93 AromaticContact CD1-CZ 3.98Å; F89-F93 HydrophobicContact CD1-CZ 3.98Å; F89-F93 HydrophobicContact CG-CE2 4.24Å; F89-F93 WeakPolarHBondContact O-CD2 3.38Å; F89-F93 PolarHBondContact O-N 3.24Å; F93-V105 HydrophobicContact CE1-CG2 4.22Å
94	C	79.8	Confident	80.6	Confident	94 Å²	94	78.1 Å²	78.1	64%	0.635	40%	0.402	S	S	*	.	H	α-helix	trans	-96.7	-17.5	180	-61.4	0	0	0	0	114.7	K90	K90-C94 WeakPolarHBondContact O-CB 3.49Å; K90-C94 PolarHBondContact O-N 3.29Å; K90-C94 PolarHBondContact O-SG 3.32Å; K90-C94 VanDerWaalsContact O-SG 3.37Å
95	N	71.3	Confident	80.5	Confident	82 Å²	82	74.1 Å²	74.1	44%	0.439	37%	0.368	S	S	.	.	S	Bend	trans	-84.6	153.7	169.6	-63.8	-26.4	0	0	0	109.5	A91 H97	A91-N95 VanDerWaalsContact O-CB 3.3Å; A91-N95 WeakPolarHBondContact O-CB 3.4Å; A91-N95 VanDerWaalsContact O-CG 3.27Å; A91-N95 PolarHBondContact O-N 3.16Å; A91-N95 PolarHBondContact O-ND2 3.23Å; N95-H97 PolarHBondContact O-N 3.15Å
96	D	64.9	Low	80.5	Confident	136 Å²	136	78 Å²	78	73%	0.727	38%	0.381	S	S	*	.	S	Bend	trans	-70.6	34.3	-177.9	-108	-48.2	0	0	0	114.1	R101	D96-R101 IonicContact OD1-CZ 3.65Å; D96-R101 IonicContact OD1-NH2 3.78Å; D96-R101 PolarHBondContact OD1-NH2 3.12Å
97	H	67.8	Low	80.3	Confident	98 Å²	98	78.2 Å²	78.2	45%	0.454	38%	0.383	S	S	.	.			trans	-75.5	165.7	175.9	-58.2	167.5	0	0	0	111.4	N95 E99 S100	N95-H97 PolarHBondContact O-N 3.15Å; H97-E99 VanDerWaalsContact C-N 3.33Å; H97-E99 WeakPolarHBondContact CB-OE2 3.33Å; H97-E99 PolarHBondContact O-N 2.76Å; H97-S100 VanDerWaalsContact O-CB 3.31Å; H97-S100 WeakPolarHBondContact O-CB 3.21Å; H97-S100 PolarHBondContact O-N 2.87Å; H97-S100 PolarHBondContact O-OG 2.89Å
98	R	63.8	Low	80.1	Confident	183 Å²	183	81.4 Å²	81.4	69%	0.691	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-66.3	-37.9	-173.9	-176.4	174.3	170.2	176.1	-6.7	112.1	S100 R101 E102	R98-S100 PolarHBondContact O-N 3.36Å; R98-R101 PolarHBondContact O-N 3.42Å; R98-E102 HydrophobicContact CG-CG 4.42Å; R98-E102 IonicContact CZ-OE1 2.73Å; R98-E102 VanDerWaalsContact CZ-OE1 3.27Å; R98-E102 IonicContact NE-OE1 2.76Å; R98-E102 PolarHBondContact NE-OE1 2.67Å; R98-E102 IonicContact NE-OE2 3.4Å; R98-E102 IonicContact NH2-OE1 3.63Å; R98-E102 PolarHBondContact NH2-OE1 2.98Å; R98-E102 PolarHBondContact O-N 2.98Å
99	E	70.6	Confident	79.8	Confident	73 Å²	73	82.4 Å²	82.4	34%	0.341	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-60.9	-23.4	176.3	-58	85	164.6	0	0	112.4	R79 M92 H97 R101 V105	R79-E99 PolarHBondContact NH2-O 2.8Å; M92-E99 HydrophobicContact CG-CB 3.86Å; M92-E99 HydrophobicContact CG-CG 4.46Å; M92-E99 HydrophobicContact SD-CB 4.4Å; H97-E99 VanDerWaalsContact C-N 3.33Å; H97-E99 WeakPolarHBondContact CB-OE2 3.33Å; H97-E99 PolarHBondContact O-N 2.76Å; E99-R101 PolarHBondContact O-N 3.19Å; E99-V105 HydrophobicContact CB-CG2 4.41Å; E99-V105 HydrophobicContact CG-CG1 4.47Å
100	S	68.9	Low	79.7	Confident	25 Å²	25	82.9 Å²	82.9	18%	0.175	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-63.7	-23.6	172.7	74.2	0	0	0	0	112.4	R79 H97 R98	R79-S100 PolarHBondContact NH1-O 3.18Å; R79-S100 PolarHBondContact NH2-O 3.43Å; H97-S100 VanDerWaalsContact O-CB 3.31Å; H97-S100 WeakPolarHBondContact O-CB 3.21Å; H97-S100 PolarHBondContact O-N 2.87Å; H97-S100 PolarHBondContact O-OG 2.89Å; R98-S100 PolarHBondContact O-N 3.36Å
101	R	70.3	Confident	79.7	Confident	194 Å²	194	80.9 Å²	80.9	73%	0.732	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-12.4	-175.1	-54.2	-179	-168.4	179.2	3.3	114.2	D96 R98 E99	D96-R101 IonicContact OD1-CZ 3.65Å; D96-R101 IonicContact OD1-NH2 3.78Å; D96-R101 PolarHBondContact OD1-NH2 3.12Å; R98-R101 PolarHBondContact O-N 3.42Å; E99-R101 PolarHBondContact O-N 3.19Å
102	E	80.8	Confident	79.9	Confident	73 Å²	73	79 Å²	79	34%	0.341	40%	0.403	S	S	.	.			trans	-89.8	136.8	179.2	-69.9	-177.6	163.9	0	0	111.7	R79 R98	R79-E102 PolarHBondContact NH2-O 3.34Å; R98-E102 HydrophobicContact CG-CG 4.42Å; R98-E102 IonicContact CZ-OE1 2.73Å; R98-E102 VanDerWaalsContact CZ-OE1 3.27Å; R98-E102 IonicContact NE-OE1 2.76Å; R98-E102 PolarHBondContact NE-OE1 2.67Å; R98-E102 IonicContact NE-OE2 3.4Å; R98-E102 IonicContact NH2-OE1 3.63Å; R98-E102 PolarHBondContact NH2-OE1 2.98Å; R98-E102 PolarHBondContact O-N 2.98Å
103	M	82	Confident	80.1	Confident	125 Å²	125	84.4 Å²	84.4	62%	0.616	43%	0.427	S	S	*	.	S	Bend	trans	-77.7	-29.8	179.2	-171.3	177.9	-174.7	0	0	112	V66 V67	V66-M103 CarbonylContact C-O 3.58Å; V67-M103 PolarHBondContact N-O 3.31Å
104	L	88.3	Confident	80.3	Confident	86 Å²	86	83.4 Å²	83.4	45%	0.45	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.3	176.3	-174.6	69.6	0	0	0	108.8	V67	V67-L104 HydrophobicContact CB-CD1 3.94Å; V67-L104 HydrophobicContact CG1-CD1 3.76Å; V67-L104 CarbonylContact O-C 3.59Å; V67-L104 WeakPolarHBondContact O-CA 3.49Å
105	V	88	Confident	80.8	Confident	5 Å²	5	79 Å²	79	3%	0.03	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	115.2	178.1	178.5	0	0	0	0	108.9	V66 V67 I68 S69 M92 F93 E99 I107	V66-V105 HydrophobicContact CG2-CB 4.49Å; V66-V105 HydrophobicContact CG2-CG2 3.9Å; V67-V105 PolarHBondContact O-N 3.43Å; I68-V105 CarbonylContact C-O 3.56Å; I68-V105 WeakPolarHBondContact CA-O 3.16Å; S69-V105 PolarHBondContact N-O 3.21Å; M92-V105 HydrophobicContact CE-CG1 4.28Å; M92-V105 HydrophobicContact SD-CG1 3.87Å; F93-V105 HydrophobicContact CE1-CG2 4.22Å; E99-V105 HydrophobicContact CB-CG2 4.41Å; E99-V105 HydrophobicContact CG-CG1 4.47Å; V105-I107 HydrophobicContact CG1-CG1 4.31Å
106	E	88.3	Confident	81.7	Confident	129 Å²	129	79 Å²	79	60%	0.603	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.2	178.3	-173.2	170.5	-142.3	0	0	110.9	S69	S69-E106 WeakPolarHBondContact O-CA 3.45Å
107	I	87	Confident	82.9	Confident	9 Å²	9	73.9 Å²	73.9	5%	0.046	37%	0.366	C	S	.	.			trans	-114.5	111.6	178.4	-55.4	-179.2	0	0	0	109.2	I68 S69 V70 F89 V105 I110 M115 F144	I68-I107 HydrophobicContact CG2-CD1 3.66Å; I68-I107 HydrophobicContact CG2-CG1 4.01Å; S69-I107 PolarHBondContact O-N 3.5Å; V70-I107 HydrophobicContact CG2-CB 4.26Å; F89-I107 HydrophobicContact CE1-CD1 3.79Å; F89-I107 HydrophobicContact CZ-CD1 3.72Å; V105-I107 HydrophobicContact CG1-CG1 4.31Å; I107-I110 HydrophobicContact CG2-CD1 3.49Å; I107-I110 VanDerWaalsContact CG2-CD1 3.49Å; I107-I110 HydrophobicContact CG2-CG1 4.16Å; I107-M115 HydrophobicContact CD1-CE 4.03Å; I107-F144 HydrophobicContact CD1-CE1 4.07Å; I107-F144 HydrophobicContact CD1-CZ 3.97Å; I107-F144 HydrophobicContact CG2-CE1 4.38Å; I107-F144 HydrophobicContact CG2-CZ 4.27Å
108	N	86.6	Confident	84	Confident	125 Å²	125	69.2 Å²	69.2	67%	0.668	35%	0.345	S	S	*	.			trans	-87.4	151.3	-179.6	-73	-63.5	0	0	0	111.8
109	G	82.3	Confident	85.3	Confident	84 Å²	84	60.5 Å²	60.5	87%	0.866	31%	0.312	S	S	*	.	S	Bend	trans	83.3	16.7	175.2	0	0	0	0	0	116
110	I	88.4	Confident	86.3	Confident	10 Å²	10	60 Å²	60	5%	0.051	31%	0.311	C	S	.	.	S	Bend	trans	-126.2	145.6	177.3	-52	179.6	0	0	0	109.5	V70 I107 A114 M115 T140 L143 F144	V70-I110 HydrophobicContact CG1-CB 4.15Å; V70-I110 WeakPolarHBondContact CG1-O 3.33Å; I107-I110 HydrophobicContact CG2-CD1 3.49Å; I107-I110 VanDerWaalsContact CG2-CD1 3.49Å; I107-I110 HydrophobicContact CG2-CG1 4.16Å; I110-A114 HydrophobicContact CG2-CB 3.94Å; I110-M115 HydrophobicContact CD1-CE 4.44Å; I110-T140 HydrophobicContact CG2-CG2 4.3Å; I110-L143 HydrophobicContact CD1-CD2 3.64Å; I110-L143 HydrophobicContact CG1-CD2 3.91Å; I110-F144 HydrophobicContact CD1-CE1 3.91Å; I110-F144 HydrophobicContact CD1-CE2 3.77Å; I110-F144 HydrophobicContact CD1-CZ 3.22Å
111	E	88.2	Confident	87.4	Confident	82 Å²	82	60.7 Å²	60.7	38%	0.383	31%	0.31	S	S	.	.			trans	-75.4	139	168	-75.8	-168.2	-142.9	0	0	112.1	K113 A114 M115	E111-K113 PolarHBondContact O-N 3.19Å; E111-K113 VanDerWaalsContact O-N 3.14Å; E111-A114 HydrophobicContact CB-CB 4.21Å; E111-A114 WeakPolarHBondContact O-CA 3.16Å; E111-A114 VanDerWaalsContact O-CB 3.31Å; E111-A114 WeakPolarHBondContact O-CB 3.28Å; E111-A114 PolarHBondContact O-N 2.95Å; E111-M115 PolarHBondContact O-N 3.09Å; E111-M115 VanDerWaalsContact O-N 3.1Å
112	A	89.9	Confident	88.4	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-29	178.6	0	0	0	0	0	113.2	V70 Q71 R73 F75 E116	V70-A112 HydrophobicContact CG1-CB 4.39Å; Q71-A112 HydrophobicContact CB-CB 4.5Å; R73-A112 HydrophobicContact CB-CB 4.19Å; R73-A112 HydrophobicContact CG-CB 4.11Å; F75-A112 HydrophobicContact CE2-CB 4.35Å; F75-A112 HydrophobicContact CZ-CB 4.25Å; F75-A112 WeakPolarHBondContact CZ-O 3.3Å; A112-E116 WeakPolarHBondContact O-CB 3.23Å; A112-E116 PolarHBondContact O-N 2.95Å
113	K	89.6	Confident	88.9	Confident	135 Å²	135	48.4 Å²	48.4	59%	0.587	26%	0.262	S	S	*	.	H	α-helix	trans	-65.2	-36.7	171.5	-67.8	178.6	-179.1	173.2	0	112.7	E111 E116 A117	E111-K113 PolarHBondContact O-N 3.19Å; E111-K113 VanDerWaalsContact O-N 3.14Å; K113-E116 PolarHBondContact O-N 3.32Å; K113-A117 PolarHBondContact O-N 3.23Å
114	A	89	Confident	89.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-70.2	-41.7	178.7	0	0	0	0	0	110.8	I110 E111 A117 F118 F136 T140	I110-A114 HydrophobicContact CG2-CB 3.94Å; E111-A114 HydrophobicContact CB-CB 4.21Å; E111-A114 WeakPolarHBondContact O-CA 3.16Å; E111-A114 VanDerWaalsContact O-CB 3.31Å; E111-A114 WeakPolarHBondContact O-CB 3.28Å; E111-A114 PolarHBondContact O-N 2.95Å; A114-A117 PolarHBondContact O-N 3.12Å; A114-F118 VanDerWaalsContact O-CB 3.31Å; A114-F118 WeakPolarHBondContact O-CB 3.08Å; A114-F118 PolarHBondContact O-N 3.5Å; A114-F136 HydrophobicContact CB-CB 4.24Å; A114-F136 HydrophobicContact CB-CD2 3.41Å; A114-F136 VanDerWaalsContact CB-CD2 3.41Å; A114-F136 HydrophobicContact CB-CE2 4.07Å; A114-F136 HydrophobicContact CB-CG 4.17Å; A114-T140 WeakPolarHBondContact CB-OG1 3.28Å
115	M	91.1	Very high	89.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-43.8	171.9	179	57.1	71.3	0	0	111.8	I68 V70 F75 I107 I110 E111 F118 L119 F144	I68-M115 HydrophobicContact CG2-CE 3.77Å; I68-M115 HydrophobicContact CG2-SD 4.32Å; V70-M115 HydrophobicContact CB-CB 4.47Å; V70-M115 HydrophobicContact CG2-CB 4.07Å; V70-M115 HydrophobicContact CG2-CE 3.72Å; V70-M115 HydrophobicContact CG2-CG 3.93Å; F75-M115 HydrophobicContact CD2-CG 3.76Å; F75-M115 HydrophobicContact CE2-CB 4.19Å; F75-M115 HydrophobicContact CE2-CG 3.83Å; F75-M115 HydrophobicContact CG-CG 4.16Å; F75-M115 HydrophobicContact CZ-CB 4.4Å; F75-M115 HydrophobicContact CZ-CG 4.27Å; I107-M115 HydrophobicContact CD1-CE 4.03Å; I110-M115 HydrophobicContact CD1-CE 4.44Å; E111-M115 PolarHBondContact O-N 3.09Å; E111-M115 VanDerWaalsContact O-N 3.1Å; M115-F118 PolarHBondContact O-N 3.4Å; M115-F118 HydrophobicContact SD-CD1 3.97Å; M115-L119 HydrophobicContact CG-CD1 4.03Å; M115-L119 HydrophobicContact CG-CG 4.42Å; M115-L119 WeakPolarHBondContact O-CG 3.18Å; M115-L119 PolarHBondContact O-N 3.39Å; M115-L119 HydrophobicContact SD-CD1 3.94Å; M115-L119 HydrophobicContact SD-CD2 4.31Å; M115-L119 HydrophobicContact SD-CG 3.87Å; M115-F144 HydrophobicContact CE-CE2 3.59Å; M115-F144 HydrophobicContact CE-CZ 3.45Å; M115-F144 VanDerWaalsContact CE-CZ 3.45Å; M115-F144 HydrophobicContact SD-CE2 4.38Å
116	E	90.4	Very high	89.2	Confident	84 Å²	84	51.1 Å²	51.1	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-60.1	-47.4	176.2	-171.3	179.1	167.9	0	0	112	F75 A112 K113 F118 L119 N120	F75-E116 HydrophobicContact CE1-CB 4Å; F75-E116 HydrophobicContact CE1-CG 4.43Å; F75-E116 HydrophobicContact CZ-CB 4.41Å; A112-E116 WeakPolarHBondContact O-CB 3.23Å; A112-E116 PolarHBondContact O-N 2.95Å; K113-E116 PolarHBondContact O-N 3.32Å; E116-F118 PolarHBondContact O-N 3.34Å; E116-L119 PolarHBondContact O-N 3.33Å; E116-N120 WeakPolarHBondContact O-CB 3.49Å; E116-N120 PolarHBondContact O-N 2.88Å; E116-N120 PolarHBondContact O-ND2 3.39Å; E116-N120 PolarHBondContact O-OD1 3.21Å
117	A	89.4	Confident	89.3	Confident	28 Å²	28	47 Å²	47	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-39.4	176	0	0	0	0	0	112.8	K113 A114 Y121 L137	K113-A117 PolarHBondContact O-N 3.23Å; A114-A117 PolarHBondContact O-N 3.12Å; A117-Y121 PolarHBondContact O-N 2.89Å; A117-L137 HydrophobicContact CB-CD1 4Å
118	F	90.9	Very high	89.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-48.6	174.3	167.6	-93.5	0	0	0	111.9	L82 F89 A114 M115 E116 N120 Y121 V122 T140 F144 I146	L82-F118 HydrophobicContact CD2-CE1 4.14Å; F89-F118 HydrophobicContact CD2-CZ 4.19Å; F89-F118 AromaticContact CE2-CE1 3.77Å; F89-F118 HydrophobicContact CE2-CE1 3.77Å; F89-F118 AromaticContact CE2-CZ 3.71Å; F89-F118 HydrophobicContact CE2-CZ 3.71Å; A114-F118 VanDerWaalsContact O-CB 3.31Å; A114-F118 WeakPolarHBondContact O-CB 3.08Å; A114-F118 PolarHBondContact O-N 3.5Å; M115-F118 PolarHBondContact O-N 3.4Å; M115-F118 HydrophobicContact SD-CD1 3.97Å; E116-F118 PolarHBondContact O-N 3.34Å; F118-N120 VanDerWaalsContact C-N 3.33Å; F118-N120 PolarHBondContact O-N 3.46Å; F118-Y121 WeakPolarHBondContact O-CA 3.4Å; F118-Y121 WeakPolarHBondContact O-CB 3.28Å; F118-Y121 PolarHBondContact O-N 2.95Å; F118-Y121 VanDerWaalsContact O-N 3.13Å; F118-V122 HydrophobicContact CD1-CG2 4.17Å; F118-V122 HydrophobicContact CD2-CG2 4.46Å; F118-V122 HydrophobicContact CE1-CG2 3.73Å; F118-V122 HydrophobicContact CE2-CG2 4.09Å; F118-V122 HydrophobicContact CZ-CG2 3.69Å; F118-V122 WeakPolarHBondContact O-CG2 3.31Å; F118-V122 PolarHBondContact O-N 2.94Å; F118-T140 HydrophobicContact CB-CG2 4.01Å; F118-T140 HydrophobicContact CD2-CG2 4.32Å; F118-T140 HydrophobicContact CG-CG2 4.3Å; F118-F144 HydrophobicContact CD1-CD2 4.03Å; F118-F144 HydrophobicContact CD1-CE2 4.07Å; F118-F144 HydrophobicContact CD2-CB 4.45Å; F118-F144 AromaticContact CD2-CD2 3.58Å; F118-F144 HydrophobicContact CD2-CD2 3.58Å; F118-F144 HydrophobicContact CD2-CE2 4.32Å; F118-F144 HydrophobicContact CD2-CG 4.48Å; F118-F144 AromaticContact CE1-CD2 3.88Å; F118-F144 HydrophobicContact CE1-CD2 3.88Å; F118-F144 HydrophobicContact CE1-CE2 4.12Å; F118-F144 HydrophobicContact CE2-CB 3.61Å; F118-F144 AromaticContact CE2-CD2 3.35Å; F118-F144 HydrophobicContact CE2-CD2 3.35Å; F118-F144 HydrophobicContact CE2-CE2 4.31Å; F118-F144 AromaticContact CE2-CG 3.86Å; F118-F144 HydrophobicContact CE2-CG 3.86Å; F118-F144 AromaticContact CG-CD2 3.9Å; F118-F144 HydrophobicContact CG-CD2 3.9Å; F118-F144 HydrophobicContact CG-CE2 4.19Å; F118-F144 HydrophobicContact CZ-CB 3.97Å; F118-F144 AromaticContact CZ-CD2 3.54Å; F118-F144 HydrophobicContact CZ-CD2 3.54Å; F118-F144 HydrophobicContact CZ-CE2 4.24Å; F118-F144 AromaticContact CZ-CG 3.97Å; F118-F144 HydrophobicContact CZ-CG 3.97Å; F118-I146 HydrophobicContact CD2-CD1 4Å; F118-I146 HydrophobicContact CE2-CD1 3.26Å; F118-I146 HydrophobicContact CE2-CG1 3.96Å; F118-I146 HydrophobicContact CZ-CD1 4.01Å
119	L	91.4	Very high	89.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.6	-38.9	179.5	-67.9	172.6	0	0	0	111.4	R58 F75 C77 L82 M115 E116 Y121 V122 Y123	R58-L119 VanDerWaalsContact NH2-CB 3.34Å; F75-L119 HydrophobicContact CB-CD1 3.57Å; F75-L119 HydrophobicContact CD1-CD1 3.84Å; F75-L119 HydrophobicContact CG-CD1 3.84Å; C77-L119 VanDerWaalsContact SG-CD2 3.56Å; L82-L119 HydrophobicContact CD2-CD2 3.78Å; M115-L119 HydrophobicContact CG-CD1 4.03Å; M115-L119 HydrophobicContact CG-CG 4.42Å; M115-L119 WeakPolarHBondContact O-CG 3.18Å; M115-L119 PolarHBondContact O-N 3.39Å; M115-L119 HydrophobicContact SD-CD1 3.94Å; M115-L119 HydrophobicContact SD-CD2 4.31Å; M115-L119 HydrophobicContact SD-CG 3.87Å; E116-L119 PolarHBondContact O-N 3.33Å; L119-Y121 VanDerWaalsContact C-N 3.27Å; L119-Y121 PolarHBondContact O-N 2.73Å; L119-V122 PolarHBondContact O-N 2.88Å; L119-Y123 WeakPolarHBondContact O-CD2 3.17Å; L119-Y123 PolarHBondContact O-N 3.29Å
120	N	90.6	Very high	90.1	Very high	62 Å²	62	48.5 Å²	48.5	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-62.7	-36.2	174	-65.8	-10	0	0	0	111.3	R58 E116 F118 T124	R58-N120 PolarHBondContact NH1-OD1 3.13Å; E116-N120 WeakPolarHBondContact O-CB 3.49Å; E116-N120 PolarHBondContact O-N 2.88Å; E116-N120 PolarHBondContact O-ND2 3.39Å; E116-N120 PolarHBondContact O-OD1 3.21Å; F118-N120 VanDerWaalsContact C-N 3.33Å; F118-N120 PolarHBondContact O-N 3.46Å; N120-T124 WeakPolarHBondContact O-CB 3.48Å; N120-T124 WeakPolarHBondContact O-CG2 3.41Å; N120-T124 PolarHBondContact O-N 2.97Å; N120-T124 PolarHBondContact O-OG1 3.02Å
121	Y	92.3	Very high	90	Very high	40 Å²	40	52.7 Å²	52.7	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-46.9	170.1	177	-100.7	0	0	0	112.8	A117 F118 L119 Y123 T124 G125 R126 A127 I146 T148 L149	A117-Y121 PolarHBondContact O-N 2.89Å; F118-Y121 WeakPolarHBondContact O-CA 3.4Å; F118-Y121 WeakPolarHBondContact O-CB 3.28Å; F118-Y121 PolarHBondContact O-N 2.95Å; F118-Y121 VanDerWaalsContact O-N 3.13Å; L119-Y121 VanDerWaalsContact C-N 3.27Å; L119-Y121 PolarHBondContact O-N 2.73Å; Y121-Y123 VanDerWaalsContact C-N 3.28Å; Y121-Y123 PolarHBondContact O-N 3Å; Y121-T124 PolarHBondContact O-N 2.88Å; Y121-G125 WeakPolarHBondContact CE2-O 3.08Å; Y121-G125 VanDerWaalsContact O-CA 3.25Å; Y121-G125 WeakPolarHBondContact O-CA 3.24Å; Y121-G125 PolarHBondContact O-N 3.49Å; Y121-R126 WeakPolarHBondContact CA-O 3.46Å; Y121-A127 HydrophobicContact CD2-CB 3.94Å; Y121-A127 HydrophobicContact CG-CB 4.43Å; Y121-I146 HydrophobicContact CD1-CD1 4.21Å; Y121-I146 HydrophobicContact CD1-CG2 4.42Å; Y121-I146 HydrophobicContact CE1-CD1 4.19Å; Y121-I146 HydrophobicContact CE1-CG2 3.68Å; Y121-T148 PolarHBondContact OH-OG1 3.37Å; Y121-L149 HydrophobicContact CD1-CD2 4.14Å; Y121-L149 HydrophobicContact CD2-CD1 4.48Å; Y121-L149 HydrophobicContact CE1-CB 4.29Å; Y121-L149 HydrophobicContact CG-CD2 4.21Å
122	V	91.9	Very high	89.9	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.048	30%	0.295	C	S	.	.	H	α-helix	trans	-57.4	-39.9	-179.9	167.6	0	0	0	0	112.1	V81 L82 C85 F118 L119 I146	V81-V122 HydrophobicContact CG1-CG1 3.71Å; L82-V122 HydrophobicContact CD2-CG1 4.49Å; C85-V122 HydrophobicContact CB-CG1 4.05Å; C85-V122 HydrophobicContact CB-CG2 4.11Å; F118-V122 HydrophobicContact CD1-CG2 4.17Å; F118-V122 HydrophobicContact CD2-CG2 4.46Å; F118-V122 HydrophobicContact CE1-CG2 3.73Å; F118-V122 HydrophobicContact CE2-CG2 4.09Å; F118-V122 HydrophobicContact CZ-CG2 3.69Å; F118-V122 WeakPolarHBondContact O-CG2 3.31Å; F118-V122 PolarHBondContact O-N 2.94Å; L119-V122 PolarHBondContact O-N 2.88Å; V122-I146 HydrophobicContact CG2-CD1 4.33Å
123	Y	91.1	Very high	89.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-93.9	-17.7	-175.8	-78.3	-89.8	0	0	0	115	F54 N55 R58 H78 V81 L119 Y121	F54-Y123 HydrophobicContact CB-CD1 4.09Å; F54-Y123 HydrophobicContact CB-CE1 4.06Å; N55-Y123 HydrophobicContact CB-CD1 4.35Å; N55-Y123 WeakPolarHBondContact OD1-CB 3.09Å; R58-Y123 HydrophobicContact CB-CE1 4.34Å; H78-Y123 VanDerWaalsContact CB-OH 3.29Å; H78-Y123 WeakPolarHBondContact CB-OH 3.27Å; H78-Y123 PolarHBondContact N-OH 3.43Å; H78-Y123 AromaticContact ND1-CE1 3.73Å; H78-Y123 AromaticContact ND1-CZ 3.72Å; H78-Y123 PolarHBondContact ND1-OH 3.07Å; V81-Y123 HydrophobicContact CB-CE1 4.13Å; V81-Y123 HydrophobicContact CG1-CD1 4.24Å; V81-Y123 HydrophobicContact CG1-CE1 3.88Å; V81-Y123 HydrophobicContact CG1-CE2 4.28Å; V81-Y123 HydrophobicContact CG2-CE1 4.03Å; L119-Y123 WeakPolarHBondContact O-CD2 3.17Å; L119-Y123 PolarHBondContact O-N 3.29Å; Y121-Y123 VanDerWaalsContact C-N 3.28Å; Y121-Y123 PolarHBondContact O-N 3Å
124	T	89.4	Confident	89.9	Confident	57 Å²	57	51.7 Å²	51.7	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-120.6	-9.6	-178.6	72.9	0	0	0	0	114.7	N120 Y121 R126	N120-T124 WeakPolarHBondContact O-CB 3.48Å; N120-T124 WeakPolarHBondContact O-CG2 3.41Å; N120-T124 PolarHBondContact O-N 2.97Å; N120-T124 PolarHBondContact O-OG1 3.02Å; Y121-T124 PolarHBondContact O-N 2.88Å; T124-R126 PolarHBondContact O-N 3.18Å; T124-R126 PolarHBondContact OG1-N 3.38Å; T124-R126 PolarHBondContact OG1-O 3.06Å
125	G	87.1	Confident	89.9	Confident	48 Å²	48	57.1 Å²	57.1	50%	0.495	30%	0.299	S	S	.	.	S	Bend	trans	68.5	3.8	-170.4	0	0	0	0	0	114.7	Y121	Y121-G125 WeakPolarHBondContact CE2-O 3.08Å; Y121-G125 VanDerWaalsContact O-CA 3.25Å; Y121-G125 WeakPolarHBondContact O-CA 3.24Å; Y121-G125 PolarHBondContact O-N 3.49Å
126	R	88.6	Confident	89.8	Confident	168 Å²	168	58.8 Å²	58.8	63%	0.634	31%	0.306	S	S	*	.			trans	-121.5	133.6	-170.6	-62.2	168.8	-167.8	-105.2	1.3	110.9	E48 Y121 T124	E48-R126 IonicContact OE1-CZ 2.67Å; E48-R126 IonicContact OE1-NE 2.98Å; E48-R126 IonicContact OE1-NH2 3.56Å; E48-R126 PolarHBondContact OE1-NH2 3.47Å; Y121-R126 WeakPolarHBondContact CA-O 3.46Å; T124-R126 PolarHBondContact O-N 3.18Å; T124-R126 PolarHBondContact OG1-N 3.38Å; T124-R126 PolarHBondContact OG1-O 3.06Å
127	A	89.4	Confident	89.9	Confident	43 Å²	43	54.9 Å²	54.9	36%	0.355	29%	0.288	S	S	.	.			trans	-132.5	139.6	174.6	0	0	0	0	0	109.9	Y121 L149	Y121-A127 HydrophobicContact CD2-CB 3.94Å; Y121-A127 HydrophobicContact CG-CB 4.43Å; A127-L149 HydrophobicContact CB-CD1 3.66Å
128	K	90.1	Very high	89.9	Confident	171 Å²	171	53.5 Å²	53.5	74%	0.743	28%	0.277	S	S	*	.			trans	-98.4	111.5	172.8	-176.2	-178.5	178.6	-176.2	0	108.8	T130 N133	K128-T130 HydrophobicContact CG-CG2 4.34Å; K128-N133 PolarHBondContact O-ND2 2.84Å
129	I	91.8	Very high	89.9	Confident	38 Å²	38	56.9 Å²	56.9	20%	0.195	29%	0.293	C	S	.	.			trans	-93.6	134.8	178	-49.3	176.9	0	0	0	108.9	N133 V134 L137 A152 F156	I129-N133 WeakPolarHBondContact CA-OD1 3.4Å; I129-V134 HydrophobicContact CG2-CB 3.89Å; I129-V134 HydrophobicContact CG2-CG2 3.88Å; I129-L137 HydrophobicContact CG1-CD2 4Å; I129-A152 HydrophobicContact CD1-CB 3.94Å; I129-F156 HydrophobicContact CB-CD2 4.32Å; I129-F156 HydrophobicContact CB-CG 4.36Å; I129-F156 HydrophobicContact CG2-CB 3.91Å; I129-F156 HydrophobicContact CG2-CD1 3.8Å; I129-F156 HydrophobicContact CG2-CD2 4.04Å; I129-F156 HydrophobicContact CG2-CE1 4.33Å; I129-F156 HydrophobicContact CG2-CG 3.63Å
130	T	90.9	Very high	89.8	Confident	41 Å²	41	57 Å²	57	25%	0.252	29%	0.294	S	S	.	.			trans	-138.9	163.3	178.3	66.4	0	0	0	0	110	K128 E132 N133 V134	K128-T130 HydrophobicContact CG-CG2 4.34Å; T130-E132 VanDerWaalsContact C-N 3.26Å; T130-E132 PolarHBondContact O-N 2.96Å; T130-N133 PolarHBondContact N-OD1 3.1Å; T130-N133 PolarHBondContact O-N 3.44Å; T130-N133 VanDerWaalsContact O-N 3.12Å; T130-N133 PolarHBondContact O-OD1 3.38Å; T130-N133 PolarHBondContact OG1-N 3.41Å; T130-N133 PolarHBondContact OG1-ND2 3.02Å; T130-V134 WeakPolarHBondContact O-CB 3.23Å; T130-V134 PolarHBondContact O-N 3.14Å
131	T	86.1	Confident	89.8	Confident	98 Å²	98	54.1 Å²	54.1	60%	0.601	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-37.5	175.8	46.1	0	0	0	0	112.9	F156	T131-F156 HydrophobicContact CG2-CE1 4.22Å; T131-F156 HydrophobicContact CG2-CZ 4.28Å
132	E	86.8	Confident	89.6	Confident	168 Å²	168	55.3 Å²	55.3	79%	0.785	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-28.2	176.5	-64.5	175.7	-172.3	0	0	113.8	T130 F136	T130-E132 VanDerWaalsContact C-N 3.26Å; T130-E132 PolarHBondContact O-N 2.96Å; E132-F136 VanDerWaalsContact O-CE1 3.28Å; E132-F136 WeakPolarHBondContact O-CE1 3.5Å
133	N	89.6	Confident	89.6	Confident	24 Å²	24	58.4 Å²	58.4	13%	0.128	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-16.7	-170.3	84.7	8.7	0	0	0	115.2	K128 I129 T130 Q135 F136 L137	K128-N133 PolarHBondContact O-ND2 2.84Å; I129-N133 WeakPolarHBondContact CA-OD1 3.4Å; T130-N133 PolarHBondContact N-OD1 3.1Å; T130-N133 PolarHBondContact O-N 3.44Å; T130-N133 VanDerWaalsContact O-N 3.12Å; T130-N133 PolarHBondContact O-OD1 3.38Å; T130-N133 PolarHBondContact OG1-N 3.41Å; T130-N133 PolarHBondContact OG1-ND2 3.02Å; N133-Q135 VanDerWaalsContact C-N 3.27Å; N133-Q135 PolarHBondContact O-N 3.07Å; N133-F136 VanDerWaalsContact CA-CZ 3.45Å; N133-F136 HydrophobicContact CB-CD2 4.46Å; N133-F136 HydrophobicContact CB-CE1 4.1Å; N133-F136 HydrophobicContact CB-CE2 3.59Å; N133-F136 HydrophobicContact CB-CZ 3.37Å; N133-F136 WeakPolarHBondContact O-CD2 3.36Å; N133-F136 PolarHBondContact O-N 3.39Å; N133-L137 WeakPolarHBondContact O-CB 3.36Å; N133-L137 PolarHBondContact O-N 3.45Å
134	V	90.6	Very high	89.6	Confident	8 Å²	8	58.4 Å²	58.4	5%	0.048	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-34.8	-171.9	63.9	0	0	0	0	112.9	I129 T130 F138 C153 F156 L157	I129-V134 HydrophobicContact CG2-CB 3.89Å; I129-V134 HydrophobicContact CG2-CG2 3.88Å; T130-V134 WeakPolarHBondContact O-CB 3.23Å; T130-V134 PolarHBondContact O-N 3.14Å; V134-F138 WeakPolarHBondContact O-CB 3.43Å; V134-F138 PolarHBondContact O-N 3.31Å; V134-C153 HydrophobicContact CG2-CB 3.9Å; V134-F156 HydrophobicContact CB-CD1 4.11Å; V134-F156 HydrophobicContact CB-CE1 4.42Å; V134-F156 HydrophobicContact CG1-CD1 4.38Å; V134-F156 HydrophobicContact CG1-CE1 4.43Å; V134-F156 HydrophobicContact CG2-CD1 3.97Å; V134-L157 HydrophobicContact CG1-CD2 3.72Å; V134-L157 HydrophobicContact CG1-CG 4.48Å; V134-L157 HydrophobicContact CG2-CD1 4.33Å; V134-L157 HydrophobicContact CG2-CD2 4.03Å; V134-L157 HydrophobicContact CG2-CG 3.85Å
135	Q	88.8	Confident	89.6	Confident	114 Å²	114	61 Å²	61	53%	0.533	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-62.7	179.3	179	171.5	-6.8	0	0	111.6	N133 L137 F138 E139 F172	N133-Q135 VanDerWaalsContact C-N 3.27Å; N133-Q135 PolarHBondContact O-N 3.07Å; Q135-L137 VanDerWaalsContact C-N 3.28Å; Q135-L137 PolarHBondContact O-N 3.24Å; Q135-F138 WeakPolarHBondContact O-CB 3.28Å; Q135-F138 PolarHBondContact O-N 3.1Å; Q135-E139 VanDerWaalsContact CG-OE1 3.27Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.35Å; Q135-E139 PolarHBondContact NE2-OE1 2.64Å; Q135-E139 VanDerWaalsContact NE2-OE1 3.09Å; Q135-E139 WeakPolarHBondContact O-CG 3.31Å; Q135-E139 PolarHBondContact O-N 2.97Å; Q135-F172 HydrophobicContact CG-CD2 4.42Å; Q135-F172 HydrophobicContact CG-CE2 3.81Å
136	F	89	Confident	89.7	Confident	34 Å²	34	59 Å²	59	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-66.7	-29.5	-178.4	57.8	-114	0	0	0	112.7	A114 E132 N133 T140	A114-F136 HydrophobicContact CB-CB 4.24Å; A114-F136 HydrophobicContact CB-CD2 3.41Å; A114-F136 VanDerWaalsContact CB-CD2 3.41Å; A114-F136 HydrophobicContact CB-CE2 4.07Å; A114-F136 HydrophobicContact CB-CG 4.17Å; E132-F136 VanDerWaalsContact O-CE1 3.28Å; E132-F136 WeakPolarHBondContact O-CE1 3.5Å; N133-F136 VanDerWaalsContact CA-CZ 3.45Å; N133-F136 HydrophobicContact CB-CD2 4.46Å; N133-F136 HydrophobicContact CB-CE1 4.1Å; N133-F136 HydrophobicContact CB-CE2 3.59Å; N133-F136 HydrophobicContact CB-CZ 3.37Å; N133-F136 WeakPolarHBondContact O-CD2 3.36Å; N133-F136 PolarHBondContact O-N 3.39Å; F136-T140 VanDerWaalsContact O-CB 3.23Å; F136-T140 WeakPolarHBondContact O-CB 3.44Å; F136-T140 PolarHBondContact O-N 3.25Å; F136-T140 PolarHBondContact O-OG1 3.31Å
137	L	91.2	Very high	89.8	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-40.2	175.1	-172	65.1	0	0	0	111.2	A117 I129 N133 Q135 S141 L149	A117-L137 HydrophobicContact CB-CD1 4Å; I129-L137 HydrophobicContact CG1-CD2 4Å; N133-L137 WeakPolarHBondContact O-CB 3.36Å; N133-L137 PolarHBondContact O-N 3.45Å; Q135-L137 VanDerWaalsContact C-N 3.28Å; Q135-L137 PolarHBondContact O-N 3.24Å; L137-S141 VanDerWaalsContact O-CB 3.28Å; L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3.12Å; L137-S141 PolarHBondContact O-OG 3.24Å; L137-L149 HydrophobicContact CD1-CD2 4.05Å; L137-L149 HydrophobicContact CD2-CD1 4.29Å; L137-L149 HydrophobicContact CG-CD1 4.46Å; L137-L149 HydrophobicContact CG-CD2 4.4Å
138	F	91.1	Very high	89.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-52.2	172.2	177.1	-81.6	0	0	0	110.8	V134 Q135 T140 S141 N142 R150 C153 F172 H176 L178	V134-F138 WeakPolarHBondContact O-CB 3.43Å; V134-F138 PolarHBondContact O-N 3.31Å; Q135-F138 WeakPolarHBondContact O-CB 3.28Å; Q135-F138 PolarHBondContact O-N 3.1Å; F138-T140 VanDerWaalsContact C-N 3.31Å; F138-T140 PolarHBondContact O-N 2.9Å; F138-S141 WeakPolarHBondContact CA-OG 3.28Å; F138-S141 PolarHBondContact O-N 3.39Å; F138-S141 VanDerWaalsContact O-N 3.12Å; F138-S141 PolarHBondContact O-OG 3.01Å; F138-N142 HydrophobicContact CE1-CB 4.15Å; F138-N142 WeakPolarHBondContact O-CB 3.36Å; F138-N142 PolarHBondContact O-N 2.95Å; F138-R150 HydrophobicContact CD2-CG 3.88Å; F138-R150 HydrophobicContact CE2-CB 4.44Å; F138-R150 HydrophobicContact CE2-CG 3.26Å; F138-R150 HydrophobicContact CZ-CG 3.72Å; F138-C153 HydrophobicContact CB-CB 4.02Å; F138-C153 HydrophobicContact CD2-CB 4.01Å; F138-F172 HydrophobicContact CB-CZ 4Å; F138-F172 HydrophobicContact CD1-CE1 4.05Å; F138-F172 HydrophobicContact CD1-CE2 4.45Å; F138-F172 AromaticContact CD1-CZ 3.5Å; F138-F172 HydrophobicContact CD1-CZ 3.5Å; F138-F172 VanDerWaalsContact CD1-CZ 3.5Å; F138-F172 HydrophobicContact CE1-CZ 4.23Å; F138-F172 HydrophobicContact CG-CE1 4.12Å; F138-F172 AromaticContact CG-CZ 3.78Å; F138-F172 HydrophobicContact CG-CZ 3.78Å; F138-H176 HydrophobicContact CE1-CB 3.59Å; F138-H176 AromaticContact CE1-CD2 3.95Å; F138-H176 AromaticContact CE1-CG 3.57Å; F138-H176 HydrophobicContact CZ-CB 4.02Å; F138-L178 HydrophobicContact CD2-CD1 4.42Å; F138-L178 HydrophobicContact CE1-CD1 4.41Å; F138-L178 HydrophobicContact CE2-CD1 3.54Å; F138-L178 HydrophobicContact CE2-CD2 3.89Å; F138-L178 HydrophobicContact CE2-CG 4.14Å; F138-L178 HydrophobicContact CZ-CD1 3.57Å; F138-L178 HydrophobicContact CZ-CD2 3.78Å; F138-L178 HydrophobicContact CZ-CG 3.83Å
139	E	89.6	Confident	89.9	Confident	70 Å²	70	48.4 Å²	48.4	33%	0.327	25%	0.253	S	S	.	.	H	α-helix	trans	-55	-47.1	179.6	-71.6	168.3	-167.4	0	0	111.2	Q135 N142 L143	Q135-E139 VanDerWaalsContact CG-OE1 3.27Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.35Å; Q135-E139 PolarHBondContact NE2-OE1 2.64Å; Q135-E139 VanDerWaalsContact NE2-OE1 3.09Å; Q135-E139 WeakPolarHBondContact O-CG 3.31Å; Q135-E139 PolarHBondContact O-N 2.97Å; E139-N142 PolarHBondContact O-N 3.38Å; E139-L143 WeakPolarHBondContact O-CB 3.21Å; E139-L143 PolarHBondContact O-N 3.21Å
140	T	89.5	Confident	89.8	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-45.9	175.6	-58.1	0	0	0	0	112	I110 A114 F118 F136 F138 N142 L143 F144	I110-T140 HydrophobicContact CG2-CG2 4.3Å; A114-T140 WeakPolarHBondContact CB-OG1 3.28Å; F118-T140 HydrophobicContact CB-CG2 4.01Å; F118-T140 HydrophobicContact CD2-CG2 4.32Å; F118-T140 HydrophobicContact CG-CG2 4.3Å; F136-T140 VanDerWaalsContact O-CB 3.23Å; F136-T140 WeakPolarHBondContact O-CB 3.44Å; F136-T140 PolarHBondContact O-N 3.25Å; F136-T140 PolarHBondContact O-OG1 3.31Å; F138-T140 VanDerWaalsContact C-N 3.31Å; F138-T140 PolarHBondContact O-N 2.9Å; T140-N142 VanDerWaalsContact C-N 3.3Å; T140-N142 PolarHBondContact O-N 2.67Å; T140-L143 PolarHBondContact O-N 3.05Å; T140-F144 HydrophobicContact CG2-CD2 3.55Å; T140-F144 HydrophobicContact CG2-CE2 3.52Å; T140-F144 WeakPolarHBondContact O-CB 3.45Å; T140-F144 WeakPolarHBondContact O-CD2 3.46Å; T140-F144 PolarHBondContact O-N 2.81Å
141	S	90.8	Very high	89.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-34.3	178.7	73.3	0	0	0	0	112.7	L137 F138 Q145 I146 R150	L137-S141 VanDerWaalsContact O-CB 3.28Å; L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3.12Å; L137-S141 PolarHBondContact O-OG 3.24Å; F138-S141 WeakPolarHBondContact CA-OG 3.28Å; F138-S141 PolarHBondContact O-N 3.39Å; F138-S141 VanDerWaalsContact O-N 3.12Å; F138-S141 PolarHBondContact O-OG 3.01Å; S141-Q145 CarbonylContact O-C 3.6Å; S141-Q145 PolarHBondContact O-N 3.34Å; S141-I146 PolarHBondContact O-N 3.27Å; S141-R150 VanDerWaalsContact OG-CA 3.24Å; S141-R150 WeakPolarHBondContact OG-CA 3.48Å; S141-R150 WeakPolarHBondContact OG-CB 3.48Å; S141-R150 PolarHBondContact OG-N 3.39Å
142	N	89.1	Confident	90	Very high	66 Å²	66	49.1 Å²	49.1	35%	0.353	25%	0.253	S	S	.	.	H	α-helix	trans	-73.6	-44.3	177.9	-172.8	63.9	0	0	0	111.5	F138 E139 T140 Q145	F138-N142 HydrophobicContact CE1-CB 4.15Å; F138-N142 WeakPolarHBondContact O-CB 3.36Å; F138-N142 PolarHBondContact O-N 2.95Å; E139-N142 PolarHBondContact O-N 3.38Å; T140-N142 VanDerWaalsContact C-N 3.3Å; T140-N142 PolarHBondContact O-N 2.67Å; N142-Q145 PolarHBondContact O-N 3.43Å; N142-Q145 VanDerWaalsContact O-N 3.14Å
143	L	90	Very high	90.3	Very high	73 Å²	73	41.1 Å²	41.1	38%	0.382	22%	0.215	S	C	.	.	H	α-helix	trans	-59.9	-45.9	175	177.5	58.6	0	0	0	111.8	Y88 I110 E139 T140 Q145	Y88-L143 HydrophobicContact CE2-CD1 4.49Å; I110-L143 HydrophobicContact CD1-CD2 3.64Å; I110-L143 HydrophobicContact CG1-CD2 3.91Å; E139-L143 WeakPolarHBondContact O-CB 3.21Å; E139-L143 PolarHBondContact O-N 3.21Å; T140-L143 PolarHBondContact O-N 3.05Å; L143-Q145 PolarHBondContact O-N 3.03Å
144	F	91	Very high	90.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	7	176.6	-59.7	-33.8	0	0	0	114.3	S86 Y88 F89 I107 I110 M115 F118 T140 I146	S86-F144 WeakPolarHBondContact CB-O 3.31Å; S86-F144 PolarHBondContact OG-O 2.84Å; Y88-F144 AromaticContact CD1-CD1 3.49Å; Y88-F144 HydrophobicContact CD1-CD1 3.49Å; Y88-F144 VanDerWaalsContact CD1-CD1 3.49Å; Y88-F144 AromaticContact CD1-CE1 3.91Å; Y88-F144 HydrophobicContact CD1-CE1 3.91Å; Y88-F144 AromaticContact CE1-CD1 3.78Å; Y88-F144 HydrophobicContact CE1-CD1 3.78Å; Y88-F144 AromaticContact CE1-CE1 3.7Å; Y88-F144 HydrophobicContact CE1-CE1 3.7Å; Y88-F144 HydrophobicContact CG-CD1 4.05Å; F89-F144 HydrophobicContact CD2-CD1 4.49Å; F89-F144 HydrophobicContact CE2-CB 4.5Å; F89-F144 AromaticContact CE2-CD1 3.7Å; F89-F144 HydrophobicContact CE2-CD1 3.7Å; F89-F144 HydrophobicContact CE2-CD2 4.15Å; F89-F144 AromaticContact CE2-CE1 3.82Å; F89-F144 HydrophobicContact CE2-CE1 3.82Å; F89-F144 HydrophobicContact CE2-CE2 4.23Å; F89-F144 AromaticContact CE2-CG 3.87Å; F89-F144 HydrophobicContact CE2-CG 3.87Å; F89-F144 HydrophobicContact CE2-CZ 4.07Å; F89-F144 HydrophobicContact CZ-CD1 4.06Å; F89-F144 AromaticContact CZ-CE1 3.69Å; F89-F144 HydrophobicContact CZ-CE1 3.69Å; F89-F144 HydrophobicContact CZ-CE2 4.37Å; F89-F144 AromaticContact CZ-CZ 3.85Å; F89-F144 HydrophobicContact CZ-CZ 3.85Å; I107-F144 HydrophobicContact CD1-CE1 4.07Å; I107-F144 HydrophobicContact CD1-CZ 3.97Å; I107-F144 HydrophobicContact CG2-CE1 4.38Å; I107-F144 HydrophobicContact CG2-CZ 4.27Å; I110-F144 HydrophobicContact CD1-CE1 3.91Å; I110-F144 HydrophobicContact CD1-CE2 3.77Å; I110-F144 HydrophobicContact CD1-CZ 3.22Å; M115-F144 HydrophobicContact CE-CE2 3.59Å; M115-F144 HydrophobicContact CE-CZ 3.45Å; M115-F144 VanDerWaalsContact CE-CZ 3.45Å; M115-F144 HydrophobicContact SD-CE2 4.38Å; F118-F144 HydrophobicContact CD1-CD2 4.03Å; F118-F144 HydrophobicContact CD1-CE2 4.07Å; F118-F144 HydrophobicContact CD2-CB 4.45Å; F118-F144 AromaticContact CD2-CD2 3.58Å; F118-F144 HydrophobicContact CD2-CD2 3.58Å; F118-F144 HydrophobicContact CD2-CE2 4.32Å; F118-F144 HydrophobicContact CD2-CG 4.48Å; F118-F144 AromaticContact CE1-CD2 3.88Å; F118-F144 HydrophobicContact CE1-CD2 3.88Å; F118-F144 HydrophobicContact CE1-CE2 4.12Å; F118-F144 HydrophobicContact CE2-CB 3.61Å; F118-F144 AromaticContact CE2-CD2 3.35Å; F118-F144 HydrophobicContact CE2-CD2 3.35Å; F118-F144 HydrophobicContact CE2-CE2 4.31Å; F118-F144 AromaticContact CE2-CG 3.86Å; F118-F144 HydrophobicContact CE2-CG 3.86Å; F118-F144 AromaticContact CG-CD2 3.9Å; F118-F144 HydrophobicContact CG-CD2 3.9Å; F118-F144 HydrophobicContact CG-CE2 4.19Å; F118-F144 HydrophobicContact CZ-CB 3.97Å; F118-F144 AromaticContact CZ-CD2 3.54Å; F118-F144 HydrophobicContact CZ-CD2 3.54Å; F118-F144 HydrophobicContact CZ-CE2 4.24Å; F118-F144 AromaticContact CZ-CG 3.97Å; F118-F144 HydrophobicContact CZ-CG 3.97Å; T140-F144 HydrophobicContact CG2-CD2 3.55Å; T140-F144 HydrophobicContact CG2-CE2 3.52Å; T140-F144 WeakPolarHBondContact O-CB 3.45Å; T140-F144 WeakPolarHBondContact O-CD2 3.46Å; T140-F144 PolarHBondContact O-N 2.81Å; F144-I146 PolarHBondContact O-N 3.39Å
145	Q	90.6	Very high	90.4	Very high	110 Å²	110	46.8 Å²	46.8	51%	0.514	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	28.4	173.8	-56.4	179.8	5.5	0	0	115	S87 S141 N142 L143 T147	S87-Q145 VanDerWaalsContact OG-CB 3.28Å; S87-Q145 WeakPolarHBondContact OG-CB 3.35Å; S87-Q145 PolarHBondContact OG-OE1 3.32Å; S141-Q145 CarbonylContact O-C 3.6Å; S141-Q145 PolarHBondContact O-N 3.34Å; N142-Q145 PolarHBondContact O-N 3.43Å; N142-Q145 VanDerWaalsContact O-N 3.14Å; L143-Q145 PolarHBondContact O-N 3.03Å; Q145-T147 PolarHBondContact O-N 2.95Å
146	I	90	Very high	90.6	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.227	C	C	.	.			trans	-84.5	93.1	173.3	-59.2	-162.9	0	0	0	109.4	F118 Y121 V122 S141 F144 T148 L149 R150	F118-I146 HydrophobicContact CD2-CD1 4Å; F118-I146 HydrophobicContact CE2-CD1 3.26Å; F118-I146 HydrophobicContact CE2-CG1 3.96Å; F118-I146 HydrophobicContact CZ-CD1 4.01Å; Y121-I146 HydrophobicContact CD1-CD1 4.21Å; Y121-I146 HydrophobicContact CD1-CG2 4.42Å; Y121-I146 HydrophobicContact CE1-CD1 4.19Å; Y121-I146 HydrophobicContact CE1-CG2 3.68Å; V122-I146 HydrophobicContact CG2-CD1 4.33Å; S141-I146 PolarHBondContact O-N 3.27Å; F144-I146 PolarHBondContact O-N 3.39Å; I146-T148 WeakPolarHBondContact CG2-OG1 3.48Å; I146-T148 PolarHBondContact O-N 2.94Å; I146-L149 HydrophobicContact CB-CB 4.4Å; I146-L149 HydrophobicContact CG2-CB 3.67Å; I146-R150 WeakPolarHBondContact O-CB 3.36Å; I146-R150 PolarHBondContact O-N 3.46Å; I146-R150 VanDerWaalsContact O-N 3.1Å
147	T	89.3	Confident	90.7	Very high	73 Å²	73	43 Å²	43	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-40.7	-178.6	53.6	0	0	0	0	113.1	Q145 L149 R150 D151	Q145-T147 PolarHBondContact O-N 2.95Å; T147-L149 PolarHBondContact O-N 2.96Å; T147-R150 PolarHBondContact O-N 2.84Å; T147-D151 VanDerWaalsContact O-CB 3.29Å; T147-D151 WeakPolarHBondContact O-CB 3.32Å; T147-D151 PolarHBondContact O-N 3.5Å
148	T	91.1	Very high	90.7	Very high	83 Å²	83	45.8 Å²	45.8	51%	0.509	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-46.5	-179.5	45.6	0	0	0	0	113.1	Y121 I146 A152	Y121-T148 PolarHBondContact OH-OG1 3.37Å; I146-T148 WeakPolarHBondContact CG2-OG1 3.48Å; I146-T148 PolarHBondContact O-N 2.94Å; T148-A152 WeakPolarHBondContact O-CB 3.22Å; T148-A152 PolarHBondContact O-N 3.16Å; T148-A152 VanDerWaalsContact O-N 3.1Å
149	L	90.3	Very high	90.7	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-72.1	-40.5	179.1	-177.2	59.8	0	0	0	111.4	Y121 A127 L137 I146 T147 A152 C153	Y121-L149 HydrophobicContact CD1-CD2 4.14Å; Y121-L149 HydrophobicContact CD2-CD1 4.48Å; Y121-L149 HydrophobicContact CE1-CB 4.29Å; Y121-L149 HydrophobicContact CG-CD2 4.21Å; A127-L149 HydrophobicContact CB-CD1 3.66Å; L137-L149 HydrophobicContact CD1-CD2 4.05Å; L137-L149 HydrophobicContact CD2-CD1 4.29Å; L137-L149 HydrophobicContact CG-CD1 4.46Å; L137-L149 HydrophobicContact CG-CD2 4.4Å; I146-L149 HydrophobicContact CB-CB 4.4Å; I146-L149 HydrophobicContact CG2-CB 3.67Å; T147-L149 PolarHBondContact O-N 2.96Å; L149-A152 PolarHBondContact O-N 2.95Å; L149-C153 PolarHBondContact O-N 3.06Å; L149-C153 PolarHBondContact O-SG 3.36Å
150	R	90.3	Very high	90.8	Very high	68 Å²	68	52 Å²	52	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-57.5	-48.9	174.2	-176.4	-161.4	66.5	-165.4	-5.3	111.8	F138 S141 I146 T147 A152 C153 A154	F138-R150 HydrophobicContact CD2-CG 3.88Å; F138-R150 HydrophobicContact CE2-CB 4.44Å; F138-R150 HydrophobicContact CE2-CG 3.26Å; F138-R150 HydrophobicContact CZ-CG 3.72Å; S141-R150 VanDerWaalsContact OG-CA 3.24Å; S141-R150 WeakPolarHBondContact OG-CA 3.48Å; S141-R150 WeakPolarHBondContact OG-CB 3.48Å; S141-R150 PolarHBondContact OG-N 3.39Å; I146-R150 WeakPolarHBondContact O-CB 3.36Å; I146-R150 PolarHBondContact O-N 3.46Å; I146-R150 VanDerWaalsContact O-N 3.1Å; T147-R150 PolarHBondContact O-N 2.84Å; R150-A152 VanDerWaalsContact C-N 3.33Å; R150-A152 PolarHBondContact O-N 3.36Å; R150-C153 PolarHBondContact O-N 3.28Å; R150-A154 PolarHBondContact O-N 3.29Å
151	D	90.3	Very high	91	Very high	81 Å²	81	53.2 Å²	53.2	43%	0.433	28%	0.275	S	S	.	.	H	α-helix	trans	-70.8	-31.7	-177.3	-61.6	-8.3	0	0	0	111	T147 K155	T147-D151 VanDerWaalsContact O-CB 3.29Å; T147-D151 WeakPolarHBondContact O-CB 3.32Å; T147-D151 PolarHBondContact O-N 3.5Å; D151-K155 WeakPolarHBondContact O-CB 3.4Å; D151-K155 PolarHBondContact O-N 3.09Å
152	A	91.6	Very high	91.1	Very high	43 Å²	43	56.6 Å²	56.6	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-66.2	-41.1	170.1	0	0	0	0	0	112.7	I129 T148 L149 R150 K155 F156	I129-A152 HydrophobicContact CD1-CB 3.94Å; T148-A152 WeakPolarHBondContact O-CB 3.22Å; T148-A152 PolarHBondContact O-N 3.16Å; T148-A152 VanDerWaalsContact O-N 3.1Å; L149-A152 PolarHBondContact O-N 2.95Å; R150-A152 VanDerWaalsContact C-N 3.33Å; R150-A152 PolarHBondContact O-N 3.36Å; A152-K155 PolarHBondContact O-N 3.22Å; A152-F156 PolarHBondContact O-N 2.88Å
153	C	91.8	Very high	91.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-43.6	174.5	-65.9	0	0	0	0	111.5	V134 F138 L149 R150 K155 F156 L157	V134-C153 HydrophobicContact CG2-CB 3.9Å; F138-C153 HydrophobicContact CB-CB 4.02Å; F138-C153 HydrophobicContact CD2-CB 4.01Å; L149-C153 PolarHBondContact O-N 3.06Å; L149-C153 PolarHBondContact O-SG 3.36Å; R150-C153 PolarHBondContact O-N 3.28Å; C153-K155 VanDerWaalsContact C-N 3.32Å; C153-K155 PolarHBondContact O-N 2.87Å; C153-F156 WeakPolarHBondContact O-CB 3.26Å; C153-F156 PolarHBondContact O-N 3.17Å; C153-F156 VanDerWaalsContact O-N 3.17Å; C153-L157 PolarHBondContact O-N 3.29Å
154	A	90.8	Very high	91.4	Very high	15 Å²	15	53.2 Å²	53.2	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-40.1	175.9	0	0	0	0	0	112.1	R150 L157 E158 L178 L181	R150-A154 PolarHBondContact O-N 3.29Å; A154-L157 PolarHBondContact O-N 2.89Å; A154-E158 PolarHBondContact O-N 2.98Å; A154-E158 VanDerWaalsContact O-N 3.08Å; A154-L178 HydrophobicContact CB-CD1 4.41Å; A154-L181 HydrophobicContact CB-CD2 4.4Å
155	K	91.6	Very high	91.4	Very high	137 Å²	137	55.1 Å²	55.1	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-68.5	-31.9	175.1	-171.1	172.9	-176.4	177.1	0	113.2	D151 A152 C153 N159	D151-K155 WeakPolarHBondContact O-CB 3.4Å; D151-K155 PolarHBondContact O-N 3.09Å; A152-K155 PolarHBondContact O-N 3.22Å; C153-K155 VanDerWaalsContact C-N 3.32Å; C153-K155 PolarHBondContact O-N 2.87Å; K155-N159 VanDerWaalsContact O-CG 3.3Å; K155-N159 PolarHBondContact O-N 3.02Å; K155-N159 PolarHBondContact O-ND2 3.37Å
156	F	93.1	Very high	91.6	Very high	53 Å²	53	49.9 Å²	49.9	23%	0.232	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-46.8	172.6	179.8	-91.2	0	0	0	111.1	I129 T131 V134 A152 C153 E158 N159 Q160	I129-F156 HydrophobicContact CB-CD2 4.32Å; I129-F156 HydrophobicContact CB-CG 4.36Å; I129-F156 HydrophobicContact CG2-CB 3.91Å; I129-F156 HydrophobicContact CG2-CD1 3.8Å; I129-F156 HydrophobicContact CG2-CD2 4.04Å; I129-F156 HydrophobicContact CG2-CE1 4.33Å; I129-F156 HydrophobicContact CG2-CG 3.63Å; T131-F156 HydrophobicContact CG2-CE1 4.22Å; T131-F156 HydrophobicContact CG2-CZ 4.28Å; V134-F156 HydrophobicContact CB-CD1 4.11Å; V134-F156 HydrophobicContact CB-CE1 4.42Å; V134-F156 HydrophobicContact CG1-CD1 4.38Å; V134-F156 HydrophobicContact CG1-CE1 4.43Å; V134-F156 HydrophobicContact CG2-CD1 3.97Å; A152-F156 PolarHBondContact O-N 2.88Å; C153-F156 WeakPolarHBondContact O-CB 3.26Å; C153-F156 PolarHBondContact O-N 3.17Å; C153-F156 VanDerWaalsContact O-N 3.17Å; F156-E158 VanDerWaalsContact C-N 3.34Å; F156-E158 PolarHBondContact O-N 3.07Å; F156-N159 PolarHBondContact O-N 3.33Å; F156-Q160 HydrophobicContact CD1-CG 4.4Å; F156-Q160 HydrophobicContact CE1-CG 4.03Å; F156-Q160 HydrophobicContact CZ-CG 4.11Å; F156-Q160 WeakPolarHBondContact O-CG 3.27Å; F156-Q160 PolarHBondContact O-N 2.92Å
157	L	91.9	Very high	91.7	Very high	16 Å²	16	49.7 Å²	49.7	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-43.6	175.8	-69.8	171.5	0	0	0	112.2	V134 C153 A154 N159 Q160 L161 I169 F172 L181	V134-L157 HydrophobicContact CG1-CD2 3.72Å; V134-L157 HydrophobicContact CG1-CG 4.48Å; V134-L157 HydrophobicContact CG2-CD1 4.33Å; V134-L157 HydrophobicContact CG2-CD2 4.03Å; V134-L157 HydrophobicContact CG2-CG 3.85Å; C153-L157 PolarHBondContact O-N 3.29Å; A154-L157 PolarHBondContact O-N 2.89Å; L157-N159 VanDerWaalsContact C-N 3.3Å; L157-N159 PolarHBondContact O-N 3.09Å; L157-Q160 PolarHBondContact O-N 3.25Å; L157-L161 PolarHBondContact O-N 2.76Å; L157-I169 HydrophobicContact CB-CG2 4.08Å; L157-I169 HydrophobicContact CD2-CD1 4.45Å; L157-I169 HydrophobicContact CD2-CG1 4.46Å; L157-F172 HydrophobicContact CD1-CD1 3.81Å; L157-F172 HydrophobicContact CD1-CE1 3.56Å; L157-L181 HydrophobicContact CB-CD2 4.1Å; L157-L181 HydrophobicContact CD1-CD2 3.98Å
158	E	91	Very high	91.8	Very high	59 Å²	59	47.4 Å²	47.4	28%	0.276	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-38.1	177.6	-169.4	-178.2	143.4	0	0	113	A154 F156 Q160 L161 L181 R184	A154-E158 PolarHBondContact O-N 2.98Å; A154-E158 VanDerWaalsContact O-N 3.08Å; F156-E158 VanDerWaalsContact C-N 3.34Å; F156-E158 PolarHBondContact O-N 3.07Å; E158-Q160 PolarHBondContact O-N 3.19Å; E158-L161 HydrophobicContact CG-CD1 4.31Å; E158-L161 WeakPolarHBondContact O-CG 3.37Å; E158-L181 HydrophobicContact CB-CD1 3.9Å; E158-L181 HydrophobicContact CG-CD1 4.44Å; E158-R184 VanDerWaalsContact OE1-CD 3.28Å; E158-R184 WeakPolarHBondContact OE1-CD 3.42Å; E158-R184 IonicContact OE1-CZ 3.59Å; E158-R184 IonicContact OE1-NE 3.69Å; E158-R184 IonicContact OE1-NH1 2.7Å; E158-R184 PolarHBondContact OE1-NH1 3.46Å; E158-R184 VanDerWaalsContact OE2-CD 3.24Å; E158-R184 WeakPolarHBondContact OE2-CD 3.27Å; E158-R184 IonicContact OE2-CZ 3.02Å; E158-R184 IonicContact OE2-NE 2.75Å; E158-R184 IonicContact OE2-NH1 3.32Å; E158-R184 PolarHBondContact OE2-NH1 3.08Å
159	N	91.9	Very high	91.9	Very high	108 Å²	108	44.4 Å²	44.4	58%	0.578	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-1.1	177.1	-68.5	-22.2	0	0	0	113.7	K155 F156 L157	K155-N159 VanDerWaalsContact O-CG 3.3Å; K155-N159 PolarHBondContact O-N 3.02Å; K155-N159 PolarHBondContact O-ND2 3.37Å; F156-N159 PolarHBondContact O-N 3.33Å; L157-N159 VanDerWaalsContact C-N 3.3Å; L157-N159 PolarHBondContact O-N 3.09Å
160	Q	91	Very high	92	Very high	93 Å²	93	45 Å²	45	44%	0.435	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	16.3	-179.5	-64.6	-65.8	-80.1	0	0	112.1	F156 L157 E158 D162 N165	F156-Q160 HydrophobicContact CD1-CG 4.4Å; F156-Q160 HydrophobicContact CE1-CG 4.03Å; F156-Q160 HydrophobicContact CZ-CG 4.11Å; F156-Q160 WeakPolarHBondContact O-CG 3.27Å; F156-Q160 PolarHBondContact O-N 2.92Å; L157-Q160 PolarHBondContact O-N 3.25Å; E158-Q160 PolarHBondContact O-N 3.19Å; Q160-D162 PolarHBondContact O-N 3.27Å; Q160-N165 PolarHBondContact O-ND2 2.93Å; Q160-N165 PolarHBondContact O-OD1 3.33Å
161	L	92.8	Very high	92.1	Very high	30 Å²	30	46.9 Å²	46.9	16%	0.157	25%	0.246	C	C	.	.			trans	-64.4	123.8	176.2	-70	171.2	0	0	0	111.4	L157 E158 C166 I169 C185 Y188	L157-L161 PolarHBondContact O-N 2.76Å; E158-L161 HydrophobicContact CG-CD1 4.31Å; E158-L161 WeakPolarHBondContact O-CG 3.37Å; L161-C166 HydrophobicContact CD2-CB 4.29Å; L161-I169 HydrophobicContact CD2-CB 4.43Å; L161-I169 HydrophobicContact CD2-CD1 4.13Å; L161-I169 HydrophobicContact CD2-CG2 4.28Å; L161-C185 HydrophobicContact CD2-CB 4.29Å; L161-C185 VanDerWaalsContact CD2-SG 3.59Å; L161-Y188 HydrophobicContact CB-CD1 4.46Å; L161-Y188 HydrophobicContact CB-CD2 4.23Å; L161-Y188 HydrophobicContact CB-CE2 4.27Å; L161-Y188 HydrophobicContact CB-CG 4.32Å; L161-Y188 PolarHBondContact O-OH 3.04Å
162	D	93.7	Very high	92.1	Very high	71 Å²	71	44.5 Å²	44.5	38%	0.38	23%	0.232	S	C	.	.			trans	-138.5	152.2	-179	-176.9	-84.5	0	0	0	109.4	Q160 C164 N165 C166	Q160-D162 PolarHBondContact O-N 3.27Å; D162-C164 PolarHBondContact O-N 3.2Å; D162-C164 VanDerWaalsContact O-N 3.08Å; D162-C164 PolarHBondContact OD1-N 3.26Å; D162-C164 PolarHBondContact OD1-SG 3.3Å; D162-N165 PolarHBondContact N-OD1 2.95Å; D162-N165 PolarHBondContact O-N 2.91Å; D162-N165 VanDerWaalsContact O-N 3.08Å; D162-N165 PolarHBondContact O-OD1 3.33Å; D162-N165 VanDerWaalsContact O-OD1 3.13Å; D162-C166 WeakPolarHBondContact O-CB 3.4Å; D162-C166 PolarHBondContact O-N 3.05Å
163	P	92.4	Very high	92.1	Very high	11 Å²	11	42.4 Å²	42.4	7%	0.071	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23	179.4	-25.9	37.5	0	0	0	114.5	Y188 E195 V196 H199	P163-Y188 WeakPolarHBondContact CD-OH 3.32Å; P163-Y188 HydrophobicContact CG-CE1 4.39Å; P163-E195 HydrophobicContact CB-CB 3.92Å; P163-E195 HydrophobicContact CG-CB 4.2Å; P163-V196 HydrophobicContact CB-CG2 4.02Å; P163-H199 PolarHBondContact O-CD2 2.97Å
164	C	92.8	Very high	92	Very high	56 Å²	56	46.6 Å²	46.6	38%	0.378	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.8	177.5	78.3	0	0	0	0	115.4	D162 H199 E201	D162-C164 PolarHBondContact O-N 3.2Å; D162-C164 VanDerWaalsContact O-N 3.08Å; D162-C164 PolarHBondContact OD1-N 3.26Å; D162-C164 PolarHBondContact OD1-SG 3.3Å; C164-H199 HydrophobicContact CB-CB 4.45Å; C164-E201 WeakPolarHBondContact O-CG 3.34Å
165	N	91.9	Very high	91.9	Very high	40 Å²	40	49.7 Å²	49.7	21%	0.214	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-10.8	-172.8	75.3	19.7	0	0	0	115.1	Q160 D162 V167 G168 I169 E201	Q160-N165 PolarHBondContact O-ND2 2.93Å; Q160-N165 PolarHBondContact O-OD1 3.33Å; D162-N165 PolarHBondContact N-OD1 2.95Å; D162-N165 PolarHBondContact O-N 2.91Å; D162-N165 VanDerWaalsContact O-N 3.08Å; D162-N165 PolarHBondContact O-OD1 3.33Å; D162-N165 VanDerWaalsContact O-OD1 3.13Å; N165-V167 PolarHBondContact O-N 3.22Å; N165-G168 PolarHBondContact O-N 2.8Å; N165-I169 HydrophobicContact CB-CD1 4.32Å; N165-I169 WeakPolarHBondContact O-CG1 3.44Å; N165-I169 PolarHBondContact O-N 3.39Å; N165-I169 WeakPolarHBondContact OD1-CD1 3.46Å; N165-E201 WeakPolarHBondContact CA-OE2 3.37Å
166	C	93.8	Very high	91.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-26	-170.2	63.6	0	0	0	0	113.4	L161 D162 Q170 Y188	L161-C166 HydrophobicContact CD2-CB 4.29Å; D162-C166 WeakPolarHBondContact O-CB 3.4Å; D162-C166 PolarHBondContact O-N 3.05Å; C166-Q170 WeakPolarHBondContact O-CB 3.41Å; C166-Q170 PolarHBondContact O-N 2.93Å; C166-Y188 HydrophobicContact CB-CD1 3.83Å; C166-Y188 HydrophobicContact CB-CE1 4.27Å
167	V	92.8	Very high	91.5	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-78.1	-42.2	177.8	172.6	0	0	0	0	110.5	N165 Q170 R171 V196 E201 L205	N165-V167 PolarHBondContact O-N 3.22Å; V167-Q170 PolarHBondContact O-N 3.49Å; V167-R171 WeakPolarHBondContact O-CG 3.42Å; V167-R171 PolarHBondContact O-N 2.81Å; V167-V196 HydrophobicContact CG2-CG1 3.95Å; V167-E201 HydrophobicContact CB-CB 3.99Å; V167-E201 HydrophobicContact CG1-CB 4.28Å; V167-E201 PolarHBondContact N-OE2 2.85Å; V167-L205 HydrophobicContact CG1-CD2 3.5Å; V167-L205 VanDerWaalsContact CG1-CD2 3.5Å; V167-L205 HydrophobicContact CG1-CG 4.11Å
168	G	91.6	Very high	91.3	Very high	25 Å²	25	47.2 Å²	47.2	26%	0.258	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-47.1	173.5	0	0	0	0	0	112	N165 Q170 R171 F172 E201	N165-G168 PolarHBondContact O-N 2.8Å; G168-Q170 VanDerWaalsContact C-N 3.3Å; G168-Q170 PolarHBondContact O-N 3.29Å; G168-R171 PolarHBondContact O-N 3.22Å; G168-F172 WeakPolarHBondContact O-CB 3.42Å; G168-F172 PolarHBondContact O-N 2.9Å; G168-E201 WeakPolarHBondContact CA-OE1 3.33Å; G168-E201 VanDerWaalsContact N-CD 3.32Å; G168-E201 PolarHBondContact N-OE1 3.08Å; G168-E201 PolarHBondContact N-OE2 3.08Å
169	I	92.2	Very high	91.2	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.097	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-36.4	175.4	-61.5	173	0	0	0	110.9	L157 L161 N165 A173 L181 C185	L157-I169 HydrophobicContact CB-CG2 4.08Å; L157-I169 HydrophobicContact CD2-CD1 4.45Å; L157-I169 HydrophobicContact CD2-CG1 4.46Å; L161-I169 HydrophobicContact CD2-CB 4.43Å; L161-I169 HydrophobicContact CD2-CD1 4.13Å; L161-I169 HydrophobicContact CD2-CG2 4.28Å; N165-I169 HydrophobicContact CB-CD1 4.32Å; N165-I169 WeakPolarHBondContact O-CG1 3.44Å; N165-I169 PolarHBondContact O-N 3.39Å; N165-I169 WeakPolarHBondContact OD1-CD1 3.46Å; I169-A173 VanDerWaalsContact O-CB 3.29Å; I169-A173 WeakPolarHBondContact O-CB 3.45Å; I169-A173 PolarHBondContact O-N 3.22Å; I169-L181 HydrophobicContact CG2-CD2 4.25Å; I169-L181 HydrophobicContact CG2-CG 4.44Å; I169-C185 VanDerWaalsContact CG2-SG 3.6Å
170	Q	93.2	Very high	91.2	Very high	18 Å²	18	54.9 Å²	54.9	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-48	172.8	-171.1	-178.7	-49.8	0	0	111.9	C166 V167 G168 F172 A173 D174 A182 C185 Y213	C166-Q170 WeakPolarHBondContact O-CB 3.41Å; C166-Q170 PolarHBondContact O-N 2.93Å; V167-Q170 PolarHBondContact O-N 3.49Å; G168-Q170 VanDerWaalsContact C-N 3.3Å; G168-Q170 PolarHBondContact O-N 3.29Å; Q170-F172 VanDerWaalsContact C-N 3.29Å; Q170-F172 PolarHBondContact O-N 2.97Å; Q170-A173 CarbonylContact O-C 3.56Å; Q170-A173 WeakPolarHBondContact O-CB 3.36Å; Q170-A173 PolarHBondContact O-N 2.7Å; Q170-A173 VanDerWaalsContact O-N 3.09Å; Q170-D174 PolarHBondContact O-N 3.48Å; Q170-A182 HydrophobicContact CG-CB 4.26Å; Q170-C185 HydrophobicContact CB-CB 3.67Å; Q170-C185 HydrophobicContact CG-CB 4.17Å; Q170-Y213 PolarHBondContact NE2-OH 2.91Å; Q170-Y213 PolarHBondContact OE1-OH 3.46Å
171	R	91.4	Very high	91.3	Very high	107 Å²	107	50.8 Å²	50.8	40%	0.404	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-39.5	178.6	-74.2	175.6	63.9	167.3	-0.7	111.7	V167 G168 A175 D204	V167-R171 WeakPolarHBondContact O-CG 3.42Å; V167-R171 PolarHBondContact O-N 2.81Å; G168-R171 PolarHBondContact O-N 3.22Å; R171-A175 WeakPolarHBondContact O-CB 3.42Å; R171-A175 PolarHBondContact O-N 3.38Å; R171-D204 PolarHBondContact NH1-O 3.33Å
172	F	89.9	Confident	91.2	Very high	30 Å²	30	49.7 Å²	49.7	13%	0.132	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-48.2	171.2	176.1	-97.3	0	0	0	111.6	Q135 F138 L157 G168 Q170 D174 A175 H176	Q135-F172 HydrophobicContact CG-CD2 4.42Å; Q135-F172 HydrophobicContact CG-CE2 3.81Å; F138-F172 HydrophobicContact CB-CZ 4Å; F138-F172 HydrophobicContact CD1-CE1 4.05Å; F138-F172 HydrophobicContact CD1-CE2 4.45Å; F138-F172 AromaticContact CD1-CZ 3.5Å; F138-F172 HydrophobicContact CD1-CZ 3.5Å; F138-F172 VanDerWaalsContact CD1-CZ 3.5Å; F138-F172 HydrophobicContact CE1-CZ 4.23Å; F138-F172 HydrophobicContact CG-CE1 4.12Å; F138-F172 AromaticContact CG-CZ 3.78Å; F138-F172 HydrophobicContact CG-CZ 3.78Å; L157-F172 HydrophobicContact CD1-CD1 3.81Å; L157-F172 HydrophobicContact CD1-CE1 3.56Å; G168-F172 WeakPolarHBondContact O-CB 3.42Å; G168-F172 PolarHBondContact O-N 2.9Å; Q170-F172 VanDerWaalsContact C-N 3.29Å; Q170-F172 PolarHBondContact O-N 2.97Å; F172-D174 PolarHBondContact O-N 3.41Å; F172-A175 PolarHBondContact O-N 3.3Å; F172-H176 AromaticContact CD2-CD2 3.53Å; F172-H176 AromaticContact CD2-NE2 3.62Å; F172-H176 AromaticContact CE1-CD2 3.98Å; F172-H176 AromaticContact CE2-CD2 3.24Å; F172-H176 WeakPolarHBondContact CE2-CD2 3.21Å; F172-H176 AromaticContact CE2-NE2 3.18Å; F172-H176 WeakPolarHBondContact CE2-NE2 3.4Å; F172-H176 AromaticContact CZ-CD2 3.51Å; F172-H176 AromaticContact CZ-NE2 3.81Å; F172-H176 PolarHBondContact O-CD2 3.42Å; F172-H176 PolarHBondContact O-N 3.1Å; F172-H176 VanDerWaalsContact O-N 3.08Å
173	A	92	Very high	91.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-41.3	178.4	0	0	0	0	0	112.5	I169 Q170 H176 A177 L178 L181 A182	I169-A173 VanDerWaalsContact O-CB 3.29Å; I169-A173 WeakPolarHBondContact O-CB 3.45Å; I169-A173 PolarHBondContact O-N 3.22Å; Q170-A173 CarbonylContact O-C 3.56Å; Q170-A173 WeakPolarHBondContact O-CB 3.36Å; Q170-A173 PolarHBondContact O-N 2.7Å; Q170-A173 VanDerWaalsContact O-N 3.09Å; A173-H176 CarbonylContact O-C 3.58Å; A173-H176 PolarHBondContact O-N 3.29Å; A173-A177 CarbonylContact O-C 3.33Å; A173-A177 PolarHBondContact O-N 2.83Å; A173-L178 HydrophobicContact CB-CB 3.99Å; A173-L178 HydrophobicContact CB-CD1 4.5Å; A173-L178 PolarHBondContact O-N 3.09Å; A173-L181 HydrophobicContact CB-CB 4.03Å; A173-L181 HydrophobicContact CB-CD2 4.03Å; A173-L181 HydrophobicContact CB-CG 3.95Å; A173-A182 HydrophobicContact CB-CB 3.79Å
174	D	90.7	Very high	91.2	Very high	88 Å²	88	54.6 Å²	54.6	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-67.4	-42.5	176	-76.2	-36.6	0	0	0	111.9	Q170 F172 H176 A177 A182	Q170-D174 PolarHBondContact O-N 3.48Å; F172-D174 PolarHBondContact O-N 3.41Å; D174-H176 PolarHBondContact O-N 2.88Å; D174-A177 PolarHBondContact O-N 2.9Å; D174-A177 VanDerWaalsContact O-N 3.1Å; D174-A182 VanDerWaalsContact OD1-CB 3.28Å; D174-A182 WeakPolarHBondContact OD1-CB 3.44Å
175	A	89	Confident	91.2	Very high	80 Å²	80	51.9 Å²	51.9	66%	0.661	28%	0.276	S	S	*	.	H	α-helix	trans	-60	-32.6	176.1	0	0	0	0	0	113.1	R171 F172	R171-A175 WeakPolarHBondContact O-CB 3.42Å; R171-A175 PolarHBondContact O-N 3.38Å; F172-A175 PolarHBondContact O-N 3.3Å
176	H	87	Confident	91.3	Very high	55 Å²	55	51.4 Å²	51.4	26%	0.255	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	13.6	176.5	-62.3	-64.2	0	0	0	114.4	F138 F172 A173 D174 L178	F138-H176 HydrophobicContact CE1-CB 3.59Å; F138-H176 AromaticContact CE1-CD2 3.95Å; F138-H176 AromaticContact CE1-CG 3.57Å; F138-H176 HydrophobicContact CZ-CB 4.02Å; F172-H176 AromaticContact CD2-CD2 3.53Å; F172-H176 AromaticContact CD2-NE2 3.62Å; F172-H176 AromaticContact CE1-CD2 3.98Å; F172-H176 AromaticContact CE2-CD2 3.24Å; F172-H176 WeakPolarHBondContact CE2-CD2 3.21Å; F172-H176 AromaticContact CE2-NE2 3.18Å; F172-H176 WeakPolarHBondContact CE2-NE2 3.4Å; F172-H176 AromaticContact CZ-CD2 3.51Å; F172-H176 AromaticContact CZ-NE2 3.81Å; F172-H176 PolarHBondContact O-CD2 3.42Å; F172-H176 PolarHBondContact O-N 3.1Å; F172-H176 VanDerWaalsContact O-N 3.08Å; A173-H176 CarbonylContact O-C 3.58Å; A173-H176 PolarHBondContact O-N 3.29Å; D174-H176 PolarHBondContact O-N 2.88Å; H176-L178 HydrophobicContact CB-CG 4.34Å; H176-L178 PolarHBondContact O-N 3.45Å
177	A	88.1	Confident	91.3	Very high	73 Å²	73	55.3 Å²	55.3	60%	0.603	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	25.7	179.4	0	0	0	0	0	115.8	A173 D174 K179	A173-A177 CarbonylContact O-C 3.33Å; A173-A177 PolarHBondContact O-N 2.83Å; D174-A177 PolarHBondContact O-N 2.9Å; D174-A177 VanDerWaalsContact O-N 3.1Å; A177-K179 PolarHBondContact O-N 3.06Å
178	L	87.8	Confident	91.3	Very high	26 Å²	26	58.4 Å²	58.4	14%	0.136	31%	0.305	C	S	.	.			trans	-75.7	64.2	174.8	-65	176.1	0	0	0	111.9	F138 A154 A173 H176 Q180 L181 A182	F138-L178 HydrophobicContact CD2-CD1 4.42Å; F138-L178 HydrophobicContact CE1-CD1 4.41Å; F138-L178 HydrophobicContact CE2-CD1 3.54Å; F138-L178 HydrophobicContact CE2-CD2 3.89Å; F138-L178 HydrophobicContact CE2-CG 4.14Å; F138-L178 HydrophobicContact CZ-CD1 3.57Å; F138-L178 HydrophobicContact CZ-CD2 3.78Å; F138-L178 HydrophobicContact CZ-CG 3.83Å; A154-L178 HydrophobicContact CB-CD1 4.41Å; A173-L178 HydrophobicContact CB-CB 3.99Å; A173-L178 HydrophobicContact CB-CD1 4.5Å; A173-L178 PolarHBondContact O-N 3.09Å; H176-L178 HydrophobicContact CB-CG 4.34Å; H176-L178 PolarHBondContact O-N 3.45Å; L178-Q180 PolarHBondContact O-N 3.08Å; L178-L181 HydrophobicContact CB-CB 4.07Å; L178-L181 HydrophobicContact CD1-CD2 3.88Å; L178-L181 PolarHBondContact O-N 2.78Å; L178-A182 PolarHBondContact O-N 3.42Å
179	K	89.9	Confident	91.4	Very high	172 Å²	172	57.3 Å²	57.3	75%	0.748	29%	0.293	S	S	*	.	H	α-helix	trans	-50.6	-33.8	-173.7	-62	-176.8	-178.6	-177.5	0	114.9	A177 S183	A177-K179 PolarHBondContact O-N 3.06Å; K179-S183 VanDerWaalsContact O-CB 3.26Å; K179-S183 WeakPolarHBondContact O-CB 3.46Å; K179-S183 PolarHBondContact O-N 3.01Å; K179-S183 VanDerWaalsContact O-N 3.15Å
180	Q	91.4	Very high	91.5	Very high	156 Å²	156	56.6 Å²	56.6	73%	0.729	29%	0.289	S	S	*	.	H	α-helix	trans	-71.8	-44.4	177.7	-68.2	-173	0.4	0	0	112.4	L178 R184	L178-Q180 PolarHBondContact O-N 3.08Å; Q180-R184 WeakPolarHBondContact O-CG 3.41Å; Q180-R184 PolarHBondContact O-N 3.1Å; Q180-R184 VanDerWaalsContact O-N 3.1Å
181	L	92.1	Very high	91.4	Very high	7 Å²	7	58 Å²	58	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-66.2	-48.6	177.3	-178.5	60.4	0	0	0	110.1	A154 L157 E158 I169 A173 L178 S183 R184 C185	A154-L181 HydrophobicContact CB-CD2 4.4Å; L157-L181 HydrophobicContact CB-CD2 4.1Å; L157-L181 HydrophobicContact CD1-CD2 3.98Å; E158-L181 HydrophobicContact CB-CD1 3.9Å; E158-L181 HydrophobicContact CG-CD1 4.44Å; I169-L181 HydrophobicContact CG2-CD2 4.25Å; I169-L181 HydrophobicContact CG2-CG 4.44Å; A173-L181 HydrophobicContact CB-CB 4.03Å; A173-L181 HydrophobicContact CB-CD2 4.03Å; A173-L181 HydrophobicContact CB-CG 3.95Å; L178-L181 HydrophobicContact CB-CB 4.07Å; L178-L181 HydrophobicContact CD1-CD2 3.88Å; L178-L181 PolarHBondContact O-N 2.78Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.18Å; L181-R184 WeakPolarHBondContact O-CA 3.36Å; L181-R184 WeakPolarHBondContact O-CB 3.06Å; L181-R184 PolarHBondContact O-N 3.44Å; L181-C185 PolarHBondContact O-N 3.37Å; L181-C185 PolarHBondContact O-SG 3.44Å
182	A	92.5	Very high	91.5	Very high	6 Å²	6	55.3 Å²	55.3	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-55.1	-43.4	177.4	0	0	0	0	0	112.4	Q170 A173 D174 L178 C185 K186	Q170-A182 HydrophobicContact CG-CB 4.26Å; A173-A182 HydrophobicContact CB-CB 3.79Å; D174-A182 VanDerWaalsContact OD1-CB 3.28Å; D174-A182 WeakPolarHBondContact OD1-CB 3.44Å; L178-A182 PolarHBondContact O-N 3.42Å; A182-C185 PolarHBondContact O-N 2.63Å; A182-K186 WeakPolarHBondContact O-CB 3.49Å; A182-K186 PolarHBondContact O-N 3.21Å
183	S	92.9	Very high	91.7	Very high	62 Å²	62	54 Å²	54	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-62.2	-41	174.6	-176.8	0	0	0	0	112.8	K179 L181 K186 N187	K179-S183 VanDerWaalsContact O-CB 3.26Å; K179-S183 WeakPolarHBondContact O-CB 3.46Å; K179-S183 PolarHBondContact O-N 3.01Å; K179-S183 VanDerWaalsContact O-N 3.15Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.18Å; S183-K186 PolarHBondContact O-N 2.81Å; S183-N187 WeakPolarHBondContact O-CB 3.41Å; S183-N187 PolarHBondContact O-N 3.01Å; S183-N187 PolarHBondContact O-ND2 3.17Å; S183-N187 VanDerWaalsContact O-ND2 3.15Å
184	R	92	Very high	91.8	Very high	123 Å²	123	56.3 Å²	56.3	46%	0.464	31%	0.308	S	S	.	.	H	α-helix	trans	-66.9	-45.9	176.3	-72.2	-179.6	177.8	-178.4	-6	112	E158 Q180 L181 K186 N187 Y188	E158-R184 VanDerWaalsContact OE1-CD 3.28Å; E158-R184 WeakPolarHBondContact OE1-CD 3.42Å; E158-R184 IonicContact OE1-CZ 3.59Å; E158-R184 IonicContact OE1-NE 3.69Å; E158-R184 IonicContact OE1-NH1 2.7Å; E158-R184 PolarHBondContact OE1-NH1 3.46Å; E158-R184 VanDerWaalsContact OE2-CD 3.24Å; E158-R184 WeakPolarHBondContact OE2-CD 3.27Å; E158-R184 IonicContact OE2-CZ 3.02Å; E158-R184 IonicContact OE2-NE 2.75Å; E158-R184 IonicContact OE2-NH1 3.32Å; E158-R184 PolarHBondContact OE2-NH1 3.08Å; Q180-R184 WeakPolarHBondContact O-CG 3.41Å; Q180-R184 PolarHBondContact O-N 3.1Å; Q180-R184 VanDerWaalsContact O-N 3.1Å; L181-R184 WeakPolarHBondContact O-CA 3.36Å; L181-R184 WeakPolarHBondContact O-CB 3.06Å; L181-R184 PolarHBondContact O-N 3.44Å; R184-K186 VanDerWaalsContact C-N 3.33Å; R184-K186 PolarHBondContact O-N 3.46Å; R184-N187 PolarHBondContact O-N 3.47Å; R184-Y188 WeakPolarHBondContact O-CB 3.45Å; R184-Y188 PolarHBondContact O-N 3.13Å
185	C	94	Very high	91.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.1	-47.4	173.5	-59.1	0	0	0	0	111.3	L161 I169 Q170 L181 A182 N187 Y188 A189	L161-C185 HydrophobicContact CD2-CB 4.29Å; L161-C185 VanDerWaalsContact CD2-SG 3.59Å; I169-C185 VanDerWaalsContact CG2-SG 3.6Å; Q170-C185 HydrophobicContact CB-CB 3.67Å; Q170-C185 HydrophobicContact CG-CB 4.17Å; L181-C185 PolarHBondContact O-N 3.37Å; L181-C185 PolarHBondContact O-SG 3.44Å; A182-C185 PolarHBondContact O-N 2.63Å; C185-N187 PolarHBondContact O-N 3.43Å; C185-Y188 WeakPolarHBondContact O-CB 3.39Å; C185-Y188 PolarHBondContact O-N 3.33Å; C185-A189 WeakPolarHBondContact O-CB 3.45Å; C185-A189 PolarHBondContact O-N 3.38Å
186	K	92.9	Very high	92.2	Very high	29 Å²	29	53.5 Å²	53.5	13%	0.126	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-44.8	179.5	-169.7	169	175.9	175.8	0	112.6	A182 S183 R184 Y188 A189 L190 D212 Y213	A182-K186 WeakPolarHBondContact O-CB 3.49Å; A182-K186 PolarHBondContact O-N 3.21Å; S183-K186 PolarHBondContact O-N 2.81Å; R184-K186 VanDerWaalsContact C-N 3.33Å; R184-K186 PolarHBondContact O-N 3.46Å; K186-Y188 VanDerWaalsContact C-N 3.32Å; K186-Y188 PolarHBondContact O-N 3.22Å; K186-A189 PolarHBondContact O-N 2.94Å; K186-L190 HydrophobicContact CG-CD1 4.14Å; K186-L190 HydrophobicContact CG-CG 4.49Å; K186-L190 WeakPolarHBondContact O-CB 3.44Å; K186-L190 VanDerWaalsContact O-CG 3.25Å; K186-L190 WeakPolarHBondContact O-CG 3.29Å; K186-L190 PolarHBondContact O-N 2.74Å; K186-D212 IonicContact NZ-OD1 3.53Å; K186-D212 PolarHBondContact NZ-OD1 3.23Å; K186-D212 IonicContact NZ-OD2 2.71Å; K186-D212 PolarHBondContact NZ-OD2 3.08Å; K186-Y213 HydrophobicContact CG-CE1 4.08Å
187	N	93.2	Very high	92.6	Very high	82 Å²	82	51 Å²	51	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-37.9	177.5	-66.9	-23.3	0	0	0	111.7	S183 R184 C185 L190 A191	S183-N187 WeakPolarHBondContact O-CB 3.41Å; S183-N187 PolarHBondContact O-N 3.01Å; S183-N187 PolarHBondContact O-ND2 3.17Å; S183-N187 VanDerWaalsContact O-ND2 3.15Å; R184-N187 PolarHBondContact O-N 3.47Å; C185-N187 PolarHBondContact O-N 3.43Å; N187-L190 PolarHBondContact O-N 3.4Å; N187-A191 WeakPolarHBondContact O-CB 3.11Å; N187-A191 PolarHBondContact O-N 3.42Å
188	Y	94.3	Very high	92.8	Very high	69 Å²	69	52.1 Å²	52.1	27%	0.271	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-44.8	173.6	-177.4	-82.8	0	0	0	111.9	L161 P163 C166 R184 C185 K186 A191 N192	L161-Y188 HydrophobicContact CB-CD1 4.46Å; L161-Y188 HydrophobicContact CB-CD2 4.23Å; L161-Y188 HydrophobicContact CB-CE2 4.27Å; L161-Y188 HydrophobicContact CB-CG 4.32Å; L161-Y188 PolarHBondContact O-OH 3.04Å; P163-Y188 WeakPolarHBondContact CD-OH 3.32Å; P163-Y188 HydrophobicContact CG-CE1 4.39Å; C166-Y188 HydrophobicContact CB-CD1 3.83Å; C166-Y188 HydrophobicContact CB-CE1 4.27Å; R184-Y188 WeakPolarHBondContact O-CB 3.45Å; R184-Y188 PolarHBondContact O-N 3.13Å; C185-Y188 WeakPolarHBondContact O-CB 3.39Å; C185-Y188 PolarHBondContact O-N 3.33Å; K186-Y188 VanDerWaalsContact C-N 3.32Å; K186-Y188 PolarHBondContact O-N 3.22Å; Y188-A191 PolarHBondContact O-N 3.19Å; Y188-N192 PolarHBondContact O-N 2.89Å; Y188-N192 PolarHBondContact O-ND2 3.4Å; Y188-N192 VanDerWaalsContact O-ND2 3.11Å
189	A	93.9	Very high	93.1	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-38.3	177.3	0	0	0	0	0	112.4	C185 K186 A191 F193 Y213	C185-A189 WeakPolarHBondContact O-CB 3.45Å; C185-A189 PolarHBondContact O-N 3.38Å; K186-A189 PolarHBondContact O-N 2.94Å; A189-A191 VanDerWaalsContact C-N 3.35Å; A189-F193 VanDerWaalsContact O-CA 3.29Å; A189-F193 WeakPolarHBondContact O-CA 3.24Å; A189-F193 PolarHBondContact O-N 3.02Å; A189-Y213 HydrophobicContact CB-CE1 3.97Å
190	L	93.1	Very high	93.1	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-65.7	-35.6	173.4	-72.3	168.5	0	0	0	112.3	K186 N187 Y213 L219 F220	K186-L190 HydrophobicContact CG-CD1 4.14Å; K186-L190 HydrophobicContact CG-CG 4.49Å; K186-L190 WeakPolarHBondContact O-CB 3.44Å; K186-L190 VanDerWaalsContact O-CG 3.25Å; K186-L190 WeakPolarHBondContact O-CG 3.29Å; K186-L190 PolarHBondContact O-N 2.74Å; N187-L190 PolarHBondContact O-N 3.4Å; L190-Y213 HydrophobicContact CD2-CD1 3.92Å; L190-Y213 HydrophobicContact CG-CD1 4.32Å; L190-L219 HydrophobicContact CD2-CB 4.36Å; L190-L219 HydrophobicContact CD2-CD1 3.63Å; L190-F220 WeakPolarHBondContact O-CB 3.39Å; L190-F220 PolarHBondContact O-N 2.97Å
191	A	91.9	Very high	93.2	Very high	47 Å²	47	48.8 Å²	48.8	39%	0.388	25%	0.249	S	C	.	.	H	α-helix	trans	-74.1	-33.9	178.8	0	0	0	0	0	113.4	N187 Y188 A189 F220	N187-A191 WeakPolarHBondContact O-CB 3.11Å; N187-A191 PolarHBondContact O-N 3.42Å; Y188-A191 PolarHBondContact O-N 3.19Å; A189-A191 VanDerWaalsContact C-N 3.35Å; A191-F220 WeakPolarHBondContact O-CB 3.42Å; A191-F220 WeakPolarHBondContact O-CD1 3.46Å
192	N	93.4	Very high	93.3	Very high	50 Å²	50	48.6 Å²	48.6	27%	0.267	25%	0.248	S	C	.	.	S	Bend	trans	-110.6	23.5	-176.6	-58.4	-63.9	0	0	0	113.1	Y188 S194 E195 V196	Y188-N192 PolarHBondContact O-N 2.89Å; Y188-N192 PolarHBondContact O-ND2 3.4Å; Y188-N192 VanDerWaalsContact O-ND2 3.11Å; N192-S194 PolarHBondContact O-N 3.5Å; N192-S194 VanDerWaalsContact O-N 3.07Å; N192-E195 PolarHBondContact O-N 3.2Å; N192-V196 HydrophobicContact CB-CG2 4.42Å; N192-V196 WeakPolarHBondContact O-CG2 3.37Å; N192-V196 PolarHBondContact O-N 3.01Å; N192-V196 VanDerWaalsContact O-N 3.1Å
193	F	94.6	Very high	93.3	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-53.5	-35.5	-170.5	-177.9	-97.7	0	0	0	114.3	A189 E195 V196 S197 F202 I214 L219 V221 I226 A230	A189-F193 VanDerWaalsContact O-CA 3.29Å; A189-F193 WeakPolarHBondContact O-CA 3.24Å; A189-F193 PolarHBondContact O-N 3.02Å; F193-E195 PolarHBondContact O-N 3.11Å; F193-V196 PolarHBondContact O-N 3.39Å; F193-S197 VanDerWaalsContact O-CB 3.3Å; F193-S197 WeakPolarHBondContact O-CB 3.48Å; F193-S197 PolarHBondContact O-N 3.29Å; F193-S197 PolarHBondContact O-OG 3.05Å; F193-F202 AromaticContact CE2-CE2 3.72Å; F193-F202 HydrophobicContact CE2-CE2 3.72Å; F193-F202 HydrophobicContact CE2-CZ 4.2Å; F193-F202 HydrophobicContact CZ-CE2 4.13Å; F193-F202 HydrophobicContact CZ-CZ 4.13Å; F193-I214 HydrophobicContact CZ-CG2 4.21Å; F193-L219 HydrophobicContact CB-CD1 3.85Å; F193-L219 HydrophobicContact CD1-CD1 4.12Å; F193-L219 HydrophobicContact CD1-CD2 4.45Å; F193-L219 HydrophobicContact CD1-CG 4.47Å; F193-L219 HydrophobicContact CD2-CD1 3.56Å; F193-L219 HydrophobicContact CE1-CD2 4.45Å; F193-L219 HydrophobicContact CE2-CD1 4.07Å; F193-L219 HydrophobicContact CG-CD1 3.57Å; F193-L219 HydrophobicContact CG-CG 4.34Å; F193-V221 HydrophobicContact CD1-CG1 3.77Å; F193-V221 HydrophobicContact CE1-CG1 4.47Å; F193-I226 HydrophobicContact CD1-CG2 4.44Å; F193-A230 HydrophobicContact CE1-CB 3.88Å; F193-A230 HydrophobicContact CZ-CB 3.81Å
194	S	93	Very high	93.3	Very high	49 Å²	49	51.4 Å²	51.4	34%	0.343	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-29.9	176.8	52	0	0	0	0	113.8	N192 S197 N198	N192-S194 PolarHBondContact O-N 3.5Å; N192-S194 VanDerWaalsContact O-N 3.07Å; S194-S197 PolarHBondContact O-OG 3.22Å; S194-N198 PolarHBondContact O-ND2 3.39Å
195	E	93.8	Very high	93.3	Very high	106 Å²	106	45.7 Å²	45.7	50%	0.495	24%	0.236	S	C	.	.	H	α-helix	trans	-89.3	-49.6	176.9	-66.6	178.6	-167.1	0	0	110.2	P163 N192 F193 S197 N198 H199	P163-E195 HydrophobicContact CB-CB 3.92Å; P163-E195 HydrophobicContact CG-CB 4.2Å; N192-E195 PolarHBondContact O-N 3.2Å; F193-E195 PolarHBondContact O-N 3.11Å; E195-S197 PolarHBondContact O-N 2.98Å; E195-S197 VanDerWaalsContact O-N 3.14Å; E195-N198 PolarHBondContact O-N 2.88Å; E195-N198 PolarHBondContact O-ND2 3Å; E195-H199 PolarHBondContact O-CD2 2.92Å; E195-H199 VanDerWaalsContact O-CD2 3.29Å
196	V	94.4	Very high	93.3	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-49.8	-41.4	177.4	178	0	0	0	0	112.4	P163 V167 N192 F193 N198 H199 F202	P163-V196 HydrophobicContact CB-CG2 4.02Å; V167-V196 HydrophobicContact CG2-CG1 3.95Å; N192-V196 HydrophobicContact CB-CG2 4.42Å; N192-V196 WeakPolarHBondContact O-CG2 3.37Å; N192-V196 PolarHBondContact O-N 3.01Å; N192-V196 VanDerWaalsContact O-N 3.1Å; F193-V196 PolarHBondContact O-N 3.39Å; V196-N198 PolarHBondContact O-N 3.29Å; V196-H199 PolarHBondContact O-N 3.18Å; V196-H199 VanDerWaalsContact O-N 3.11Å; V196-F202 HydrophobicContact CG1-CD2 4.36Å; V196-F202 WeakPolarHBondContact O-CB 3.25Å
197	S	94.5	Very high	93.3	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.021	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.5	-179.5	63.2	0	0	0	0	115.7	F193 S194 E195	F193-S197 VanDerWaalsContact O-CB 3.3Å; F193-S197 WeakPolarHBondContact O-CB 3.48Å; F193-S197 PolarHBondContact O-N 3.29Å; F193-S197 PolarHBondContact O-OG 3.05Å; S194-S197 PolarHBondContact O-OG 3.22Å; E195-S197 PolarHBondContact O-N 2.98Å; E195-S197 VanDerWaalsContact O-N 3.14Å
198	N	93.6	Very high	93.3	Very high	95 Å²	95	55 Å²	55	51%	0.508	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-4.9	175.8	-53.2	-66.9	0	0	0	114	S194 E195 V196 K233	S194-N198 PolarHBondContact O-ND2 3.39Å; E195-N198 PolarHBondContact O-N 2.88Å; E195-N198 PolarHBondContact O-ND2 3Å; V196-N198 PolarHBondContact O-N 3.29Å; N198-K233 PolarHBondContact OD1-NZ 3.42Å
199	H	94.6	Very high	93.3	Very high	68 Å²	68	53.1 Å²	53.1	32%	0.315	27%	0.265	S	S	.	.	S	Bend	trans	-98.3	154.9	-176.7	-64.7	-72.9	0	0	0	112.6	P163 C164 E195 V196 E201 F202	P163-H199 PolarHBondContact O-CD2 2.97Å; C164-H199 HydrophobicContact CB-CB 4.45Å; E195-H199 PolarHBondContact O-CD2 2.92Å; E195-H199 VanDerWaalsContact O-CD2 3.29Å; V196-H199 PolarHBondContact O-N 3.18Å; V196-H199 VanDerWaalsContact O-N 3.11Å; H199-E201 VanDerWaalsContact C-N 3.35Å; H199-E201 PolarHBondContact O-N 3.2Å; H199-F202 WeakPolarHBondContact O-CB 3.41Å; H199-F202 PolarHBondContact O-N 3.06Å
200	E	90.1	Very high	93.3	Very high	161 Å²	161	53 Å²	53	75%	0.752	26%	0.264	S	S	*	.	H	α-helix	trans	-62.1	-37.7	-174.5	-64	-175.2	157.8	0	0	112.9	F202 L203 D204	E200-F202 PolarHBondContact O-N 3.13Å; E200-F202 VanDerWaalsContact O-N 3.09Å; E200-L203 WeakPolarHBondContact O-CA 3.49Å; E200-L203 WeakPolarHBondContact O-CB 3.46Å; E200-L203 PolarHBondContact O-N 3.1Å; E200-D204 PolarHBondContact O-N 3.1Å
201	E	92	Very high	93.4	Very high	56 Å²	56	54.5 Å²	54.5	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-57	-29.3	177.6	-62	-165.4	150.8	0	0	113.5	C164 N165 V167 G168 H199	C164-E201 WeakPolarHBondContact O-CG 3.34Å; N165-E201 WeakPolarHBondContact CA-OE2 3.37Å; V167-E201 HydrophobicContact CB-CB 3.99Å; V167-E201 HydrophobicContact CG1-CB 4.28Å; V167-E201 PolarHBondContact N-OE2 2.85Å; G168-E201 WeakPolarHBondContact CA-OE1 3.33Å; G168-E201 VanDerWaalsContact N-CD 3.32Å; G168-E201 PolarHBondContact N-OE1 3.08Å; G168-E201 PolarHBondContact N-OE2 3.08Å; H199-E201 VanDerWaalsContact C-N 3.35Å; H199-E201 PolarHBondContact O-N 3.2Å
202	F	94.3	Very high	93.5	Very high	3 Å²	3	55.5 Å²	55.5	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-72	-35.9	175.4	178.2	-94.9	0	0	0	111.8	F193 V196 H199 E200 D204 L205 L210 A230 W234	F193-F202 AromaticContact CE2-CE2 3.72Å; F193-F202 HydrophobicContact CE2-CE2 3.72Å; F193-F202 HydrophobicContact CE2-CZ 4.2Å; F193-F202 HydrophobicContact CZ-CE2 4.13Å; F193-F202 HydrophobicContact CZ-CZ 4.13Å; V196-F202 HydrophobicContact CG1-CD2 4.36Å; V196-F202 WeakPolarHBondContact O-CB 3.25Å; H199-F202 WeakPolarHBondContact O-CB 3.41Å; H199-F202 PolarHBondContact O-N 3.06Å; E200-F202 PolarHBondContact O-N 3.13Å; E200-F202 VanDerWaalsContact O-N 3.09Å; F202-D204 PolarHBondContact O-N 3.22Å; F202-L205 HydrophobicContact CD2-CD1 3.51Å; F202-L205 HydrophobicContact CE2-CD1 3.78Å; F202-L205 HydrophobicContact CG-CD1 4.23Å; F202-L205 WeakPolarHBondContact O-CB 3.44Å; F202-L205 WeakPolarHBondContact O-CG 3.36Å; F202-L205 PolarHBondContact O-N 3.03Å; F202-L210 HydrophobicContact CE1-CD1 4.4Å; F202-L210 HydrophobicContact CE2-CD1 3.76Å; F202-L210 HydrophobicContact CZ-CD1 3.46Å; F202-L210 VanDerWaalsContact CZ-CD1 3.46Å; F202-A230 HydrophobicContact CE1-CB 4.03Å; F202-A230 HydrophobicContact CZ-CB 3.91Å; F202-W234 HydrophobicContact CE1-CB 4.41Å
203	L	93.1	Very high	93.5	Very high	32 Å²	32	53.5 Å²	53.5	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-26	176.7	-56.4	178.1	0	0	0	111.8	E200 L205 K233 W234 H237 R242	E200-L203 WeakPolarHBondContact O-CA 3.49Å; E200-L203 WeakPolarHBondContact O-CB 3.46Å; E200-L203 PolarHBondContact O-N 3.1Å; L203-L205 VanDerWaalsContact C-N 3.35Å; L203-K233 HydrophobicContact CD2-CB 4.31Å; L203-W234 PolarHBondContact O-NE1 3.19Å; L203-H237 HydrophobicContact CB-CB 4.47Å; L203-H237 HydrophobicContact CD2-CB 4.42Å; L203-R242 VanDerWaalsContact O-CZ 3.31Å; L203-R242 PolarHBondContact O-NH1 2.9Å; L203-R242 PolarHBondContact O-NH2 3.16Å
204	D	92.2	Very high	93.5	Very high	94 Å²	94	53.4 Å²	53.4	50%	0.503	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-0.6	175.3	-80.3	-20.9	0	0	0	115.1	R171 E200 F202	R171-D204 PolarHBondContact NH1-O 3.33Å; E200-D204 PolarHBondContact O-N 3.1Å; F202-D204 PolarHBondContact O-N 3.22Å
205	L	93.1	Very high	93.4	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	26%	0.257	C	S	.	.			trans	-61.9	142.3	174.5	-75.9	174.5	0	0	0	112	V167 F202 L203 E209 L210 Y213 W234	V167-L205 HydrophobicContact CG1-CD2 3.5Å; V167-L205 VanDerWaalsContact CG1-CD2 3.5Å; V167-L205 HydrophobicContact CG1-CG 4.11Å; F202-L205 HydrophobicContact CD2-CD1 3.51Å; F202-L205 HydrophobicContact CE2-CD1 3.78Å; F202-L205 HydrophobicContact CG-CD1 4.23Å; F202-L205 WeakPolarHBondContact O-CB 3.44Å; F202-L205 WeakPolarHBondContact O-CG 3.36Å; F202-L205 PolarHBondContact O-N 3.03Å; L203-L205 VanDerWaalsContact C-N 3.35Å; L205-E209 HydrophobicContact CD2-CB 3.97Å; L205-L210 HydrophobicContact CD1-CD1 4.48Å; L205-Y213 HydrophobicContact CD1-CD2 3.96Å; L205-Y213 HydrophobicContact CD1-CE2 3.92Å; L205-Y213 HydrophobicContact CD2-CE2 4.03Å; L205-W234 WeakPolarHBondContact O-CZ2 3.3Å; L205-W234 PolarHBondContact O-NE1 2.82Å
206	R	93.2	Very high	93.2	Very high	160 Å²	160	51.4 Å²	51.4	60%	0.604	25%	0.248	S	C	*	.			trans	-75.9	153.7	168.8	-58.2	173.4	-73	175.2	-2.5	109.7	E208 E209 L210	R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 3.24Å; R206-E209 HydrophobicContact CB-CG 4.37Å; R206-E209 WeakPolarHBondContact CB-OE2 3.39Å; R206-E209 VanDerWaalsContact CG-OE2 3.31Å; R206-E209 WeakPolarHBondContact CG-OE2 3.3Å; R206-E209 IonicContact CZ-OE1 2.91Å; R206-E209 IonicContact CZ-OE2 3.27Å; R206-E209 PolarHBondContact N-OE2 3Å; R206-E209 IonicContact NE-OE1 3.88Å; R206-E209 PolarHBondContact NE-OE1 3.48Å; R206-E209 IonicContact NE-OE2 3.89Å; R206-E209 PolarHBondContact NE-OE2 2.94Å; R206-E209 IonicContact NH2-OE1 2.8Å; R206-E209 PolarHBondContact NH2-OE1 3.39Å; R206-E209 IonicContact NH2-OE2 2.73Å; R206-E209 WeakPolarHBondContact O-CB 3.24Å; R206-E209 PolarHBondContact O-N 2.89Å; R206-L210 PolarHBondContact O-N 3.5Å
207	I	93.3	Very high	92.7	Very high	29 Å²	29	55.5 Å²	55.5	15%	0.149	27%	0.267	C	S	.	.	H	α-helix	trans	-53.4	-42.4	-177.2	-168.6	-165.9	0	0	0	113.2	E209 L210 K211 W234 M245 L249	I207-E209 VanDerWaalsContact C-N 3.34Å; I207-E209 PolarHBondContact O-N 3.15Å; I207-L210 PolarHBondContact O-N 3.22Å; I207-K211 HydrophobicContact CG1-CD 4.32Å; I207-K211 HydrophobicContact CG1-CG 4.44Å; I207-K211 WeakPolarHBondContact O-CB 3.45Å; I207-K211 VanDerWaalsContact O-CG 3.27Å; I207-K211 WeakPolarHBondContact O-CG 3.37Å; I207-K211 PolarHBondContact O-N 3.06Å; I207-W234 HydrophobicContact CB-CH2 4.28Å; I207-M245 HydrophobicContact CB-CE 3.76Å; I207-M245 HydrophobicContact CD1-CB 3.82Å; I207-M245 HydrophobicContact CD1-CE 3.98Å; I207-M245 HydrophobicContact CD1-CG 4.07Å; I207-M245 HydrophobicContact CD1-SD 4.48Å; I207-M245 HydrophobicContact CG1-CE 4.28Å; I207-M245 HydrophobicContact CG2-CE 3.74Å; I207-L249 HydrophobicContact CG1-CD2 4Å; I207-L249 HydrophobicContact CG1-CG 4.42Å
208	E	93.9	Very high	92.3	Very high	118 Å²	118	59.1 Å²	59.1	55%	0.551	29%	0.286	S	S	*	.	H	α-helix	trans	-71.1	-30.1	-178.2	-58.3	-51.3	130.3	0	0	112.5	R206 K211 D212	R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 3.24Å; E208-K211 IonicContact OE1-NZ 3.93Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 WeakPolarHBondContact OE2-CD 3.38Å; E208-K211 IonicContact OE2-NZ 3.35Å; E208-K211 PolarHBondContact OE2-NZ 3.22Å; E208-D212 WeakPolarHBondContact O-CB 3.44Å; E208-D212 PolarHBondContact O-N 2.85Å
209	E	92.7	Very high	92.2	Very high	28 Å²	28	54.6 Å²	54.6	13%	0.131	26%	0.262	C	S	.	.	H	α-helix	trans	-70.5	-45.8	172.1	-61.5	167	140.7	0	0	110	L205 R206 I207 K211 D212 Y213	L205-E209 HydrophobicContact CD2-CB 3.97Å; R206-E209 HydrophobicContact CB-CG 4.37Å; R206-E209 WeakPolarHBondContact CB-OE2 3.39Å; R206-E209 VanDerWaalsContact CG-OE2 3.31Å; R206-E209 WeakPolarHBondContact CG-OE2 3.3Å; R206-E209 IonicContact CZ-OE1 2.91Å; R206-E209 IonicContact CZ-OE2 3.27Å; R206-E209 PolarHBondContact N-OE2 3Å; R206-E209 IonicContact NE-OE1 3.88Å; R206-E209 PolarHBondContact NE-OE1 3.48Å; R206-E209 IonicContact NE-OE2 3.89Å; R206-E209 PolarHBondContact NE-OE2 2.94Å; R206-E209 IonicContact NH2-OE1 2.8Å; R206-E209 PolarHBondContact NH2-OE1 3.39Å; R206-E209 IonicContact NH2-OE2 2.73Å; R206-E209 WeakPolarHBondContact O-CB 3.24Å; R206-E209 PolarHBondContact O-N 2.89Å; I207-E209 VanDerWaalsContact C-N 3.34Å; I207-E209 PolarHBondContact O-N 3.15Å; E209-K211 PolarHBondContact O-N 3.38Å; E209-D212 PolarHBondContact O-N 3.43Å; E209-Y213 WeakPolarHBondContact O-CD2 3.34Å; E209-Y213 PolarHBondContact O-N 2.57Å; E209-Y213 VanDerWaalsContact O-N 3.08Å
210	L	94.8	Very high	92	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-46.3	177.3	179.6	59.8	0	0	0	111.9	F202 L205 R206 I207 D212 Y213 I214 W234 L249	F202-L210 HydrophobicContact CE1-CD1 4.4Å; F202-L210 HydrophobicContact CE2-CD1 3.76Å; F202-L210 HydrophobicContact CZ-CD1 3.46Å; F202-L210 VanDerWaalsContact CZ-CD1 3.46Å; L205-L210 HydrophobicContact CD1-CD1 4.48Å; R206-L210 PolarHBondContact O-N 3.5Å; I207-L210 PolarHBondContact O-N 3.22Å; L210-D212 VanDerWaalsContact C-N 3.3Å; L210-D212 PolarHBondContact O-N 3.06Å; L210-Y213 PolarHBondContact O-N 3.47Å; L210-Y213 VanDerWaalsContact O-N 3.15Å; L210-I214 HydrophobicContact CD1-CG2 3.95Å; L210-I214 WeakPolarHBondContact O-CG1 3.39Å; L210-I214 PolarHBondContact O-N 3.48Å; L210-W234 HydrophobicContact CD2-CB 4.05Å; L210-W234 HydrophobicContact CD2-CD2 3.51Å; L210-W234 HydrophobicContact CD2-CE3 3.88Å; L210-W234 HydrophobicContact CD2-CG 3.57Å; L210-L249 HydrophobicContact CB-CD2 4.49Å; L210-L249 HydrophobicContact CD2-CD1 4Å; L210-L249 HydrophobicContact CD2-CD2 3.81Å; L210-L249 HydrophobicContact CG-CD2 4.02Å
211	K	95	Very high	92	Very high	35 Å²	35	47.8 Å²	47.8	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-54.5	-44.1	174.3	-77.4	170.2	175.3	175.4	0	112.5	I207 E208 E209 Y213 I214 G215 S248 L249	I207-K211 HydrophobicContact CG1-CD 4.32Å; I207-K211 HydrophobicContact CG1-CG 4.44Å; I207-K211 WeakPolarHBondContact O-CB 3.45Å; I207-K211 VanDerWaalsContact O-CG 3.27Å; I207-K211 WeakPolarHBondContact O-CG 3.37Å; I207-K211 PolarHBondContact O-N 3.06Å; E208-K211 IonicContact OE1-NZ 3.93Å; E208-K211 PolarHBondContact OE1-NZ 3.37Å; E208-K211 WeakPolarHBondContact OE2-CD 3.38Å; E208-K211 IonicContact OE2-NZ 3.35Å; E208-K211 PolarHBondContact OE2-NZ 3.22Å; E209-K211 PolarHBondContact O-N 3.38Å; K211-Y213 VanDerWaalsContact C-N 3.35Å; K211-I214 PolarHBondContact O-N 3.16Å; K211-G215 WeakPolarHBondContact O-CA 3.38Å; K211-G215 PolarHBondContact O-N 3.05Å; K211-S248 WeakPolarHBondContact CE-OG 3.48Å; K211-S248 PolarHBondContact NZ-OG 3.32Å; K211-L249 HydrophobicContact CG-CD2 3.96Å
212	D	93.1	Very high	91.8	Very high	69 Å²	69	49 Å²	49	37%	0.369	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-33.4	178.7	172.4	27.7	0	0	0	112	K186 E208 E209 L210 R216	K186-D212 IonicContact NZ-OD1 3.53Å; K186-D212 PolarHBondContact NZ-OD1 3.23Å; K186-D212 IonicContact NZ-OD2 2.71Å; K186-D212 PolarHBondContact NZ-OD2 3.08Å; E208-D212 WeakPolarHBondContact O-CB 3.44Å; E208-D212 PolarHBondContact O-N 2.85Å; E209-D212 PolarHBondContact O-N 3.43Å; L210-D212 VanDerWaalsContact C-N 3.3Å; L210-D212 PolarHBondContact O-N 3.06Å; D212-R216 WeakPolarHBondContact O-CD 3.41Å; D212-R216 WeakPolarHBondContact O-CG 3.37Å
213	Y	93.6	Very high	91.6	Very high	7 Å²	7	55 Å²	55	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-57.7	167.7	-71	-72.6	0	0	0	112.6	Q170 K186 A189 L190 L205 E209 L210 K211 G215 R216	Q170-Y213 PolarHBondContact NE2-OH 2.91Å; Q170-Y213 PolarHBondContact OE1-OH 3.46Å; K186-Y213 HydrophobicContact CG-CE1 4.08Å; A189-Y213 HydrophobicContact CB-CE1 3.97Å; L190-Y213 HydrophobicContact CD2-CD1 3.92Å; L190-Y213 HydrophobicContact CG-CD1 4.32Å; L205-Y213 HydrophobicContact CD1-CD2 3.96Å; L205-Y213 HydrophobicContact CD1-CE2 3.92Å; L205-Y213 HydrophobicContact CD2-CE2 4.03Å; E209-Y213 WeakPolarHBondContact O-CD2 3.34Å; E209-Y213 PolarHBondContact O-N 2.57Å; E209-Y213 VanDerWaalsContact O-N 3.08Å; L210-Y213 PolarHBondContact O-N 3.47Å; L210-Y213 VanDerWaalsContact O-N 3.15Å; K211-Y213 VanDerWaalsContact C-N 3.35Å; Y213-G215 VanDerWaalsContact C-N 3.3Å; Y213-G215 PolarHBondContact O-N 3.08Å; Y213-R216 PolarHBondContact O-N 2.74Å
214	I	94.5	Very high	91.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-71.5	-23.7	-170.9	66.9	176.8	0	0	0	113.3	F193 L210 K211 V227 V231 L249 H252 R304	F193-I214 HydrophobicContact CZ-CG2 4.21Å; L210-I214 HydrophobicContact CD1-CG2 3.95Å; L210-I214 WeakPolarHBondContact O-CG1 3.39Å; L210-I214 PolarHBondContact O-N 3.48Å; K211-I214 PolarHBondContact O-N 3.16Å; I214-V227 HydrophobicContact CB-CG1 3.94Å; I214-V227 HydrophobicContact CG2-CG1 3.89Å; I214-V231 HydrophobicContact CD1-CG2 3.69Å; I214-V231 HydrophobicContact CG2-CG2 4.14Å; I214-L249 HydrophobicContact CD1-CB 4.26Å; I214-L249 HydrophobicContact CD1-CD2 3.98Å; I214-H252 HydrophobicContact CD1-CB 3.84Å; I214-H252 HydrophobicContact CG1-CB 3.68Å; I214-R304 VanDerWaalsContact O-CZ 3.3Å; I214-R304 PolarHBondContact O-NH1 3.41Å; I214-R304 PolarHBondContact O-NH2 2.66Å
215	G	91.8	Very high	91.7	Very high	33 Å²	33	50.5 Å²	50.5	34%	0.34	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-17.6	179.5	0	0	0	0	0	114.7	K211 Y213	K211-G215 WeakPolarHBondContact O-CA 3.38Å; K211-G215 PolarHBondContact O-N 3.05Å; Y213-G215 VanDerWaalsContact C-N 3.3Å; Y213-G215 PolarHBondContact O-N 3.08Å
216	R	90.3	Very high	91.8	Very high	80 Å²	80	52 Å²	52	30%	0.302	25%	0.253	S	S	.	.			trans	-79.6	144	-171.8	-77.5	173.9	75.9	114.2	-1.3	114.6	D212 Y213 D218 R304	D212-R216 WeakPolarHBondContact O-CD 3.41Å; D212-R216 WeakPolarHBondContact O-CG 3.37Å; Y213-R216 PolarHBondContact O-N 2.74Å; R216-D218 VanDerWaalsContact C-N 3.35Å; R216-D218 VanDerWaalsContact CB-OD1 3.28Å; R216-D218 WeakPolarHBondContact CB-OD1 3.12Å; R216-D218 IonicContact CZ-OD1 2.64Å; R216-D218 IonicContact CZ-OD2 2.79Å; R216-D218 IonicContact NE-OD1 2.74Å; R216-D218 PolarHBondContact NE-OD1 3.41Å; R216-D218 IonicContact NE-OD2 2.57Å; R216-D218 IonicContact NH2-OD1 3.96Å; R216-D218 IonicContact NH2-OD2 3.88Å; R216-D218 PolarHBondContact NH2-OD2 2.96Å; R216-R304 PolarHBondContact O-NH1 3.44Å
217	E	84.1	Confident	91.9	Very high	91 Å²	91	44.4 Å²	44.4	43%	0.425	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-22.3	175.8	-66.8	-163.2	165.1	0	0	114.4	R305	E217-R305 IonicContact OE2-CZ 3.76Å; E217-R305 IonicContact OE2-NE 3.94Å; E217-R305 PolarHBondContact OE2-NE 2.91Å; E217-R305 IonicContact OE2-NH2 3.23Å; E217-R305 PolarHBondContact OE2-NH2 3.17Å
218	D	85.9	Confident	92.1	Very high	78 Å²	78	43.2 Å²	43.2	42%	0.417	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.1	-177.8	60.9	-1.9	0	0	0	113.8	R216 F220	R216-D218 VanDerWaalsContact C-N 3.35Å; R216-D218 VanDerWaalsContact CB-OD1 3.28Å; R216-D218 WeakPolarHBondContact CB-OD1 3.12Å; R216-D218 IonicContact CZ-OD1 2.64Å; R216-D218 IonicContact CZ-OD2 2.79Å; R216-D218 IonicContact NE-OD1 2.74Å; R216-D218 PolarHBondContact NE-OD1 3.41Å; R216-D218 IonicContact NE-OD2 2.57Å; R216-D218 IonicContact NH2-OD1 3.96Å; R216-D218 IonicContact NH2-OD2 3.88Å; R216-D218 PolarHBondContact NH2-OD2 2.96Å; D218-F220 PolarHBondContact O-N 3Å
219	L	90.6	Very high	92.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.			trans	-54.4	122.4	171.2	-174.9	71.8	0	0	0	111	L190 F193 V221 V227 S306	L190-L219 HydrophobicContact CD2-CB 4.36Å; L190-L219 HydrophobicContact CD2-CD1 3.63Å; F193-L219 HydrophobicContact CB-CD1 3.85Å; F193-L219 HydrophobicContact CD1-CD1 4.12Å; F193-L219 HydrophobicContact CD1-CD2 4.45Å; F193-L219 HydrophobicContact CD1-CG 4.47Å; F193-L219 HydrophobicContact CD2-CD1 3.56Å; F193-L219 HydrophobicContact CE1-CD2 4.45Å; F193-L219 HydrophobicContact CE2-CD1 4.07Å; F193-L219 HydrophobicContact CG-CD1 3.57Å; F193-L219 HydrophobicContact CG-CG 4.34Å; L219-V221 HydrophobicContact CD2-CG1 4.47Å; L219-V221 HydrophobicContact CG-CG1 4.4Å; L219-V221 PolarHBondContact O-N 3.39Å; L219-V227 HydrophobicContact CD2-CG1 4.38Å; L219-V227 HydrophobicContact CD2-CG2 3.82Å; L219-S306 WeakPolarHBondContact O-CB 3.35Å; L219-S306 PolarHBondContact O-OG 2.98Å
220	F	89.6	Confident	92.4	Very high	84 Å²	84	40 Å²	40	37%	0.368	20%	0.203	S	C	.	.			trans	-88.4	101.3	-175.9	-163.5	-92.7	0	0	0	112	L190 A191 D218	L190-F220 WeakPolarHBondContact O-CB 3.39Å; L190-F220 PolarHBondContact O-N 2.97Å; A191-F220 WeakPolarHBondContact O-CB 3.42Å; A191-F220 WeakPolarHBondContact O-CD1 3.46Å; D218-F220 PolarHBondContact O-N 3Å
221	V	90.1	Very high	92.4	Very high	2 Å²	2	40 Å²	40	1%	0.012	20%	0.203	C	C	.	.			trans	-138.6	144.6	174.9	-70	0	0	0	0	110.1	F193 L219 I226 V227 S306 T307	F193-V221 HydrophobicContact CD1-CG1 3.77Å; F193-V221 HydrophobicContact CE1-CG1 4.47Å; L219-V221 HydrophobicContact CD2-CG1 4.47Å; L219-V221 HydrophobicContact CG-CG1 4.4Å; L219-V221 PolarHBondContact O-N 3.39Å; V221-I226 HydrophobicContact CG1-CB 4.23Å; V221-I226 HydrophobicContact CG1-CG2 4.08Å; V221-V227 HydrophobicContact CB-CG2 4.48Å; V221-V227 HydrophobicContact CG1-CG2 3.98Å; V221-V227 HydrophobicContact CG2-CG2 3.99Å; V221-S306 PolarHBondContact N-OG 3.02Å; V221-S306 CarbonylContact O-C 3.59Å; V221-S306 PolarHBondContact O-OG 2.96Å; V221-T307 PolarHBondContact O-N 3.45Å
222	S	87.8	Confident	92.5	Very high	81 Å²	81	38.8 Å²	38.8	57%	0.566	20%	0.198	S	C	*	.	S	Bend	trans	-76	-29.9	175.6	55.4	0	0	0	0	112.4	I226	S222-I226 WeakPolarHBondContact OG-CD1 3.39Å
223	K	90.9	Very high	92.6	Very high	130 Å²	130	39.4 Å²	39.4	57%	0.565	20%	0.197	S	C	*	.	S	Bend	trans	-149.9	160.5	177.7	-39.1	179.1	-179.5	175.6	0	111.1	E225	K223-E225 VanDerWaalsContact C-N 3.33Å; K223-E225 WeakPolarHBondContact CB-OE2 3.28Å; K223-E225 PolarHBondContact O-N 3.1Å
224	E	93.3	Very high	92.7	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.033	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-21.7	-177	-164.6	69.9	-171.8	0	0	113	I226 V227 F228 V253 R254 L258 R304	E224-I226 PolarHBondContact O-N 2.75Å; E224-I226 VanDerWaalsContact O-N 3.16Å; E224-V227 WeakPolarHBondContact O-CB 3.42Å; E224-V227 PolarHBondContact O-N 3.24Å; E224-F228 PolarHBondContact O-N 2.9Å; E224-F228 VanDerWaalsContact O-N 3.11Å; E224-V253 HydrophobicContact CG-CG1 4.22Å; E224-R254 HydrophobicContact CG-CB 3.81Å; E224-R254 WeakPolarHBondContact OE1-CB 3.33Å; E224-R254 WeakPolarHBondContact OE1-CG 3.46Å; E224-R254 PolarHBondContact OE1-N 3.34Å; E224-L258 HydrophobicContact CB-CD1 4.39Å; E224-L258 HydrophobicContact CG-CD1 4.19Å; E224-R304 IonicContact OE1-CZ 3.67Å; E224-R304 IonicContact OE1-NE 2.78Å; E224-R304 PolarHBondContact OE1-NE 2.95Å; E224-R304 IonicContact OE1-NH2 3.8Å; E224-R304 PolarHBondContact OE1-NH2 3.49Å; E224-R304 IonicContact OE2-CZ 2.68Å; E224-R304 IonicContact OE2-NE 3.01Å; E224-R304 PolarHBondContact OE2-NE 3.35Å; E224-R304 IonicContact OE2-NH2 3.99Å
225	E	95	Very high	92.8	Very high	24 Å²	24	39.3 Å²	39.3	11%	0.112	20%	0.197	C	C	.	.	H	α-helix	trans	-50.8	-38.4	173.7	-69.7	79.3	176.3	0	0	111.7	K223 V227 F228 E229 L258 H259 Y262	K223-E225 VanDerWaalsContact C-N 3.33Å; K223-E225 WeakPolarHBondContact CB-OE2 3.28Å; K223-E225 PolarHBondContact O-N 3.1Å; E225-V227 VanDerWaalsContact C-N 3.29Å; E225-V227 PolarHBondContact O-N 3.23Å; E225-F228 PolarHBondContact O-N 2.86Å; E225-E229 WeakPolarHBondContact O-CB 3.41Å; E225-E229 WeakPolarHBondContact O-CG 3.5Å; E225-E229 PolarHBondContact O-N 2.87Å; E225-L258 HydrophobicContact CG-CD2 4.08Å; E225-L258 HydrophobicContact CG-CG 4.24Å; E225-H259 PolarHBondContact OE1-N 3.31Å; E225-Y262 HydrophobicContact CB-CE1 4.42Å; E225-Y262 HydrophobicContact CB-CE2 4.33Å; E225-Y262 HydrophobicContact CG-CD1 3.9Å; E225-Y262 HydrophobicContact CG-CD2 3.96Å; E225-Y262 HydrophobicContact CG-CE1 3.96Å; E225-Y262 HydrophobicContact CG-CE2 3.99Å; E225-Y262 HydrophobicContact CG-CG 3.91Å
226	I	94.7	Very high	92.9	Very high	37 Å²	37	43 Å²	43	19%	0.19	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-38.2	178.1	-58.6	175.2	0	0	0	111.3	F193 V221 S222 E224 A230	F193-I226 HydrophobicContact CD1-CG2 4.44Å; V221-I226 HydrophobicContact CG1-CB 4.23Å; V221-I226 HydrophobicContact CG1-CG2 4.08Å; S222-I226 WeakPolarHBondContact OG-CD1 3.39Å; E224-I226 PolarHBondContact O-N 2.75Å; E224-I226 VanDerWaalsContact O-N 3.16Å; I226-A230 VanDerWaalsContact O-CB 3.31Å; I226-A230 WeakPolarHBondContact O-CB 3.4Å; I226-A230 PolarHBondContact O-N 3.04Å
227	V	95.9	Very high	93.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-72.3	-40.6	179.1	-169.6	0	0	0	0	110.4	I214 L219 V221 E224 E225 A230 V231 V253	I214-V227 HydrophobicContact CB-CG1 3.94Å; I214-V227 HydrophobicContact CG2-CG1 3.89Å; L219-V227 HydrophobicContact CD2-CG1 4.38Å; L219-V227 HydrophobicContact CD2-CG2 3.82Å; V221-V227 HydrophobicContact CB-CG2 4.48Å; V221-V227 HydrophobicContact CG1-CG2 3.98Å; V221-V227 HydrophobicContact CG2-CG2 3.99Å; E224-V227 WeakPolarHBondContact O-CB 3.42Å; E224-V227 PolarHBondContact O-N 3.24Å; E225-V227 VanDerWaalsContact C-N 3.29Å; E225-V227 PolarHBondContact O-N 3.23Å; V227-A230 PolarHBondContact O-N 3.32Å; V227-V231 WeakPolarHBondContact O-CG2 3.26Å; V227-V231 PolarHBondContact O-N 3.11Å; V227-V253 HydrophobicContact CG1-CG2 4.34Å
228	F	96.6	Very high	93.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-49.9	173.8	177	-99.3	0	0	0	111.4	E224 E225 A230 V231 M232 L250 V253 L255 L258 Y262 T266 V267 I273	E224-F228 PolarHBondContact O-N 2.9Å; E224-F228 VanDerWaalsContact O-N 3.11Å; E225-F228 PolarHBondContact O-N 2.86Å; F228-A230 VanDerWaalsContact C-N 3.34Å; F228-A230 PolarHBondContact O-N 3.47Å; F228-V231 PolarHBondContact O-N 3.46Å; F228-M232 HydrophobicContact CD1-CG 4.22Å; F228-M232 HydrophobicContact CD2-CG 4.29Å; F228-M232 HydrophobicContact CE1-CG 3.73Å; F228-M232 HydrophobicContact CE2-CG 3.81Å; F228-M232 HydrophobicContact CE2-SD 4.06Å; F228-M232 HydrophobicContact CG-CG 4.47Å; F228-M232 HydrophobicContact CZ-CG 3.5Å; F228-M232 HydrophobicContact CZ-SD 4.04Å; F228-M232 WeakPolarHBondContact O-CG 3.28Å; F228-M232 PolarHBondContact O-N 2.75Å; F228-L250 HydrophobicContact CD2-CD2 4.03Å; F228-L250 HydrophobicContact CE2-CD2 4.02Å; F228-V253 HydrophobicContact CB-CG1 4.09Å; F228-L255 HydrophobicContact CD2-CD2 4.1Å; F228-L258 HydrophobicContact CB-CD2 4.12Å; F228-L258 HydrophobicContact CG-CD2 4.25Å; F228-Y262 AromaticContact CD1-CE1 3.98Å; F228-Y262 HydrophobicContact CD1-CE1 3.98Å; F228-Y262 HydrophobicContact CE1-CE1 4.35Å; F228-T266 HydrophobicContact CE1-CG2 4.29Å; F228-V267 HydrophobicContact CD1-CG2 4.27Å; F228-V267 HydrophobicContact CD2-CG2 4.36Å; F228-V267 HydrophobicContact CE1-CG2 3.89Å; F228-V267 HydrophobicContact CE2-CB 4.42Å; F228-V267 HydrophobicContact CE2-CG1 3.87Å; F228-V267 HydrophobicContact CE2-CG2 3.99Å; F228-V267 HydrophobicContact CG-CG2 4.5Å; F228-V267 HydrophobicContact CZ-CB 4.14Å; F228-V267 HydrophobicContact CZ-CG1 4.02Å; F228-V267 HydrophobicContact CZ-CG2 3.75Å; F228-I273 HydrophobicContact CE2-CD1 3.76Å; F228-I273 HydrophobicContact CZ-CD1 3.75Å
229	E	95.9	Very high	93.9	Very high	77 Å²	77	40.5 Å²	40.5	36%	0.36	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-40.2	178.7	-72.6	173.5	-169.2	0	0	112.4	E225 M232 K233 Y262	E225-E229 WeakPolarHBondContact O-CB 3.41Å; E225-E229 WeakPolarHBondContact O-CG 3.5Å; E225-E229 PolarHBondContact O-N 2.87Å; E229-M232 PolarHBondContact O-N 3.33Å; E229-K233 WeakPolarHBondContact O-CB 3.27Å; E229-K233 VanDerWaalsContact O-CG 3.24Å; E229-K233 WeakPolarHBondContact O-CG 3.29Å; E229-K233 PolarHBondContact O-N 3Å; E229-Y262 WeakPolarHBondContact CG-OH 3.47Å; E229-Y262 PolarHBondContact OE1-OH 3.48Å
230	A	96.2	Very high	93.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-44.8	174.7	0	0	0	0	0	112.1	F193 F202 I226 V227 F228 W234	F193-A230 HydrophobicContact CE1-CB 3.88Å; F193-A230 HydrophobicContact CZ-CB 3.81Å; F202-A230 HydrophobicContact CE1-CB 4.03Å; F202-A230 HydrophobicContact CZ-CB 3.91Å; I226-A230 VanDerWaalsContact O-CB 3.31Å; I226-A230 WeakPolarHBondContact O-CB 3.4Å; I226-A230 PolarHBondContact O-N 3.04Å; V227-A230 PolarHBondContact O-N 3.32Å; F228-A230 VanDerWaalsContact C-N 3.34Å; F228-A230 PolarHBondContact O-N 3.47Å; A230-W234 PolarHBondContact O-N 2.68Å
231	V	96.7	Very high	94	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-44.9	175.8	168.2	0	0	0	0	111.2	I214 V227 F228 W234 V235 L249 V253	I214-V231 HydrophobicContact CD1-CG2 3.69Å; I214-V231 HydrophobicContact CG2-CG2 4.14Å; V227-V231 WeakPolarHBondContact O-CG2 3.26Å; V227-V231 PolarHBondContact O-N 3.11Å; F228-V231 PolarHBondContact O-N 3.46Å; V231-W234 PolarHBondContact O-N 2.68Å; V231-V235 WeakPolarHBondContact O-CG2 3.3Å; V231-V235 PolarHBondContact O-N 3.45Å; V231-L249 HydrophobicContact CG1-CB 3.78Å; V231-L249 HydrophobicContact CG1-CD1 4.19Å; V231-V253 HydrophobicContact CG2-CG2 3.98Å
232	M	95.8	Very high	94.2	Very high	10 Å²	10	51.7 Å²	51.7	5%	0.049	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-42.6	179.5	-65.6	-53.5	-67.4	0	0	111.9	F228 E229 W234 V235 Y236 L246 D270 I273	F228-M232 HydrophobicContact CD1-CG 4.22Å; F228-M232 HydrophobicContact CD2-CG 4.29Å; F228-M232 HydrophobicContact CE1-CG 3.73Å; F228-M232 HydrophobicContact CE2-CG 3.81Å; F228-M232 HydrophobicContact CE2-SD 4.06Å; F228-M232 HydrophobicContact CG-CG 4.47Å; F228-M232 HydrophobicContact CZ-CG 3.5Å; F228-M232 HydrophobicContact CZ-SD 4.04Å; F228-M232 WeakPolarHBondContact O-CG 3.28Å; F228-M232 PolarHBondContact O-N 2.75Å; E229-M232 PolarHBondContact O-N 3.33Å; M232-W234 VanDerWaalsContact C-N 3.29Å; M232-W234 PolarHBondContact O-N 3.08Å; M232-V235 PolarHBondContact O-N 3.13Å; M232-V235 VanDerWaalsContact O-N 3.16Å; M232-Y236 HydrophobicContact CB-CD2 4.33Å; M232-Y236 HydrophobicContact CE-CD2 4.35Å; M232-Y236 HydrophobicContact CE-CE2 3.73Å; M232-Y236 WeakPolarHBondContact O-CB 3.47Å; M232-Y236 VanDerWaalsContact O-CD2 3.26Å; M232-Y236 WeakPolarHBondContact O-CD2 3.14Å; M232-Y236 PolarHBondContact O-N 2.67Å; M232-L246 HydrophobicContact SD-CD1 3.82Å; M232-D270 VanDerWaalsContact CE-OD2 3.22Å; M232-D270 WeakPolarHBondContact CE-OD2 3.45Å; M232-I273 HydrophobicContact CE-CD1 4.31Å; M232-I273 HydrophobicContact CE-CG1 4.39Å; M232-I273 HydrophobicContact SD-CD1 4.25Å
233	K	95.3	Very high	94.3	Very high	82 Å²	82	53.4 Å²	53.4	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-54.3	-45.4	171.7	-76.7	168.5	-178	168.5	0	111.7	N198 L203 E229 Y236 H237	N198-K233 PolarHBondContact OD1-NZ 3.42Å; L203-K233 HydrophobicContact CD2-CB 4.31Å; E229-K233 WeakPolarHBondContact O-CB 3.27Å; E229-K233 VanDerWaalsContact O-CG 3.24Å; E229-K233 WeakPolarHBondContact O-CG 3.29Å; E229-K233 PolarHBondContact O-N 3Å; K233-Y236 PolarHBondContact O-N 3.47Å; K233-H237 PolarHBondContact O-N 2.91Å; K233-H237 VanDerWaalsContact O-N 3.16Å
234	W	96.3	Very high	94.3	Very high	5 Å²	5	52.4 Å²	52.4	2%	0.019	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-43.3	177	-174.4	95.3	0	0	0	112.1	F202 L203 L205 I207 L210 A230 V231 M232 R242 M245 L249	F202-W234 HydrophobicContact CE1-CB 4.41Å; L203-W234 PolarHBondContact O-NE1 3.19Å; L205-W234 WeakPolarHBondContact O-CZ2 3.3Å; L205-W234 PolarHBondContact O-NE1 2.82Å; I207-W234 HydrophobicContact CB-CH2 4.28Å; L210-W234 HydrophobicContact CD2-CB 4.05Å; L210-W234 HydrophobicContact CD2-CD2 3.51Å; L210-W234 HydrophobicContact CD2-CE3 3.88Å; L210-W234 HydrophobicContact CD2-CG 3.57Å; A230-W234 PolarHBondContact O-N 2.68Å; V231-W234 PolarHBondContact O-N 2.68Å; M232-W234 VanDerWaalsContact C-N 3.29Å; M232-W234 PolarHBondContact O-N 3.08Å; W234-R242 VanDerWaalsContact CE2-CZ 3.44Å; W234-R242 HydrophobicContact CE3-CB 4.3Å; W234-R242 HydrophobicContact CE3-CG 4.18Å; W234-R242 HydrophobicContact CH2-CB 4.31Å; W234-R242 HydrophobicContact CH2-CG 3.69Å; W234-R242 HydrophobicContact CZ2-CG 4.38Å; W234-R242 HydrophobicContact CZ3-CB 3.74Å; W234-R242 HydrophobicContact CZ3-CG 3.58Å; W234-R242 WeakPolarHBondContact O-CD 3.48Å; W234-R242 PolarHBondContact O-NH1 3.48Å; W234-M245 HydrophobicContact CH2-SD 3.86Å; W234-M245 HydrophobicContact CZ3-SD 4.28Å; W234-L249 HydrophobicContact CE3-CD1 3.68Å; W234-L249 HydrophobicContact CZ3-CD1 3.61Å
235	V	95.4	Very high	94.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-44.2	177.5	174.1	0	0	0	0	111.6	V231 M232 H237 N238 V239 R242 L246 L249 L272	V231-V235 WeakPolarHBondContact O-CG2 3.3Å; V231-V235 PolarHBondContact O-N 3.45Å; M232-V235 PolarHBondContact O-N 3.13Å; M232-V235 VanDerWaalsContact O-N 3.16Å; V235-H237 VanDerWaalsContact C-N 3.26Å; V235-H237 PolarHBondContact O-N 3.31Å; V235-N238 CarbonylContact O-C 3.49Å; V235-N238 PolarHBondContact O-N 3.47Å; V235-V239 PolarHBondContact O-N 3.16Å; V235-R242 HydrophobicContact CB-CB 4.48Å; V235-R242 HydrophobicContact CG1-CB 4.26Å; V235-R242 HydrophobicContact CG2-CB 4.5Å; V235-L246 HydrophobicContact CG2-CD1 4.1Å; V235-L249 HydrophobicContact CG2-CD1 4.14Å; V235-L272 HydrophobicContact CG1-CD1 3.97Å
236	Y	94.8	Very high	94.2	Very high	111 Å²	111	53.8 Å²	53.8	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-25.6	-179.9	-86	-64.4	0	0	0	114.2	M232 K233 N238 V239 D270 L272	M232-Y236 HydrophobicContact CB-CD2 4.33Å; M232-Y236 HydrophobicContact CE-CD2 4.35Å; M232-Y236 HydrophobicContact CE-CE2 3.73Å; M232-Y236 WeakPolarHBondContact O-CB 3.47Å; M232-Y236 VanDerWaalsContact O-CD2 3.26Å; M232-Y236 WeakPolarHBondContact O-CD2 3.14Å; M232-Y236 PolarHBondContact O-N 2.67Å; K233-Y236 PolarHBondContact O-N 3.47Å; Y236-N238 PolarHBondContact O-N 2.85Å; Y236-V239 HydrophobicContact CD1-CG2 3.93Å; Y236-D270 PolarHBondContact OH-OD2 3.24Å; Y236-L272 HydrophobicContact CD1-CD1 3.98Å; Y236-L272 HydrophobicContact CE1-CD1 3.53Å; Y236-L272 HydrophobicContact CE1-CG 4.06Å; Y236-L272 HydrophobicContact CE2-CD1 4.19Å; Y236-L272 HydrophobicContact CG-CD1 4.48Å
237	H	94.3	Very high	94.2	Very high	103 Å²	103	54 Å²	54	48%	0.477	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-27.7	176	-177.7	84.7	0	0	0	113.5	L203 K233 V235	L203-H237 HydrophobicContact CB-CB 4.47Å; L203-H237 HydrophobicContact CD2-CB 4.42Å; K233-H237 PolarHBondContact O-N 2.91Å; K233-H237 VanDerWaalsContact O-N 3.16Å; V235-H237 VanDerWaalsContact C-N 3.26Å; V235-H237 PolarHBondContact O-N 3.31Å
238	N	93.4	Very high	94.1	Very high	49 Å²	49	55.8 Å²	55.8	26%	0.262	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.5	74.3	174.4	-176.1	-19.6	0	0	0	110	V235 Y236 D240 Q241 R242	V235-N238 CarbonylContact O-C 3.49Å; V235-N238 PolarHBondContact O-N 3.47Å; Y236-N238 PolarHBondContact O-N 2.85Å; N238-D240 VanDerWaalsContact C-N 3.33Å; N238-D240 PolarHBondContact O-N 3.31Å; N238-Q241 PolarHBondContact ND2-OE1 2.81Å; N238-Q241 PolarHBondContact O-N 3.23Å; N238-Q241 WeakPolarHBondContact OD1-CB 3.47Å; N238-Q241 WeakPolarHBondContact OD1-CG 3.31Å; N238-Q241 PolarHBondContact OD1-N 3.2Å; N238-R242 HydrophobicContact CB-CG 4.21Å; N238-R242 WeakPolarHBondContact O-CB 3.34Å; N238-R242 VanDerWaalsContact O-CG 3.23Å; N238-R242 WeakPolarHBondContact O-CG 3.3Å; N238-R242 PolarHBondContact O-N 3.11Å
239	V	93.2	Very high	94	Very high	45 Å²	45	55.6 Å²	55.6	27%	0.273	27%	0.273	S	S	.	.	H	α-helix	trans	-55.3	-45.6	-172.5	178	0	0	0	0	112.3	V235 Y236 Q241 R242 R243 L272	V235-V239 PolarHBondContact O-N 3.16Å; Y236-V239 HydrophobicContact CD1-CG2 3.93Å; V239-Q241 VanDerWaalsContact C-N 3.34Å; V239-Q241 PolarHBondContact O-N 3.35Å; V239-R242 PolarHBondContact O-N 2.92Å; V239-R243 WeakPolarHBondContact O-CB 3.5Å; V239-R243 PolarHBondContact O-N 3.03Å; V239-L272 HydrophobicContact CG1-CD1 4.33Å; V239-L272 HydrophobicContact CG1-CD2 3.74Å; V239-L272 HydrophobicContact CG2-CD1 4.48Å
240	D	90.6	Very high	93.9	Very high	151 Å²	151	52 Å²	52	81%	0.807	26%	0.256	S	S	*	.	H	α-helix	trans	-60.7	-40.9	-173.4	-63.9	-43.3	0	0	0	112.7	N238	N238-D240 VanDerWaalsContact C-N 3.33Å; N238-D240 PolarHBondContact O-N 3.31Å
241	Q	92.3	Very high	93.8	Very high	142 Å²	142	55.9 Å²	55.9	66%	0.664	28%	0.275	S	S	*	.	H	α-helix	trans	-88.3	-30.5	179.3	-61.1	-178.4	7.8	0	0	112.8	N238 V239	N238-Q241 PolarHBondContact ND2-OE1 2.81Å; N238-Q241 PolarHBondContact O-N 3.23Å; N238-Q241 WeakPolarHBondContact OD1-CB 3.47Å; N238-Q241 WeakPolarHBondContact OD1-CG 3.31Å; N238-Q241 PolarHBondContact OD1-N 3.2Å; V239-Q241 VanDerWaalsContact C-N 3.34Å; V239-Q241 PolarHBondContact O-N 3.35Å
242	R	93.7	Very high	93.7	Very high	28 Å²	28	59.2 Å²	59.2	11%	0.106	29%	0.29	C	S	.	.	H	α-helix	trans	-93.9	-19.5	-170.7	-61.5	177.4	176.1	-168.7	-4.1	113.9	L203 W234 V235 N238 V239 M245 L246	L203-R242 VanDerWaalsContact O-CZ 3.31Å; L203-R242 PolarHBondContact O-NH1 2.9Å; L203-R242 PolarHBondContact O-NH2 3.16Å; W234-R242 VanDerWaalsContact CE2-CZ 3.44Å; W234-R242 HydrophobicContact CE3-CB 4.3Å; W234-R242 HydrophobicContact CE3-CG 4.18Å; W234-R242 HydrophobicContact CH2-CB 4.31Å; W234-R242 HydrophobicContact CH2-CG 3.69Å; W234-R242 HydrophobicContact CZ2-CG 4.38Å; W234-R242 HydrophobicContact CZ3-CB 3.74Å; W234-R242 HydrophobicContact CZ3-CG 3.58Å; W234-R242 WeakPolarHBondContact O-CD 3.48Å; W234-R242 PolarHBondContact O-NH1 3.48Å; V235-R242 HydrophobicContact CB-CB 4.48Å; V235-R242 HydrophobicContact CG1-CB 4.26Å; V235-R242 HydrophobicContact CG2-CB 4.5Å; N238-R242 HydrophobicContact CB-CG 4.21Å; N238-R242 WeakPolarHBondContact O-CB 3.34Å; N238-R242 VanDerWaalsContact O-CG 3.23Å; N238-R242 WeakPolarHBondContact O-CG 3.3Å; N238-R242 PolarHBondContact O-N 3.11Å; V239-R242 PolarHBondContact O-N 2.92Å; R242-M245 HydrophobicContact CB-SD 4.45Å; R242-M245 HydrophobicContact CG-SD 4.34Å; R242-M245 WeakPolarHBondContact O-CA 3.44Å; R242-M245 VanDerWaalsContact O-CB 3.28Å; R242-M245 WeakPolarHBondContact O-CB 3.29Å; R242-M245 PolarHBondContact O-N 3.14Å; R242-L246 PolarHBondContact O-N 3.28Å
243	R	90.4	Very high	93.7	Very high	116 Å²	116	58.7 Å²	58.7	44%	0.438	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-53.8	-45.1	177.5	176.7	178	173.1	-165.8	-4	114.1	V239 M245 L246 N275	V239-R243 WeakPolarHBondContact O-CB 3.5Å; V239-R243 PolarHBondContact O-N 3.03Å; R243-M245 PolarHBondContact O-N 3.3Å; R243-M245 VanDerWaalsContact O-N 3.15Å; R243-L246 VanDerWaalsContact O-CB 3.28Å; R243-L246 WeakPolarHBondContact O-CB 3.45Å; R243-L246 PolarHBondContact O-N 3.04Å; R243-N275 PolarHBondContact NH2-O 3.08Å
244	P	91	Very high	93.6	Very high	109 Å²	109	55.7 Å²	55.7	71%	0.708	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.1	177.1	-21.8	34.4	0	0	0	113.9
245	M	92.8	Very high	93.5	Very high	59 Å²	59	55.5 Å²	55.5	29%	0.291	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-87.1	-15.5	-176.7	-54.4	166.4	120.3	0	0	112.4	I207 W234 R242 R243 N247 S248 L249	I207-M245 HydrophobicContact CB-CE 3.76Å; I207-M245 HydrophobicContact CD1-CB 3.82Å; I207-M245 HydrophobicContact CD1-CE 3.98Å; I207-M245 HydrophobicContact CD1-CG 4.07Å; I207-M245 HydrophobicContact CD1-SD 4.48Å; I207-M245 HydrophobicContact CG1-CE 4.28Å; I207-M245 HydrophobicContact CG2-CE 3.74Å; W234-M245 HydrophobicContact CH2-SD 3.86Å; W234-M245 HydrophobicContact CZ3-SD 4.28Å; R242-M245 HydrophobicContact CB-SD 4.45Å; R242-M245 HydrophobicContact CG-SD 4.34Å; R242-M245 WeakPolarHBondContact O-CA 3.44Å; R242-M245 VanDerWaalsContact O-CB 3.28Å; R242-M245 WeakPolarHBondContact O-CB 3.29Å; R242-M245 PolarHBondContact O-N 3.14Å; R243-M245 PolarHBondContact O-N 3.3Å; R243-M245 VanDerWaalsContact O-N 3.15Å; M245-N247 PolarHBondContact O-N 2.83Å; M245-S248 PolarHBondContact O-N 3.07Å; M245-S248 VanDerWaalsContact O-N 3.08Å; M245-L249 PolarHBondContact O-N 2.92Å
246	L	93.3	Very high	93.4	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-53.4	-50.5	-173.8	178	62.5	0	0	0	113.1	M232 V235 R242 R243 S248 L249 L250 L272 I273 A276	M232-L246 HydrophobicContact SD-CD1 3.82Å; V235-L246 HydrophobicContact CG2-CD1 4.1Å; R242-L246 PolarHBondContact O-N 3.28Å; R243-L246 VanDerWaalsContact O-CB 3.28Å; R243-L246 WeakPolarHBondContact O-CB 3.45Å; R243-L246 PolarHBondContact O-N 3.04Å; L246-S248 VanDerWaalsContact C-N 3.3Å; L246-S248 PolarHBondContact O-N 3.5Å; L246-L249 PolarHBondContact O-N 3.06Å; L246-L249 VanDerWaalsContact O-N 3.07Å; L246-L250 HydrophobicContact CD1-CD1 3.88Å; L246-L250 HydrophobicContact CD1-CD2 4.4Å; L246-L250 HydrophobicContact CD1-CG 3.9Å; L246-L250 HydrophobicContact CG-CD1 3.89Å; L246-L250 HydrophobicContact CG-CG 4.27Å; L246-L250 WeakPolarHBondContact O-CG 3.29Å; L246-L250 PolarHBondContact O-N 2.91Å; L246-L272 HydrophobicContact CD2-CB 4.32Å; L246-I273 HydrophobicContact CD2-CG1 4.11Å; L246-A276 HydrophobicContact CD2-CB 4.48Å
247	N	93.5	Very high	93.2	Very high	43 Å²	43	52.6 Å²	52.6	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-55.9	-45.2	177.7	175.5	19.2	0	0	0	111.6	M245 L249 L250 Q251 E278	M245-N247 PolarHBondContact O-N 2.83Å; N247-L249 PolarHBondContact O-N 3.35Å; N247-L250 PolarHBondContact O-N 3.49Å; N247-Q251 WeakPolarHBondContact O-CG 3.39Å; N247-Q251 PolarHBondContact O-N 3.11Å; N247-Q251 VanDerWaalsContact O-N 3.1Å; N247-Q251 PolarHBondContact OD1-NE2 3.1Å; N247-E278 HydrophobicContact CB-CB 4.14Å; N247-E278 WeakPolarHBondContact ND2-CB 3.45Å
248	S	94.1	Very high	93.1	Very high	36 Å²	36	47.9 Å²	47.9	25%	0.252	24%	0.243	S	C	.	.	H	α-helix	trans	-66.3	-24.7	-179.6	-169.9	0	0	0	0	113.1	K211 M245 L246 H252	K211-S248 WeakPolarHBondContact CE-OG 3.48Å; K211-S248 PolarHBondContact NZ-OG 3.32Å; M245-S248 PolarHBondContact O-N 3.07Å; M245-S248 VanDerWaalsContact O-N 3.08Å; L246-S248 VanDerWaalsContact C-N 3.3Å; L246-S248 PolarHBondContact O-N 3.5Å; S248-H252 PolarHBondContact O-CD2 3.07Å; S248-H252 VanDerWaalsContact O-CD2 3.24Å
249	L	94.7	Very high	93.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-82.6	-45.5	173.8	-66.1	170.7	0	0	0	111.3	I207 L210 K211 I214 V231 W234 V235 M245 L246 N247 Q251 H252	I207-L249 HydrophobicContact CG1-CD2 4Å; I207-L249 HydrophobicContact CG1-CG 4.42Å; L210-L249 HydrophobicContact CB-CD2 4.49Å; L210-L249 HydrophobicContact CD2-CD1 4Å; L210-L249 HydrophobicContact CD2-CD2 3.81Å; L210-L249 HydrophobicContact CG-CD2 4.02Å; K211-L249 HydrophobicContact CG-CD2 3.96Å; I214-L249 HydrophobicContact CD1-CB 4.26Å; I214-L249 HydrophobicContact CD1-CD2 3.98Å; V231-L249 HydrophobicContact CG1-CB 3.78Å; V231-L249 HydrophobicContact CG1-CD1 4.19Å; W234-L249 HydrophobicContact CE3-CD1 3.68Å; W234-L249 HydrophobicContact CZ3-CD1 3.61Å; V235-L249 HydrophobicContact CG2-CD1 4.14Å; M245-L249 PolarHBondContact O-N 2.92Å; L246-L249 PolarHBondContact O-N 3.06Å; L246-L249 VanDerWaalsContact O-N 3.07Å; N247-L249 PolarHBondContact O-N 3.35Å; L249-Q251 PolarHBondContact O-N 3.18Å; L249-H252 PolarHBondContact O-N 2.97Å
250	L	94.4	Very high	93	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-25.1	178.9	-70	-179.6	0	0	0	113.3	F228 L246 N247 H252 V253 I273 C279 L282	F228-L250 HydrophobicContact CD2-CD2 4.03Å; F228-L250 HydrophobicContact CE2-CD2 4.02Å; L246-L250 HydrophobicContact CD1-CD1 3.88Å; L246-L250 HydrophobicContact CD1-CD2 4.4Å; L246-L250 HydrophobicContact CD1-CG 3.9Å; L246-L250 HydrophobicContact CG-CD1 3.89Å; L246-L250 HydrophobicContact CG-CG 4.27Å; L246-L250 WeakPolarHBondContact O-CG 3.29Å; L246-L250 PolarHBondContact O-N 2.91Å; N247-L250 PolarHBondContact O-N 3.49Å; L250-H252 PolarHBondContact O-N 2.71Å; L250-V253 HydrophobicContact CD2-CB 4.49Å; L250-V253 HydrophobicContact CD2-CG2 4.25Å; L250-V253 PolarHBondContact O-N 2.92Å; L250-V253 VanDerWaalsContact O-N 3.1Å; L250-V253 VanDerWaalsContact O-O 3.14Å; L250-I273 HydrophobicContact CD1-CD1 4.43Å; L250-I273 HydrophobicContact CD1-CG1 4.48Å; L250-C279 HydrophobicContact CD1-CB 4.33Å; L250-L282 HydrophobicContact CB-CD1 3.82Å
251	Q	93.9	Very high	93.1	Very high	83 Å²	83	48.9 Å²	48.9	39%	0.388	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-25	172.2	-76.2	172.5	30.9	0	0	114.1	N247 L249 L282 R300	N247-Q251 WeakPolarHBondContact O-CG 3.39Å; N247-Q251 PolarHBondContact O-N 3.11Å; N247-Q251 VanDerWaalsContact O-N 3.1Å; N247-Q251 PolarHBondContact OD1-NE2 3.1Å; L249-Q251 PolarHBondContact O-N 3.18Å; Q251-L282 HydrophobicContact CG-CD1 4.02Å; Q251-L282 HydrophobicContact CG-CD2 4.23Å; Q251-R300 PolarHBondContact O-NH1 3.05Å; Q251-R300 VanDerWaalsContact O-NH1 3.11Å
252	H	94.5	Very high	93.2	Very high	69 Å²	69	44.2 Å²	44.2	32%	0.319	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-11.2	176.4	-60.5	-75.6	0	0	0	113.5	I214 S248 L249 L250 R304	I214-H252 HydrophobicContact CD1-CB 3.84Å; I214-H252 HydrophobicContact CG1-CB 3.68Å; S248-H252 PolarHBondContact O-CD2 3.07Å; S248-H252 VanDerWaalsContact O-CD2 3.24Å; L249-H252 PolarHBondContact O-N 2.97Å; L250-H252 PolarHBondContact O-N 2.71Å; H252-R304 PolarHBondContact O-NH2 2.82Å
253	V	94.9	Very high	93.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-83.4	132.4	171.4	-175.9	0	0	0	0	108.6	E224 V227 F228 V231 L250 L255 R300	E224-V253 HydrophobicContact CG-CG1 4.22Å; V227-V253 HydrophobicContact CG1-CG2 4.34Å; F228-V253 HydrophobicContact CB-CG1 4.09Å; V231-V253 HydrophobicContact CG2-CG2 3.98Å; L250-V253 HydrophobicContact CD2-CB 4.49Å; L250-V253 HydrophobicContact CD2-CG2 4.25Å; L250-V253 PolarHBondContact O-N 2.92Å; L250-V253 VanDerWaalsContact O-N 3.1Å; L250-V253 VanDerWaalsContact O-O 3.14Å; V253-L255 HydrophobicContact CB-CD2 4.47Å; V253-L255 HydrophobicContact CG1-CD2 3.89Å; V253-L255 HydrophobicContact CG1-CG 4.37Å; V253-L255 PolarHBondContact O-N 3.4Å; V253-R300 WeakPolarHBondContact O-CD 3.28Å
254	R	93.8	Very high	93.4	Very high	19 Å²	19	41.6 Å²	41.6	7%	0.072	22%	0.223	C	C	.	.			trans	-84.2	62.9	-176.2	-55.4	-179.7	-173.2	-157	-1.2	110.3	E224 P256 L257 R300 R302 P303 R304	E224-R254 HydrophobicContact CG-CB 3.81Å; E224-R254 WeakPolarHBondContact OE1-CB 3.33Å; E224-R254 WeakPolarHBondContact OE1-CG 3.46Å; E224-R254 PolarHBondContact OE1-N 3.34Å; R254-P256 VanDerWaalsContact C-N 3.27Å; R254-P256 VanDerWaalsContact O-N 3.09Å; R254-L257 HydrophobicContact CB-CB 4.44Å; R254-L257 HydrophobicContact CB-CD1 3.92Å; R254-L257 HydrophobicContact CB-CG 4.27Å; R254-L257 WeakPolarHBondContact O-CB 3.49Å; R254-L257 PolarHBondContact O-N 2.88Å; R254-R300 WeakPolarHBondContact CB-O 3.31Å; R254-R302 WeakPolarHBondContact CD-O 3.45Å; R254-R302 PolarHBondContact NH1-O 2.76Å; R254-P303 VanDerWaalsContact NH1-C 3.31Å; R254-P303 PolarHBondContact NH1-O 3.47Å; R254-P303 VanDerWaalsContact NH1-O 3.12Å; R254-R304 VanDerWaalsContact CZ-CG 3.45Å
255	L	94.2	Very high	93.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-47.5	-36.3	-175.5	-68.2	-178.4	0	0	0	115.9	F228 V253 L257 L258 V267 L282 L283 A286	F228-L255 HydrophobicContact CD2-CD2 4.1Å; V253-L255 HydrophobicContact CB-CD2 4.47Å; V253-L255 HydrophobicContact CG1-CD2 3.89Å; V253-L255 HydrophobicContact CG1-CG 4.37Å; V253-L255 PolarHBondContact O-N 3.4Å; L255-L257 PolarHBondContact O-N 3.49Å; L255-L257 VanDerWaalsContact O-N 3.14Å; L255-L258 HydrophobicContact CD2-CD1 3.94Å; L255-L258 WeakPolarHBondContact O-CD1 3.2Å; L255-L258 PolarHBondContact O-N 2.86Å; L255-V267 HydrophobicContact CD2-CG1 4.35Å; L255-L282 HydrophobicContact CD1-CB 3.97Å; L255-L283 HydrophobicContact CD1-CD2 4.36Å; L255-A286 HydrophobicContact CB-CB 4.02Å
256	P	92.8	Very high	93.6	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.013	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-60.6	-13.2	172.8	-26.8	37.4	0	0	0	116.2	R254 E285 A286 Y289 H290 R300 T301	R254-P256 VanDerWaalsContact C-N 3.27Å; R254-P256 VanDerWaalsContact O-N 3.09Å; P256-E285 HydrophobicContact CG-CG 4.33Å; P256-A286 HydrophobicContact CG-CB 4.39Å; P256-Y289 HydrophobicContact CB-CD1 3.61Å; P256-Y289 HydrophobicContact CB-CE1 4.25Å; P256-Y289 HydrophobicContact CB-CG 3.73Å; P256-Y289 WeakPolarHBondContact O-CD1 3.46Å; P256-Y289 WeakPolarHBondContact O-CE1 3.46Å; P256-H290 PolarHBondContact O-NE2 3.44Å; P256-R300 HydrophobicContact CG-CB 4.27Å; P256-T301 HydrophobicContact CB-CG2 3.88Å; P256-T301 HydrophobicContact CG-CG2 3.97Å
257	L	91.2	Very high	93.7	Very high	47 Å²	47	43.5 Å²	43.5	25%	0.246	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-107.9	1.4	-173.2	-57.5	-179	0	0	0	114.1	R254 L255 Y289 R302 P303	R254-L257 HydrophobicContact CB-CB 4.44Å; R254-L257 HydrophobicContact CB-CD1 3.92Å; R254-L257 HydrophobicContact CB-CG 4.27Å; R254-L257 WeakPolarHBondContact O-CB 3.49Å; R254-L257 PolarHBondContact O-N 2.88Å; L255-L257 PolarHBondContact O-N 3.49Å; L255-L257 VanDerWaalsContact O-N 3.14Å; L257-Y289 HydrophobicContact CD2-CE1 3.91Å; L257-R302 VanDerWaalsContact CD1-C 3.42Å; L257-R302 VanDerWaalsContact CD1-O 3.26Å; L257-R302 WeakPolarHBondContact CD1-O 3.38Å; L257-P303 HydrophobicContact CD1-CB 4.45Å
258	L	93.4	Very high	93.6	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.223	C	C	.	.	S	Bend	trans	-71.9	152.7	168.4	-72.9	88.2	0	0	0	109.7	E224 E225 F228 L255 Y262 V267 H290	E224-L258 HydrophobicContact CB-CD1 4.39Å; E224-L258 HydrophobicContact CG-CD1 4.19Å; E225-L258 HydrophobicContact CG-CD2 4.08Å; E225-L258 HydrophobicContact CG-CG 4.24Å; F228-L258 HydrophobicContact CB-CD2 4.12Å; F228-L258 HydrophobicContact CG-CD2 4.25Å; L255-L258 HydrophobicContact CD2-CD1 3.94Å; L255-L258 WeakPolarHBondContact O-CD1 3.2Å; L255-L258 PolarHBondContact O-N 2.86Å; L258-Y262 HydrophobicContact CD2-CD1 3.59Å; L258-Y262 HydrophobicContact CD2-CE1 3.61Å; L258-V267 HydrophobicContact CD2-CG2 3.91Å; L258-H290 PolarHBondContact O-NE2 2.78Å
259	H	91.6	Very high	93.4	Very high	108 Å²	108	43.6 Å²	43.6	50%	0.5	23%	0.232	S	C	.	.			trans	-60.7	131.3	174.6	-173.2	-92.6	0	0	0	110.8	E225 N261 Y262 F263	E225-H259 PolarHBondContact OE1-N 3.31Å; H259-N261 VanDerWaalsContact C-N 3.27Å; H259-N261 PolarHBondContact ND1-N 3.24Å; H259-N261 PolarHBondContact O-N 3.22Å; H259-N261 VanDerWaalsContact O-N 3.08Å; H259-Y262 WeakPolarHBondContact O-CA 3.28Å; H259-Y262 WeakPolarHBondContact O-CB 3.17Å; H259-Y262 PolarHBondContact O-N 2.98Å; H259-F263 PolarHBondContact O-N 3.29Å
260	P	91.4	Very high	93.4	Very high	57 Å²	57	44.6 Å²	44.6	37%	0.37	24%	0.237	S	C	.	.	H	α-helix	trans	-53.6	-38.1	-173	-31.1	36.2	0	0	0	114.9	F263 V264 H290	P260-F263 PolarHBondContact O-N 2.82Å; P260-V264 WeakPolarHBondContact O-CG2 3.26Å; P260-V264 PolarHBondContact O-N 3.48Å; P260-V264 VanDerWaalsContact O-N 3.13Å; P260-H290 HydrophobicContact CG-CB 4.42Å
261	N	92.6	Very high	93.3	Very high	102 Å²	102	51.4 Å²	51.4	55%	0.545	27%	0.269	S	S	.	.	H	α-helix	trans	-65.9	-39.1	176.4	-62	0.3	0	0	0	112.4	H259 Q265	H259-N261 VanDerWaalsContact C-N 3.27Å; H259-N261 PolarHBondContact ND1-N 3.24Å; H259-N261 PolarHBondContact O-N 3.22Å; H259-N261 VanDerWaalsContact O-N 3.08Å; N261-Q265 VanDerWaalsContact O-CB 3.28Å; N261-Q265 WeakPolarHBondContact O-CB 3.24Å; N261-Q265 VanDerWaalsContact O-CG 3.26Å; N261-Q265 WeakPolarHBondContact O-CG 3.4Å; N261-Q265 PolarHBondContact O-N 3Å
262	Y	95.1	Very high	93.2	Very high	44 Å²	44	48.4 Å²	48.4	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-41.4	178	-177.3	-75.1	0	0	0	110.2	E225 F228 E229 L258 H259 V264 Q265 T266 V267	E225-Y262 HydrophobicContact CB-CE1 4.42Å; E225-Y262 HydrophobicContact CB-CE2 4.33Å; E225-Y262 HydrophobicContact CG-CD1 3.9Å; E225-Y262 HydrophobicContact CG-CD2 3.96Å; E225-Y262 HydrophobicContact CG-CE1 3.96Å; E225-Y262 HydrophobicContact CG-CE2 3.99Å; E225-Y262 HydrophobicContact CG-CG 3.91Å; F228-Y262 AromaticContact CD1-CE1 3.98Å; F228-Y262 HydrophobicContact CD1-CE1 3.98Å; F228-Y262 HydrophobicContact CE1-CE1 4.35Å; E229-Y262 WeakPolarHBondContact CG-OH 3.47Å; E229-Y262 PolarHBondContact OE1-OH 3.48Å; L258-Y262 HydrophobicContact CD2-CD1 3.59Å; L258-Y262 HydrophobicContact CD2-CE1 3.61Å; H259-Y262 WeakPolarHBondContact O-CA 3.28Å; H259-Y262 WeakPolarHBondContact O-CB 3.17Å; H259-Y262 PolarHBondContact O-N 2.98Å; Y262-V264 PolarHBondContact O-N 3.34Å; Y262-Q265 PolarHBondContact O-N 3.45Å; Y262-T266 HydrophobicContact CE1-CG2 3.95Å; Y262-T266 HydrophobicContact CE2-CG2 4.43Å; Y262-T266 WeakPolarHBondContact O-CA 3.25Å; Y262-T266 VanDerWaalsContact O-CB 3.3Å; Y262-T266 WeakPolarHBondContact O-CB 3.48Å; Y262-T266 PolarHBondContact O-N 3.48Å; Y262-V267 HydrophobicContact CD1-CG2 4.28Å; Y262-V267 HydrophobicContact CE1-CG2 4.22Å; Y262-V267 PolarHBondContact O-N 2.86Å
263	F	95.6	Very high	93.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	24%	0.241	C	C	.	.	I	π-helix	trans	-55.7	-51.2	175.5	179	-95.4	0	0	0	111.7	H259 P260 V267 E268 L283 A286 R287 H290	H259-F263 PolarHBondContact O-N 3.29Å; P260-F263 PolarHBondContact O-N 2.82Å; F263-V267 HydrophobicContact CD2-CB 4.02Å; F263-V267 HydrophobicContact CD2-CG1 4.22Å; F263-V267 HydrophobicContact CD2-CG2 4.15Å; F263-V267 HydrophobicContact CE2-CB 4.37Å; F263-V267 HydrophobicContact CE2-CG1 4.13Å; F263-V267 WeakPolarHBondContact O-CA 3.46Å; F263-V267 VanDerWaalsContact O-CB 3.3Å; F263-V267 WeakPolarHBondContact O-CB 3.5Å; F263-V267 PolarHBondContact O-N 3.15Å; F263-V267 VanDerWaalsContact O-N 3.08Å; F263-E268 HydrophobicContact CD1-CG 4.07Å; F263-E268 VanDerWaalsContact CE1-CD 3.45Å; F263-E268 HydrophobicContact CE1-CG 3.68Å; F263-E268 VanDerWaalsContact CE1-OE1 3.27Å; F263-E268 WeakPolarHBondContact CE1-OE1 3.47Å; F263-E268 HydrophobicContact CZ-CG 4.07Å; F263-E268 PolarHBondContact O-N 2.98Å; F263-L283 HydrophobicContact CE2-CD2 3.85Å; F263-L283 HydrophobicContact CZ-CB 4.18Å; F263-L283 HydrophobicContact CZ-CD2 3.84Å; F263-A286 HydrophobicContact CD2-CB 4.21Å; F263-A286 HydrophobicContact CE2-CB 3.54Å; F263-A286 HydrophobicContact CZ-CB 3.72Å; F263-R287 HydrophobicContact CE1-CG 3.91Å; F263-R287 HydrophobicContact CZ-CG 4.39Å; F263-H290 AromaticContact CD1-CE1 3.88Å; F263-H290 AromaticContact CD1-ND1 3.96Å; F263-H290 AromaticContact CG-CE1 3.62Å
264	V	93.4	Very high	93	Very high	86 Å²	86	49.9 Å²	49.9	52%	0.521	26%	0.262	S	S	.	.	I	π-helix	trans	-68.9	-40.3	-179.7	178.2	0	0	0	0	112.5	P260 Y262	P260-V264 WeakPolarHBondContact O-CG2 3.26Å; P260-V264 PolarHBondContact O-N 3.48Å; P260-V264 VanDerWaalsContact O-N 3.13Å; Y262-V264 PolarHBondContact O-N 3.34Å
265	Q	93.4	Very high	92.8	Very high	151 Å²	151	53.6 Å²	53.6	71%	0.706	28%	0.284	S	S	*	.	I	π-helix	trans	-79.3	-38.6	-175.3	-70.6	178	-21.1	0	0	113.6	N261 Y262	N261-Q265 VanDerWaalsContact O-CB 3.28Å; N261-Q265 WeakPolarHBondContact O-CB 3.24Å; N261-Q265 VanDerWaalsContact O-CG 3.26Å; N261-Q265 WeakPolarHBondContact O-CG 3.4Å; N261-Q265 PolarHBondContact O-N 3Å; Y262-Q265 PolarHBondContact O-N 3.45Å
266	T	94.1	Very high	92.6	Very high	59 Å²	59	53.8 Å²	53.8	36%	0.362	29%	0.286	S	S	.	.	I	π-helix	trans	-106.5	-47.9	-171.2	-49.9	0	0	0	0	112.1	F228 Y262 D270	F228-T266 HydrophobicContact CE1-CG2 4.29Å; Y262-T266 HydrophobicContact CE1-CG2 3.95Å; Y262-T266 HydrophobicContact CE2-CG2 4.43Å; Y262-T266 WeakPolarHBondContact O-CA 3.25Å; Y262-T266 VanDerWaalsContact O-CB 3.3Å; Y262-T266 WeakPolarHBondContact O-CB 3.48Å; Y262-T266 PolarHBondContact O-N 3.48Å; T266-D270 PolarHBondContact O-N 3.31Å
267	V	94.3	Very high	92.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.31	C	S	.	.	I	π-helix	trans	-77.3	-45.3	-175.5	-172.6	0	0	0	0	111.4	F228 L255 L258 Y262 F263 I273 L283	F228-V267 HydrophobicContact CD1-CG2 4.27Å; F228-V267 HydrophobicContact CD2-CG2 4.36Å; F228-V267 HydrophobicContact CE1-CG2 3.89Å; F228-V267 HydrophobicContact CE2-CB 4.42Å; F228-V267 HydrophobicContact CE2-CG1 3.87Å; F228-V267 HydrophobicContact CE2-CG2 3.99Å; F228-V267 HydrophobicContact CG-CG2 4.5Å; F228-V267 HydrophobicContact CZ-CB 4.14Å; F228-V267 HydrophobicContact CZ-CG1 4.02Å; F228-V267 HydrophobicContact CZ-CG2 3.75Å; L255-V267 HydrophobicContact CD2-CG1 4.35Å; L258-V267 HydrophobicContact CD2-CG2 3.91Å; Y262-V267 HydrophobicContact CD1-CG2 4.28Å; Y262-V267 HydrophobicContact CE1-CG2 4.22Å; Y262-V267 PolarHBondContact O-N 2.86Å; F263-V267 HydrophobicContact CD2-CB 4.02Å; F263-V267 HydrophobicContact CD2-CG1 4.22Å; F263-V267 HydrophobicContact CD2-CG2 4.15Å; F263-V267 HydrophobicContact CE2-CB 4.37Å; F263-V267 HydrophobicContact CE2-CG1 4.13Å; F263-V267 WeakPolarHBondContact O-CA 3.46Å; F263-V267 VanDerWaalsContact O-CB 3.3Å; F263-V267 WeakPolarHBondContact O-CB 3.5Å; F263-V267 PolarHBondContact O-N 3.15Å; F263-V267 VanDerWaalsContact O-N 3.08Å; V267-I273 HydrophobicContact CG1-CD1 3.87Å; V267-L283 HydrophobicContact CG1-CD2 3.85Å
268	E	91.9	Very high	92.5	Very high	38 Å²	38	60.8 Å²	60.8	18%	0.178	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.3	177.6	-57.8	-169.1	131.3	0	0	113	F263 Q274 R287	F263-E268 HydrophobicContact CD1-CG 4.07Å; F263-E268 VanDerWaalsContact CE1-CD 3.45Å; F263-E268 HydrophobicContact CE1-CG 3.68Å; F263-E268 VanDerWaalsContact CE1-OE1 3.27Å; F263-E268 WeakPolarHBondContact CE1-OE1 3.47Å; F263-E268 HydrophobicContact CZ-CG 4.07Å; F263-E268 PolarHBondContact O-N 2.98Å; E268-Q274 WeakPolarHBondContact O-CG 3.2Å; E268-Q274 PolarHBondContact O-NE2 3.43Å; E268-R287 IonicContact OE1-CZ 3.61Å; E268-R287 IonicContact OE1-NE 2.65Å; E268-R287 PolarHBondContact OE1-NE 3.27Å; E268-R287 IonicContact OE1-NH2 3.35Å; E268-R287 PolarHBondContact OE1-NH2 3.24Å
269	G	91.1	Very high	92.5	Very high	42 Å²	42	60.7 Å²	60.7	43%	0.433	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-14	175.6	0	0	0	0	0	114.6
270	D	94.1	Very high	92.5	Very high	22 Å²	22	60.7 Å²	60.7	12%	0.118	32%	0.32	C	S	.	.			trans	-74.5	127.5	-174.6	-176.3	-79.7	0	0	0	113	M232 Y236 T266 L272 I273 Q274	M232-D270 VanDerWaalsContact CE-OD2 3.22Å; M232-D270 WeakPolarHBondContact CE-OD2 3.45Å; Y236-D270 PolarHBondContact OH-OD2 3.24Å; T266-D270 PolarHBondContact O-N 3.31Å; D270-L272 VanDerWaalsContact C-N 3.35Å; D270-L272 PolarHBondContact O-N 3.48Å; D270-L272 WeakPolarHBondContact OD1-CA 3.41Å; D270-L272 WeakPolarHBondContact OD1-CB 3.46Å; D270-L272 PolarHBondContact OD1-N 3.09Å; D270-I273 HydrophobicContact CB-CB 4.17Å; D270-I273 HydrophobicContact CB-CD1 4.06Å; D270-I273 HydrophobicContact CB-CG1 4.18Å; D270-I273 PolarHBondContact O-N 3.1Å; D270-I273 PolarHBondContact OD1-N 2.65Å; D270-Q274 WeakPolarHBondContact O-CG 3Å; D270-Q274 PolarHBondContact O-N 3.15Å
271	E	91.8	Very high	92.5	Very high	144 Å²	144	65.8 Å²	65.8	67%	0.673	34%	0.339	S	S	*	.	H	α-helix	trans	-65.1	-32.7	-176.7	-64.6	-172.9	173.5	0	0	113.4	N275	E271-N275 WeakPolarHBondContact O-CB 2.99Å; E271-N275 PolarHBondContact O-N 3.42Å; E271-N275 VanDerWaalsContact O-N 3.11Å; E271-N275 PolarHBondContact O-ND2 3.37Å
272	L	92.1	Very high	92.5	Very high	20 Å²	20	61.4 Å²	61.4	11%	0.105	32%	0.315	C	S	.	.	H	α-helix	trans	-71.6	-39	178.9	-62.4	179.9	0	0	0	110.7	V235 Y236 V239 L246 D270 N275 A276	V235-L272 HydrophobicContact CG1-CD1 3.97Å; Y236-L272 HydrophobicContact CD1-CD1 3.98Å; Y236-L272 HydrophobicContact CE1-CD1 3.53Å; Y236-L272 HydrophobicContact CE1-CG 4.06Å; Y236-L272 HydrophobicContact CE2-CD1 4.19Å; Y236-L272 HydrophobicContact CG-CD1 4.48Å; V239-L272 HydrophobicContact CG1-CD1 4.33Å; V239-L272 HydrophobicContact CG1-CD2 3.74Å; V239-L272 HydrophobicContact CG2-CD1 4.48Å; L246-L272 HydrophobicContact CD2-CB 4.32Å; D270-L272 VanDerWaalsContact C-N 3.35Å; D270-L272 PolarHBondContact O-N 3.48Å; D270-L272 WeakPolarHBondContact OD1-CA 3.41Å; D270-L272 WeakPolarHBondContact OD1-CB 3.46Å; D270-L272 PolarHBondContact OD1-N 3.09Å; L272-N275 CarbonylContact O-C 3.56Å; L272-N275 PolarHBondContact O-N 2.98Å; L272-A276 VanDerWaalsContact O-CB 3.27Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.28Å
273	I	92.9	Very high	92.4	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-70.2	-42.8	177.5	-64.8	177.5	0	0	0	111.1	F228 M232 L246 L250 V267 D270 N275 A276 L283	F228-I273 HydrophobicContact CE2-CD1 3.76Å; F228-I273 HydrophobicContact CZ-CD1 3.75Å; M232-I273 HydrophobicContact CE-CD1 4.31Å; M232-I273 HydrophobicContact CE-CG1 4.39Å; M232-I273 HydrophobicContact SD-CD1 4.25Å; L246-I273 HydrophobicContact CD2-CG1 4.11Å; L250-I273 HydrophobicContact CD1-CD1 4.43Å; L250-I273 HydrophobicContact CD1-CG1 4.48Å; V267-I273 HydrophobicContact CG1-CD1 3.87Å; D270-I273 HydrophobicContact CB-CB 4.17Å; D270-I273 HydrophobicContact CB-CD1 4.06Å; D270-I273 HydrophobicContact CB-CG1 4.18Å; D270-I273 PolarHBondContact O-N 3.1Å; D270-I273 PolarHBondContact OD1-N 2.65Å; I273-N275 VanDerWaalsContact C-N 3.26Å; I273-N275 PolarHBondContact O-N 2.88Å; I273-A276 PolarHBondContact O-N 3.4Å; I273-A276 VanDerWaalsContact O-N 3.16Å; I273-L283 HydrophobicContact CG2-CD1 3.81Å; I273-L283 HydrophobicContact CG2-CD2 4.25Å; I273-L283 HydrophobicContact CG2-CG 4.47Å
274	Q	91.5	Very high	92.2	Very high	98 Å²	98	64.6 Å²	64.6	46%	0.458	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-36.4	174.4	-73.2	179.1	14.8	0	0	112.2	E268 D270 A276 Y280	E268-Q274 WeakPolarHBondContact O-CG 3.2Å; E268-Q274 PolarHBondContact O-NE2 3.43Å; D270-Q274 WeakPolarHBondContact O-CG 3Å; D270-Q274 PolarHBondContact O-N 3.15Å; Q274-A276 VanDerWaalsContact C-N 3.29Å; Q274-A276 PolarHBondContact O-N 3.39Å; Q274-Y280 PolarHBondContact O-OH 3.23Å
275	N	89.6	Confident	92.1	Very high	98 Å²	98	61.6 Å²	61.6	52%	0.524	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	16.9	178.2	-69.7	-66.9	0	0	0	113.9	R243 E271 L272 I273	R243-N275 PolarHBondContact NH2-O 3.08Å; E271-N275 WeakPolarHBondContact O-CB 2.99Å; E271-N275 PolarHBondContact O-N 3.42Å; E271-N275 VanDerWaalsContact O-N 3.11Å; E271-N275 PolarHBondContact O-ND2 3.37Å; L272-N275 CarbonylContact O-C 3.56Å; L272-N275 PolarHBondContact O-N 2.98Å; I273-N275 VanDerWaalsContact C-N 3.26Å; I273-N275 PolarHBondContact O-N 2.88Å
276	A	91.1	Very high	92.1	Very high	5 Å²	5	54.4 Å²	54.4	4%	0.041	28%	0.278	C	S	.	.			trans	-127.2	84.7	179.7	0	0	0	0	0	111.3	L246 L272 I273 Q274 E278 C279	L246-A276 HydrophobicContact CD2-CB 4.48Å; L272-A276 VanDerWaalsContact O-CB 3.27Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.28Å; I273-A276 PolarHBondContact O-N 3.4Å; I273-A276 VanDerWaalsContact O-N 3.16Å; Q274-A276 VanDerWaalsContact C-N 3.29Å; Q274-A276 PolarHBondContact O-N 3.39Å; A276-E278 PolarHBondContact O-N 3.16Å; A276-E278 VanDerWaalsContact O-N 3.09Å; A276-C279 HydrophobicContact CB-CB 4.48Å; A276-C279 WeakPolarHBondContact O-CB 3.46Å; A276-C279 PolarHBondContact O-N 3.32Å
277	P	89.9	Confident	91.9	Very high	81 Å²	81	56.4 Å²	56.4	53%	0.526	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-60.8	-23.1	-175.3	26.5	-35.6	0	0	0	113.4	C279 Y280	P277-C279 PolarHBondContact O-N 3.35Å; P277-Y280 HydrophobicContact CB-CE2 4.49Å; P277-Y280 WeakPolarHBondContact O-CB 3.42Å; P277-Y280 PolarHBondContact O-N 2.89Å
278	E	91.9	Very high	91.6	Very high	115 Å²	115	62.9 Å²	62.9	54%	0.537	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63.2	-26.2	175.8	-52.1	78.2	-172.9	0	0	112.3	N247 A276	N247-E278 HydrophobicContact CB-CB 4.14Å; N247-E278 WeakPolarHBondContact ND2-CB 3.45Å; A276-E278 PolarHBondContact O-N 3.16Å; A276-E278 VanDerWaalsContact O-N 3.09Å
279	C	92.1	Very high	91.5	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.007	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-81.4	-17.5	180	-59.1	0	0	0	0	112.8	L250 A276 P277 Q281 L282 L283	L250-C279 HydrophobicContact CD1-CB 4.33Å; A276-C279 HydrophobicContact CB-CB 4.48Å; A276-C279 WeakPolarHBondContact O-CB 3.46Å; A276-C279 PolarHBondContact O-N 3.32Å; P277-C279 PolarHBondContact O-N 3.35Å; C279-Q281 VanDerWaalsContact C-N 3.26Å; C279-Q281 PolarHBondContact O-N 3.03Å; C279-L282 WeakPolarHBondContact O-CB 3.48Å; C279-L282 PolarHBondContact O-N 3.14Å; C279-L283 PolarHBondContact O-N 3.32Å
280	Y	91.6	Very high	91.4	Very high	109 Å²	109	62.5 Å²	62.5	43%	0.427	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-32.9	-173.1	-71.8	-0.6	0	0	0	113.2	Q274 P277 L282 L283 H284	Q274-Y280 PolarHBondContact O-OH 3.23Å; P277-Y280 HydrophobicContact CB-CE2 4.49Å; P277-Y280 WeakPolarHBondContact O-CB 3.42Å; P277-Y280 PolarHBondContact O-N 2.89Å; Y280-L282 VanDerWaalsContact C-N 3.29Å; Y280-L282 PolarHBondContact O-N 2.83Å; Y280-L283 HydrophobicContact CD1-CD1 4.14Å; Y280-L283 PolarHBondContact O-N 3.49Å; Y280-H284 WeakPolarHBondContact O-CB 3.39Å; Y280-H284 PolarHBondContact O-CD2 3.01Å; Y280-H284 VanDerWaalsContact O-CD2 3.22Å; Y280-H284 PolarHBondContact O-N 3.49Å
281	Q	92.3	Very high	91	Very high	163 Å²	163	65.8 Å²	65.8	76%	0.762	31%	0.31	S	S	*	.	H	α-helix	trans	-60.9	-39	175.9	-175	176.2	-6.1	0	0	112	C279 H284 E285	C279-Q281 VanDerWaalsContact C-N 3.26Å; C279-Q281 PolarHBondContact O-N 3.03Å; Q281-H284 PolarHBondContact O-N 3.39Å; Q281-E285 PolarHBondContact O-N 2.59Å
282	L	92.6	Very high	90.6	Very high	11 Å²	11	59.9 Å²	59.9	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-71.6	-38.8	178	-56	173.4	0	0	0	111.3	L250 Q251 L255 C279 Y280 E285 A286	L250-L282 HydrophobicContact CB-CD1 3.82Å; Q251-L282 HydrophobicContact CG-CD1 4.02Å; Q251-L282 HydrophobicContact CG-CD2 4.23Å; L255-L282 HydrophobicContact CD1-CB 3.97Å; C279-L282 WeakPolarHBondContact O-CB 3.48Å; C279-L282 PolarHBondContact O-N 3.14Å; Y280-L282 VanDerWaalsContact C-N 3.29Å; Y280-L282 PolarHBondContact O-N 2.83Å; L282-E285 WeakPolarHBondContact O-CB 3.36Å; L282-E285 PolarHBondContact O-N 3.46Å; L282-A286 PolarHBondContact O-N 2.85Å
283	L	93.7	Very high	90.2	Very high	9 Å²	9	59.3 Å²	59.3	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-42.5	173.7	-58.3	-179.5	0	0	0	111.5	L255 F263 V267 I273 C279 Y280 E285 A286 R287	L255-L283 HydrophobicContact CD1-CD2 4.36Å; F263-L283 HydrophobicContact CE2-CD2 3.85Å; F263-L283 HydrophobicContact CZ-CB 4.18Å; F263-L283 HydrophobicContact CZ-CD2 3.84Å; V267-L283 HydrophobicContact CG1-CD2 3.85Å; I273-L283 HydrophobicContact CG2-CD1 3.81Å; I273-L283 HydrophobicContact CG2-CD2 4.25Å; I273-L283 HydrophobicContact CG2-CG 4.47Å; C279-L283 PolarHBondContact O-N 3.32Å; Y280-L283 HydrophobicContact CD1-CD1 4.14Å; Y280-L283 PolarHBondContact O-N 3.49Å; L283-E285 VanDerWaalsContact C-N 3.34Å; L283-E285 PolarHBondContact O-N 3.4Å; L283-A286 PolarHBondContact O-N 2.73Å; L283-R287 WeakPolarHBondContact O-CB 3.24Å; L283-R287 VanDerWaalsContact O-CG 3.3Å; L283-R287 WeakPolarHBondContact O-CG 3.4Å; L283-R287 PolarHBondContact O-N 2.76Å
284	H	91.3	Very high	89.4	Confident	104 Å²	104	60.9 Å²	60.9	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-65	-33.6	175.4	-86.2	-78.3	0	0	0	113	Y280 Q281 R287 R288	Y280-H284 WeakPolarHBondContact O-CB 3.39Å; Y280-H284 PolarHBondContact O-CD2 3.01Å; Y280-H284 VanDerWaalsContact O-CD2 3.22Å; Y280-H284 PolarHBondContact O-N 3.49Å; Q281-H284 PolarHBondContact O-N 3.39Å; H284-R287 PolarHBondContact CE1-NH1 2.86Å; H284-R287 PolarHBondContact NE2-NH1 3.11Å; H284-R288 WeakPolarHBondContact O-CB 3.43Å; H284-R288 VanDerWaalsContact O-CG 3.29Å; H284-R288 WeakPolarHBondContact O-CG 3.32Å; H284-R288 PolarHBondContact O-N 3.35Å; H284-R288 VanDerWaalsContact O-N 3.16Å
285	E	91.4	Very high	88.7	Confident	22 Å²	22	59 Å²	59	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-51.6	170.6	-175.2	-175.5	178.4	0	0	111.1	P256 Q281 L282 L283 R288 Y289 M296 S298 R300	P256-E285 HydrophobicContact CG-CG 4.33Å; Q281-E285 PolarHBondContact O-N 2.59Å; L282-E285 WeakPolarHBondContact O-CB 3.36Å; L282-E285 PolarHBondContact O-N 3.46Å; L283-E285 VanDerWaalsContact C-N 3.34Å; L283-E285 PolarHBondContact O-N 3.4Å; E285-R288 PolarHBondContact O-N 2.62Å; E285-Y289 PolarHBondContact O-N 3.02Å; E285-M296 HydrophobicContact CG-CE 4.22Å; E285-S298 VanDerWaalsContact OE1-CB 3.24Å; E285-S298 WeakPolarHBondContact OE1-CB 3.21Å; E285-S298 PolarHBondContact OE1-OG 3.12Å; E285-R300 IonicContact OE1-NE 2.7Å; E285-R300 IonicContact OE1-NH2 3.39Å; E285-R300 IonicContact OE2-CZ 3.62Å; E285-R300 VanDerWaalsContact OE2-CZ 3.24Å; E285-R300 IonicContact OE2-NE 2.66Å; E285-R300 PolarHBondContact OE2-NE 3.07Å; E285-R300 IonicContact OE2-NH2 3.21Å; E285-R300 PolarHBondContact OE2-NH2 2.74Å
286	A	92.1	Very high	88	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-47.2	179.7	0	0	0	0	0	112.5	L255 P256 F263 L282 L283 R288 Y289 H290	L255-A286 HydrophobicContact CB-CB 4.02Å; P256-A286 HydrophobicContact CG-CB 4.39Å; F263-A286 HydrophobicContact CD2-CB 4.21Å; F263-A286 HydrophobicContact CE2-CB 3.54Å; F263-A286 HydrophobicContact CZ-CB 3.72Å; L282-A286 PolarHBondContact O-N 2.85Å; L283-A286 PolarHBondContact O-N 2.73Å; A286-R288 VanDerWaalsContact C-N 3.31Å; A286-R288 PolarHBondContact O-N 3.19Å; A286-Y289 PolarHBondContact O-N 3.12Å; A286-Y289 VanDerWaalsContact O-N 3.16Å; A286-H290 VanDerWaalsContact O-CG 3.29Å; A286-H290 PolarHBondContact O-N 2.73Å; A286-H290 PolarHBondContact O-ND1 2.65Å
287	R	90.9	Very high	87.2	Confident	102 Å²	102	58.8 Å²	58.8	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-52.2	-47.1	173.1	-73.6	172.9	-177.3	159.3	0	112.2	F263 E268 L283 H284 H290 V291	F263-R287 HydrophobicContact CE1-CG 3.91Å; F263-R287 HydrophobicContact CZ-CG 4.39Å; E268-R287 IonicContact OE1-CZ 3.61Å; E268-R287 IonicContact OE1-NE 2.65Å; E268-R287 PolarHBondContact OE1-NE 3.27Å; E268-R287 IonicContact OE1-NH2 3.35Å; E268-R287 PolarHBondContact OE1-NH2 3.24Å; L283-R287 WeakPolarHBondContact O-CB 3.24Å; L283-R287 VanDerWaalsContact O-CG 3.3Å; L283-R287 WeakPolarHBondContact O-CG 3.4Å; L283-R287 PolarHBondContact O-N 2.76Å; H284-R287 PolarHBondContact CE1-NH1 2.86Å; H284-R287 PolarHBondContact NE2-NH1 3.11Å; R287-H290 PolarHBondContact O-N 2.83Å; R287-V291 WeakPolarHBondContact O-CG2 3.43Å; R287-V291 PolarHBondContact O-N 3.29Å
288	R	88.6	Confident	86.7	Confident	135 Å²	135	55.7 Å²	55.7	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-41.9	-179.9	-76.1	179.5	66.5	172.8	0.1	111.6	H284 E285 A286 V291 L292	H284-R288 WeakPolarHBondContact O-CB 3.43Å; H284-R288 VanDerWaalsContact O-CG 3.29Å; H284-R288 WeakPolarHBondContact O-CG 3.32Å; H284-R288 PolarHBondContact O-N 3.35Å; H284-R288 VanDerWaalsContact O-N 3.16Å; E285-R288 PolarHBondContact O-N 2.62Å; A286-R288 VanDerWaalsContact C-N 3.31Å; A286-R288 PolarHBondContact O-N 3.19Å; R288-V291 PolarHBondContact O-N 2.97Å; R288-L292 VanDerWaalsContact O-CB 3.28Å; R288-L292 WeakPolarHBondContact O-CB 3.32Å; R288-L292 VanDerWaalsContact O-CG 3.31Å; R288-L292 WeakPolarHBondContact O-CG 3.37Å; R288-L292 PolarHBondContact O-N 2.91Å
289	Y	89.1	Confident	86.2	Confident	25 Å²	25	55.1 Å²	55.1	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-40	176.1	-176.6	-95.2	0	0	0	112.6	P256 L257 E285 A286 V291 L292 G293 N294 M296 T301	P256-Y289 HydrophobicContact CB-CD1 3.61Å; P256-Y289 HydrophobicContact CB-CE1 4.25Å; P256-Y289 HydrophobicContact CB-CG 3.73Å; P256-Y289 WeakPolarHBondContact O-CD1 3.46Å; P256-Y289 WeakPolarHBondContact O-CE1 3.46Å; L257-Y289 HydrophobicContact CD2-CE1 3.91Å; E285-Y289 PolarHBondContact O-N 3.02Å; A286-Y289 PolarHBondContact O-N 3.12Å; A286-Y289 VanDerWaalsContact O-N 3.16Å; Y289-V291 PolarHBondContact O-N 2.79Å; Y289-L292 PolarHBondContact O-N 3.34Å; Y289-G293 WeakPolarHBondContact CD2-O 3.47Å; Y289-G293 WeakPolarHBondContact O-CA 3.28Å; Y289-G293 PolarHBondContact O-N 3.35Å; Y289-N294 PolarHBondContact OH-OD1 2.71Å; Y289-M296 HydrophobicContact CD2-CB 4.24Å; Y289-T301 HydrophobicContact CD2-CG2 3.41Å; Y289-T301 VanDerWaalsContact CD2-CG2 3.41Å; Y289-T301 HydrophobicContact CE2-CG2 3.73Å; Y289-T301 HydrophobicContact CG-CG2 3.97Å
290	H	88.6	Confident	86.1	Confident	47 Å²	47	58.1 Å²	58.1	22%	0.218	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-29.5	175.8	-62.4	153.5	0	0	0	113.3	P256 L258 P260 F263 A286 R287	P256-H290 PolarHBondContact O-NE2 3.44Å; L258-H290 PolarHBondContact O-NE2 2.78Å; P260-H290 HydrophobicContact CG-CB 4.42Å; F263-H290 AromaticContact CD1-CE1 3.88Å; F263-H290 AromaticContact CD1-ND1 3.96Å; F263-H290 AromaticContact CG-CE1 3.62Å; A286-H290 VanDerWaalsContact O-CG 3.29Å; A286-H290 PolarHBondContact O-N 2.73Å; A286-H290 PolarHBondContact O-ND1 2.65Å; R287-H290 PolarHBondContact O-N 2.83Å
291	V	85.4	Confident	85.8	Confident	91 Å²	91	52.9 Å²	52.9	55%	0.552	26%	0.256	S	S	*	.	H	α-helix	trans	-84	-48	177.3	176.5	0	0	0	0	112.1	R287 R288 Y289 R360	R287-V291 WeakPolarHBondContact O-CG2 3.43Å; R287-V291 PolarHBondContact O-N 3.29Å; R288-V291 PolarHBondContact O-N 2.97Å; Y289-V291 PolarHBondContact O-N 2.79Å; V291-R360 PolarHBondContact O-NE 3.25Å; V291-R360 PolarHBondContact O-NH2 3.07Å
292	L	84.1	Confident	85.5	Confident	20 Å²	20	47.5 Å²	47.5	11%	0.105	23%	0.228	C	C	.	.	H	α-helix	trans	-94.3	-21.3	-169.2	-58.5	178.8	0	0	0	114.1	R288 Y289 E295 L404	R288-L292 VanDerWaalsContact O-CB 3.28Å; R288-L292 WeakPolarHBondContact O-CB 3.32Å; R288-L292 VanDerWaalsContact O-CG 3.31Å; R288-L292 WeakPolarHBondContact O-CG 3.37Å; R288-L292 PolarHBondContact O-N 2.91Å; Y289-L292 PolarHBondContact O-N 3.34Å; L292-E295 HydrophobicContact CB-CB 4.27Å; L292-L404 HydrophobicContact CD2-CD2 4.39Å
293	G	82.7	Confident	85.1	Confident	9 Å²	9	48.2 Å²	48.2	9%	0.093	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	57	-137.3	-170.3	0	0	0	0	0	112.4	Y289 E295 M296	Y289-G293 WeakPolarHBondContact CD2-O 3.47Å; Y289-G293 WeakPolarHBondContact O-CA 3.28Å; Y289-G293 PolarHBondContact O-N 3.35Å; G293-E295 PolarHBondContact O-N 3.21Å; G293-M296 PolarHBondContact O-N 3.45Å
294	N	77.1	Confident	84.8	Confident	34 Å²	34	47.9 Å²	47.9	18%	0.182	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-66	0.5	-169.7	-61.5	2.8	0	0	0	115.5	Y289 M296 R360 H589	Y289-N294 PolarHBondContact OH-OD1 2.71Å; N294-M296 PolarHBondContact O-N 2.96Å; N294-R360 PolarHBondContact ND2-O 2.95Å; N294-R360 VanDerWaalsContact ND2-O 3.14Å; N294-H589 PolarHBondContact ND2-CE1 3.29Å; N294-H589 PolarHBondContact ND2-ND1 3.32Å; N294-H589 VanDerWaalsContact ND2-ND1 3.16Å; N294-H589 PolarHBondContact OD1-CE1 3.29Å; N294-H589 VanDerWaalsContact OD1-CE1 3.31Å; N294-H589 PolarHBondContact OD1-ND1 2.85Å
295	E	76.8	Confident	84.2	Confident	57 Å²	57	49.1 Å²	49.1	27%	0.266	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-63.6	-27.3	163.7	-70.5	-177.8	-123.8	0	0	112.3	L292 G293 V402 L403 L404 G405	L292-E295 HydrophobicContact CB-CB 4.27Å; G293-E295 PolarHBondContact O-N 3.21Å; E295-V402 HydrophobicContact CG-CB 4.47Å; E295-V402 HydrophobicContact CG-CG1 4.15Å; E295-V402 WeakPolarHBondContact OE1-CG1 3.34Å; E295-L403 WeakPolarHBondContact OE2-CA 3.41Å; E295-L404 PolarHBondContact OE1-N 3.06Å; E295-L404 PolarHBondContact OE2-N 2.82Å; E295-G405 WeakPolarHBondContact OE1-CA 3.37Å; E295-G405 PolarHBondContact OE1-N 2.81Å
296	M	74.4	Confident	83.7	Confident	47 Å²	47	49.2 Å²	49.2	23%	0.232	24%	0.236	C	C	.	.	S	Bend	trans	-100.1	109.1	178.9	-171.3	75	164.7	0	0	109.4	E285 Y289 G293 N294 T301	E285-M296 HydrophobicContact CG-CE 4.22Å; Y289-M296 HydrophobicContact CD2-CB 4.24Å; G293-M296 PolarHBondContact O-N 3.45Å; N294-M296 PolarHBondContact O-N 2.96Å; M296-T301 PolarHBondContact O-OG1 2.93Å
297	M	74.4	Confident	83.1	Confident	52 Å²	52	50.1 Å²	50.1	26%	0.256	24%	0.241	S	C	.	.			trans	-107.5	120.6	179.2	-64.6	-58.9	-74.3	0	0	111.1
298	S	80.8	Confident	82.5	Confident	17 Å²	17	45.5 Å²	45.5	12%	0.119	23%	0.225	C	C	.	.			trans	-143.4	168.5	168.7	90.3	0	0	0	0	110.1	E285 R300 T301	E285-S298 VanDerWaalsContact OE1-CB 3.24Å; E285-S298 WeakPolarHBondContact OE1-CB 3.21Å; E285-S298 PolarHBondContact OE1-OG 3.12Å; S298-R300 PolarHBondContact O-N 3.44Å; S298-R300 PolarHBondContact OG-N 2.94Å; S298-T301 PolarHBondContact N-OG1 2.73Å; S298-T301 PolarHBondContact O-N 3.28Å; S298-T301 VanDerWaalsContact O-N 3.12Å; S298-T301 PolarHBondContact O-OG1 3.01Å; S298-T301 PolarHBondContact OG-N 3.42Å
299	P	81.4	Confident	82.2	Confident	103 Å²	103	44.4 Å²	44.4	67%	0.669	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-58.4	-24.8	171.5	-24.6	35.6	0	0	0	113.5
300	R	88.1	Confident	82	Confident	63 Å²	63	43.8 Å²	43.8	24%	0.238	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-84	-12.2	177.1	-74.8	-175.8	-73.4	-92.2	0.7	114	Q251 V253 R254 P256 E285 S298 R302	Q251-R300 PolarHBondContact O-NH1 3.05Å; Q251-R300 VanDerWaalsContact O-NH1 3.11Å; V253-R300 WeakPolarHBondContact O-CD 3.28Å; R254-R300 WeakPolarHBondContact CB-O 3.31Å; P256-R300 HydrophobicContact CG-CB 4.27Å; E285-R300 IonicContact OE1-NE 2.7Å; E285-R300 IonicContact OE1-NH2 3.39Å; E285-R300 IonicContact OE2-CZ 3.62Å; E285-R300 VanDerWaalsContact OE2-CZ 3.24Å; E285-R300 IonicContact OE2-NE 2.66Å; E285-R300 PolarHBondContact OE2-NE 3.07Å; E285-R300 IonicContact OE2-NH2 3.21Å; E285-R300 PolarHBondContact OE2-NH2 2.74Å; S298-R300 PolarHBondContact O-N 3.44Å; S298-R300 PolarHBondContact OG-N 2.94Å; R300-R302 VanDerWaalsContact C-N 3.34Å
301	T	86.5	Confident	82	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-90.7	4.5	175.6	65.4	0	0	0	0	113.4	P256 Y289 M296 S298	P256-T301 HydrophobicContact CB-CG2 3.88Å; P256-T301 HydrophobicContact CG-CG2 3.97Å; Y289-T301 HydrophobicContact CD2-CG2 3.41Å; Y289-T301 VanDerWaalsContact CD2-CG2 3.41Å; Y289-T301 HydrophobicContact CE2-CG2 3.73Å; Y289-T301 HydrophobicContact CG-CG2 3.97Å; M296-T301 PolarHBondContact O-OG1 2.93Å; S298-T301 PolarHBondContact N-OG1 2.73Å; S298-T301 PolarHBondContact O-N 3.28Å; S298-T301 VanDerWaalsContact O-N 3.12Å; S298-T301 PolarHBondContact O-OG1 3.01Å; S298-T301 PolarHBondContact OG-N 3.42Å
302	R	85.1	Confident	82.3	Confident	50 Å²	50	37.4 Å²	37.4	19%	0.189	19%	0.186	C	C	.	.	S	Bend	trans	-100.4	130.6	178.1	-54.1	-168.5	-165.8	155.6	8	111.4	R254 L257 R300 N541	R254-R302 WeakPolarHBondContact CD-O 3.45Å; R254-R302 PolarHBondContact NH1-O 2.76Å; L257-R302 VanDerWaalsContact CD1-C 3.42Å; L257-R302 VanDerWaalsContact CD1-O 3.26Å; L257-R302 WeakPolarHBondContact CD1-O 3.38Å; R300-R302 VanDerWaalsContact C-N 3.34Å; R302-N541 VanDerWaalsContact CZ-C 3.48Å; R302-N541 PolarHBondContact NH1-O 3.46Å
303	P	85.4	Confident	82.8	Confident	26 Å²	26	36.5 Å²	36.5	17%	0.169	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-63.5	155.7	177.1	24.5	-32.3	0	0	0	113	R254 L257	R254-P303 VanDerWaalsContact NH1-C 3.31Å; R254-P303 PolarHBondContact NH1-O 3.47Å; R254-P303 VanDerWaalsContact NH1-O 3.12Å; L257-P303 HydrophobicContact CD1-CB 4.45Å
304	R	86.1	Confident	83.4	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.008	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-75.3	145	170.5	-64.9	179.4	-165.6	-96.4	0.3	109.4	I214 R216 E224 H252 R254 S306 T307	I214-R304 VanDerWaalsContact O-CZ 3.3Å; I214-R304 PolarHBondContact O-NH1 3.41Å; I214-R304 PolarHBondContact O-NH2 2.66Å; R216-R304 PolarHBondContact O-NH1 3.44Å; E224-R304 IonicContact OE1-CZ 3.67Å; E224-R304 IonicContact OE1-NE 2.78Å; E224-R304 PolarHBondContact OE1-NE 2.95Å; E224-R304 IonicContact OE1-NH2 3.8Å; E224-R304 PolarHBondContact OE1-NH2 3.49Å; E224-R304 IonicContact OE2-CZ 2.68Å; E224-R304 IonicContact OE2-NE 3.01Å; E224-R304 PolarHBondContact OE2-NE 3.35Å; E224-R304 IonicContact OE2-NH2 3.99Å; H252-R304 PolarHBondContact O-NH2 2.82Å; R254-R304 VanDerWaalsContact CZ-CG 3.45Å; R304-S306 PolarHBondContact O-N 3.04Å; R304-T307 HydrophobicContact CB-CG2 4.21Å; R304-T307 PolarHBondContact O-N 3.34Å; R304-T307 PolarHBondContact O-OG1 3.04Å
305	R	79.5	Confident	84.2	Confident	129 Å²	129	34.7 Å²	34.7	49%	0.487	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.1	-174.2	-58.3	-177.7	-172.6	-148.8	1.9	114	E217 K594	E217-R305 IonicContact OE2-CZ 3.76Å; E217-R305 IonicContact OE2-NE 3.94Å; E217-R305 PolarHBondContact OE2-NE 2.91Å; E217-R305 IonicContact OE2-NH2 3.23Å; E217-R305 PolarHBondContact OE2-NH2 3.17Å; R305-K594 PolarHBondContact O-NZ 2.77Å; R305-K594 VanDerWaalsContact O-NZ 3.17Å
306	S	80.6	Confident	84.9	Confident	25 Å²	25	32 Å²	32	18%	0.175	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-25.8	179.1	46.6	0	0	0	0	114.6	L219 V221 R304 G308	L219-S306 WeakPolarHBondContact O-CB 3.35Å; L219-S306 PolarHBondContact O-OG 2.98Å; V221-S306 PolarHBondContact N-OG 3.02Å; V221-S306 CarbonylContact O-C 3.59Å; V221-S306 PolarHBondContact O-OG 2.96Å; R304-S306 PolarHBondContact O-N 3.04Å; S306-G308 PolarHBondContact O-N 3.02Å
307	T	80	Confident	85.6	Confident	18 Å²	18	30 Å²	30	11%	0.11	15%	0.148	C	C	.	.	S	Bend	trans	-68.3	-2.7	177.9	63.4	0	0	0	0	113.6	V221 R304 Y309	V221-T307 PolarHBondContact O-N 3.45Å; R304-T307 HydrophobicContact CB-CG2 4.21Å; R304-T307 PolarHBondContact O-N 3.34Å; R304-T307 PolarHBondContact O-OG1 3.04Å; T307-Y309 WeakPolarHBondContact O-CD2 3.21Å; T307-Y309 PolarHBondContact O-N 3.13Å; T307-Y309 PolarHBondContact OG1-N 2.98Å
308	G	78.1	Confident	86.2	Confident	6 Å²	6	27.5 Å²	27.5	6%	0.062	14%	0.136	C	C	.	.	S	Bend	trans	77.5	-20.4	-170.9	0	0	0	0	0	114	S306 C592	S306-G308 PolarHBondContact O-N 3.02Å; G308-C592 PolarHBondContact O-N 2.98Å
309	Y	82.7	Confident	86.5	Confident	111 Å²	111	26.7 Å²	26.7	44%	0.435	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	136.6	178.9	-70	-91	0	0	0	112.7	T307 H589 R590 Y591	T307-Y309 WeakPolarHBondContact O-CD2 3.21Å; T307-Y309 PolarHBondContact O-N 3.13Å; T307-Y309 PolarHBondContact OG1-N 2.98Å; Y309-H589 HydrophobicContact CD1-CB 4.45Å; Y309-R590 WeakPolarHBondContact CA-O 3.34Å; Y309-Y591 HydrophobicContact CD2-CD2 4.12Å; Y309-Y591 AromaticContact CE2-CD2 3.92Å; Y309-Y591 HydrophobicContact CE2-CD2 3.92Å
310	S	83.9	Confident	86.5	Confident	12 Å²	12	26.4 Å²	26.4	8%	0.084	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.8	175.5	-162.6	0	0	0	0	110.2	V312 D334 H589 R590	S310-V312 PolarHBondContact O-N 2.93Å; S310-D334 WeakPolarHBondContact CB-OD2 3.26Å; S310-D334 VanDerWaalsContact OG-CG 3.3Å; S310-D334 PolarHBondContact OG-OD1 3.4Å; S310-D334 PolarHBondContact OG-OD2 3.15Å; S310-H589 WeakPolarHBondContact O-CA 3.49Å; S310-R590 PolarHBondContact N-O 3.3Å; S310-R590 PolarHBondContact O-N 2.96Å
311	E	88.8	Confident	86	Confident	4 Å²	4	32 Å²	32	2%	0.019	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	108.4	168.3	-79.2	-177.1	-178.3	0	0	108.9	P335 A540 N541 T587 H589	E311-P335 WeakPolarHBondContact O-CD 3.47Å; E311-A540 HydrophobicContact CB-CB 4.44Å; E311-N541 WeakPolarHBondContact OE2-CA 3.16Å; E311-N541 PolarHBondContact OE2-N 2.64Å; E311-T587 HydrophobicContact CB-CG2 4.13Å; E311-T587 HydrophobicContact CG-CG2 4.42Å; E311-H589 WeakPolarHBondContact CG-CD2 3.41Å; E311-H589 VanDerWaalsContact CG-NE2 3.31Å; E311-H589 WeakPolarHBondContact CG-NE2 3.27Å; E311-H589 IonicContact OE1-CD2 3.85Å; E311-H589 IonicContact OE1-CE1 2.71Å; E311-H589 IonicContact OE1-NE2 2.68Å; E311-H589 PolarHBondContact OE1-NE2 3.4Å
312	V	92.3	Very high	85.2	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.4	-179	-57.4	0	0	0	0	110.8	S310 V314 C332 Y333 D334 T587 I588 R590	S310-V312 PolarHBondContact O-N 2.93Å; V312-V314 HydrophobicContact CG2-CG2 4.45Å; V312-C332 HydrophobicContact CB-CB 4.24Å; V312-C332 HydrophobicContact CG2-CB 4.01Å; V312-Y333 CarbonylContact C-O 3.53Å; V312-Y333 VanDerWaalsContact CA-O 3.29Å; V312-Y333 WeakPolarHBondContact CA-O 3.44Å; V312-Y333 WeakPolarHBondContact CB-O 3.31Å; V312-D334 HydrophobicContact CG1-CB 4.06Å; V312-T587 WeakPolarHBondContact O-CA 3.25Å; V312-I588 HydrophobicContact CG2-CD1 4.47Å; V312-I588 HydrophobicContact CG2-CG1 3.76Å; V312-I588 PolarHBondContact N-O 2.75Å; V312-I588 PolarHBondContact O-N 2.71Å; V312-R590 HydrophobicContact CG1-CB 4.19Å; V312-R590 HydrophobicContact CG2-CB 3.58Å
313	I	94.9	Very high	84.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.3	174.6	-59.6	176.4	0	0	0	107.4	C332 Y333 P335 A540 Y545 L547 C585 V586	I313-C332 CarbonylContact O-C 3.57Å; I313-C332 WeakPolarHBondContact O-CA 3.44Å; I313-Y333 HydrophobicContact CD1-CD1 4.38Å; I313-Y333 PolarHBondContact N-O 3.02Å; I313-Y333 PolarHBondContact O-N 2.75Å; I313-P335 HydrophobicContact CD1-CG 4.06Å; I313-P335 HydrophobicContact CG1-CG 4.22Å; I313-A540 HydrophobicContact CD1-CB 4Å; I313-A540 HydrophobicContact CG1-CB 3.8Å; I313-Y545 VanDerWaalsContact CD1-CB 3.49Å; I313-Y545 HydrophobicContact CD1-CD1 3.94Å; I313-Y545 HydrophobicContact CD1-CD2 3.72Å; I313-Y545 HydrophobicContact CD1-CE2 4.43Å; I313-Y545 HydrophobicContact CD1-CG 3.44Å; I313-Y545 VanDerWaalsContact CD1-CG 3.44Å; I313-L547 HydrophobicContact CD1-CD1 4.41Å; I313-L547 HydrophobicContact CG2-CD1 4.18Å; I313-L547 HydrophobicContact CG2-CD2 4.21Å; I313-C585 WeakPolarHBondContact CG2-SG 3.2Å; I313-V586 CarbonylContact C-O 3.58Å
314	V	95	Very high	83.6	Confident	1 Å²	1	36 Å²	36	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.7	174.3	-174.8	0	0	0	0	109.2	V312 V316 C332 L343 I363 C585 V586 I588	V312-V314 HydrophobicContact CG2-CG2 4.45Å; V314-V316 HydrophobicContact CG1-CG2 3.97Å; V314-C332 HydrophobicContact CG2-CB 3.93Å; V314-L343 HydrophobicContact CB-CD1 4.5Å; V314-L343 HydrophobicContact CG1-CD1 3.64Å; V314-L343 HydrophobicContact CG2-CD1 4.01Å; V314-I363 HydrophobicContact CB-CD1 3.72Å; V314-I363 HydrophobicContact CG1-CD1 3.71Å; V314-I363 HydrophobicContact CG2-CD1 3.83Å; V314-C585 WeakPolarHBondContact O-CA 3.33Å; V314-V586 HydrophobicContact CB-CG2 4.19Å; V314-V586 PolarHBondContact N-O 3.17Å; V314-V586 PolarHBondContact O-N 2.79Å; V314-V586 VanDerWaalsContact O-N 3.11Å; V314-I588 HydrophobicContact CG2-CD1 3.73Å; V314-I588 HydrophobicContact CG2-CG1 3.79Å
315	V	94.1	Very high	83	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.03	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.8	168.3	-175.7	0	0	0	0	108.4	N330 D331 W340 L547 M576 I580 H583 G584	V315-N330 WeakPolarHBondContact O-CA 3.46Å; V315-D331 PolarHBondContact N-O 2.78Å; V315-D331 PolarHBondContact O-N 3.48Å; V315-W340 HydrophobicContact CG2-CH2 3.96Å; V315-W340 HydrophobicContact CG2-CZ3 4.14Å; V315-L547 HydrophobicContact CG2-CD2 3.83Å; V315-M576 HydrophobicContact CG2-SD 4.44Å; V315-I580 HydrophobicContact CG1-CD1 3.48Å; V315-I580 VanDerWaalsContact CG1-CD1 3.48Å; V315-H583 HydrophobicContact CG1-CB 3.86Å; V315-G584 WeakPolarHBondContact CA-O 3.32Å
316	V	92	Very high	82.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.6	-176.9	175.2	0	0	0	0	108.2	V314 N330 L346 Y354 V356 I363 V365 H583 G584	V314-V316 HydrophobicContact CG1-CG2 3.97Å; V316-N330 WeakPolarHBondContact CA-OD1 3.01Å; V316-N330 WeakPolarHBondContact CG1-OD1 3.47Å; V316-L346 HydrophobicContact CG1-CD2 4.12Å; V316-Y354 HydrophobicContact CG1-CE2 4Å; V316-Y354 PolarHBondContact O-OH 2.83Å; V316-V356 HydrophobicContact CB-CG1 4.4Å; V316-V356 HydrophobicContact CB-CG2 4.26Å; V316-V356 HydrophobicContact CG1-CG2 4.09Å; V316-V356 HydrophobicContact CG2-CG1 4.09Å; V316-I363 HydrophobicContact CG2-CG2 4.33Å; V316-V365 HydrophobicContact CG1-CG2 3.86Å; V316-H583 WeakPolarHBondContact O-CA 3.26Å; V316-H583 WeakPolarHBondContact O-CB 3.34Å; V316-G584 PolarHBondContact N-O 2.77Å; V316-G584 PolarHBondContact O-N 3.46Å
317	G	88.7	Confident	82.8	Confident	4 Å²	4	38.5 Å²	38.5	4%	0.041	20%	0.2	C	C	.	.			trans	48.7	-134.8	176.3	0	0	0	0	0	115.6	L327 Y329 Y354 H583	G317-L327 WeakPolarHBondContact CA-O 3.38Å; G317-Y329 WeakPolarHBondContact CA-O 3.5Å; G317-Y329 PolarHBondContact N-O 2.6Å; G317-Y354 VanDerWaalsContact CA-OH 3.24Å; G317-Y354 WeakPolarHBondContact CA-OH 3.31Å; G317-H583 VanDerWaalsContact O-CB 3.31Å; G317-H583 WeakPolarHBondContact O-CB 3.38Å
318	G	86.9	Confident	82.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.			trans	104	-174.3	-174.8	0	0	0	0	0	112	N326 L327 Y354 C581	G318-N326 WeakPolarHBondContact CA-OD1 3.5Å; G318-N326 PolarHBondContact N-OD1 3.24Å; G318-N326 CarbonylContact O-C 3.57Å; G318-N326 WeakPolarHBondContact O-CA 3.23Å; G318-N326 PolarHBondContact O-OD1 2.85Å; G318-L327 PolarHBondContact O-N 2.93Å; G318-Y354 PolarHBondContact N-OH 2.78Å; G318-Y354 VanDerWaalsContact N-OH 3.16Å; G318-C581 CarbonylContact C-O 3.55Å; G318-C581 VanDerWaalsContact CA-O 3.28Å; G318-C581 WeakPolarHBondContact CA-O 3.42Å
319	C	85.8	Confident	82.9	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.007	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-139.3	149.4	177	58.8	0	0	0	0	112	R321 C581	C319-R321 VanDerWaalsContact C-N 3.29Å; C319-R321 PolarHBondContact O-N 2.97Å; C319-R321 PolarHBondContact SG-O 3.26Å; C319-R321 VanDerWaalsContact SG-O 3.4Å; C319-C581 PolarHBondContact N-O 2.72Å; C319-C581 PolarHBondContact O-N 2.96Å; C319-C581 PolarHBondContact O-SG 3.3Å; C319-C581 VanDerWaalsContact O-SG 3.32Å
320	E	83.2	Confident	83.2	Confident	97 Å²	97	38.3 Å²	38.3	45%	0.453	20%	0.202	S	C	.	.	S	Bend	trans	-76.8	-15.8	-179.1	-58.2	175.1	165.7	0	0	112.4	L327 A556 R578 I580	E320-L327 HydrophobicContact CG-CD1 4.04Å; E320-A556 VanDerWaalsContact O-CB 3.27Å; E320-A556 WeakPolarHBondContact O-CB 3.24Å; E320-R578 IonicContact OE1-NH1 3.56Å; E320-I580 HydrophobicContact CG-CG2 4.49Å
321	R	76.8	Confident	83.5	Confident	181 Å²	181	39 Å²	39	68%	0.683	21%	0.205	S	C	*	.	B	Isolated β-bridge	trans	-152.9	148.6	177.1	-171.3	174.1	68	-166.5	-1.2	111.1	C319 G323 G324	C319-R321 VanDerWaalsContact C-N 3.29Å; C319-R321 PolarHBondContact O-N 2.97Å; C319-R321 PolarHBondContact SG-O 3.26Å; C319-R321 VanDerWaalsContact SG-O 3.4Å; R321-G323 PolarHBondContact O-N 2.89Å; R321-G324 PolarHBondContact O-N 2.99Å
322	V	70.1	Confident	83.7	Confident	73 Å²	73	39.1 Å²	39.1	44%	0.442	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	127.8	171.1	-178.3	0	0	0	0	111.1	G324	V322-G324 PolarHBondContact O-N 3.43Å
323	G	66.1	Low	83.8	Confident	55 Å²	55	39 Å²	39	57%	0.567	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.1	4	178	0	0	0	0	0	115.5	R321	R321-G323 PolarHBondContact O-N 2.89Å
324	G	69.9	Low	83.6	Confident	30 Å²	30	39.4 Å²	39.4	31%	0.309	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-68.5	172.1	169.5	0	0	0	0	0	113	R321 V322	R321-G324 PolarHBondContact O-N 2.99Å; V322-G324 PolarHBondContact O-N 3.43Å
325	F	72.7	Confident	83.3	Confident	176 Å²	176	40.2 Å²	40.2	77%	0.772	21%	0.213	S	C	*	.	P	Polyproline II helix	trans	-66.3	142.9	171.3	-65.4	-77	0	0	0	110.6
326	N	75.8	Confident	83	Confident	8 Å²	8	43.2 Å²	43.2	4%	0.043	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-69.5	135	170.7	-179.8	76	0	0	0	110.1	G318 F349 K351 Y354	G318-N326 WeakPolarHBondContact CA-OD1 3.5Å; G318-N326 PolarHBondContact N-OD1 3.24Å; G318-N326 CarbonylContact O-C 3.57Å; G318-N326 WeakPolarHBondContact O-CA 3.23Å; G318-N326 PolarHBondContact O-OD1 2.85Å; N326-F349 PolarHBondContact ND2-O 2.62Å; N326-F349 VanDerWaalsContact ND2-O 3.12Å; N326-K351 VanDerWaalsContact CB-O 3.25Å; N326-K351 WeakPolarHBondContact CB-O 3.47Å; N326-Y354 WeakPolarHBondContact OD1-CE1 3.31Å; N326-Y354 PolarHBondContact OD1-OH 2.81Å
327	L	80.6	Confident	82.7	Confident	26 Å²	26	46.4 Å²	46.4	14%	0.136	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-76.3	136.6	176.3	-60.8	-178.2	0	0	0	110.1	G317 G318 E320 Y329 I580	G317-L327 WeakPolarHBondContact CA-O 3.38Å; G318-L327 PolarHBondContact O-N 2.93Å; E320-L327 HydrophobicContact CG-CD1 4.04Å; L327-Y329 HydrophobicContact CB-CD2 3.73Å; L327-Y329 HydrophobicContact CB-CE2 4.18Å; L327-Y329 HydrophobicContact CD1-CD2 3.94Å; L327-Y329 HydrophobicContact CD1-CE2 4.21Å; L327-Y329 HydrophobicContact CD2-CD2 4.41Å; L327-Y329 HydrophobicContact CD2-CE2 4.04Å; L327-Y329 HydrophobicContact CG-CD2 4.25Å; L327-Y329 HydrophobicContact CG-CE2 4.38Å; L327-Y329 PolarHBondContact O-N 3.23Å; L327-I580 HydrophobicContact CD1-CG2 3.83Å
328	P	78.5	Confident	82.7	Confident	48 Å²	48	47.1 Å²	47.1	31%	0.312	26%	0.257	S	S	.	.			trans	-83.5	9.4	178.3	36.3	-37.7	0	0	0	113	K345 L346	P328-K345 VanDerWaalsContact O-CA 3.31Å; P328-K345 WeakPolarHBondContact O-CA 3.39Å; P328-K345 WeakPolarHBondContact O-CB 3.37Å; P328-L346 PolarHBondContact O-N 3.29Å
329	Y	82.2	Confident	82.8	Confident	79 Å²	79	51.6 Å²	51.6	31%	0.31	28%	0.278	S	S	.	.			trans	-80.2	143.5	-175.8	-51.9	-53.1	0	0	0	111	G317 L327	G317-Y329 WeakPolarHBondContact CA-O 3.5Å; G317-Y329 PolarHBondContact N-O 2.6Å; L327-Y329 HydrophobicContact CB-CD2 3.73Å; L327-Y329 HydrophobicContact CB-CE2 4.18Å; L327-Y329 HydrophobicContact CD1-CD2 3.94Å; L327-Y329 HydrophobicContact CD1-CE2 4.21Å; L327-Y329 HydrophobicContact CD2-CD2 4.41Å; L327-Y329 HydrophobicContact CD2-CE2 4.04Å; L327-Y329 HydrophobicContact CG-CD2 4.25Å; L327-Y329 HydrophobicContact CG-CE2 4.38Å; L327-Y329 PolarHBondContact O-N 3.23Å
330	N	88.1	Confident	83.1	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	117.1	168.5	-62.6	-52.6	0	0	0	105.4	V315 V316 L343 S344 L346 W385	V315-N330 WeakPolarHBondContact O-CA 3.46Å; V316-N330 WeakPolarHBondContact CA-OD1 3.01Å; V316-N330 WeakPolarHBondContact CG1-OD1 3.47Å; N330-L343 HydrophobicContact CB-CB 4.01Å; N330-L343 WeakPolarHBondContact O-CB 3.44Å; N330-L343 PolarHBondContact O-N 3.31Å; N330-S344 PolarHBondContact ND2-O 3.43Å; N330-L346 PolarHBondContact ND2-N 3.43Å; N330-L346 VanDerWaalsContact ND2-N 3.12Å; N330-W385 WeakPolarHBondContact ND2-CZ2 3.34Å; N330-W385 PolarHBondContact ND2-NE1 3.07Å
331	D	91.8	Very high	83.5	Confident	28 Å²	28	53.6 Å²	53.6	15%	0.15	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.4	-176.7	-64.4	-61.6	0	0	0	108.9	V315 W340 S342	V315-D331 PolarHBondContact N-O 2.78Å; V315-D331 PolarHBondContact O-N 3.48Å; D331-W340 HydrophobicContact CB-CE3 3.78Å; D331-W340 HydrophobicContact CB-CZ3 3.95Å; D331-S342 WeakPolarHBondContact OD1-CA 3.42Å; D331-S342 WeakPolarHBondContact OD1-CB 3.42Å; D331-S342 PolarHBondContact OD1-OG 2.68Å
332	C	92.6	Very high	84.2	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.034	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.5	174.7	71.5	0	0	0	0	111.3	V312 I313 V314 W340 K341 L343	V312-C332 HydrophobicContact CB-CB 4.24Å; V312-C332 HydrophobicContact CG2-CB 4.01Å; I313-C332 CarbonylContact O-C 3.57Å; I313-C332 WeakPolarHBondContact O-CA 3.44Å; V314-C332 HydrophobicContact CG2-CB 3.93Å; C332-W340 CarbonylContact O-C 3.56Å; C332-W340 WeakPolarHBondContact O-CA 3.15Å; C332-K341 PolarHBondContact N-O 2.76Å; C332-K341 PolarHBondContact O-N 2.82Å; C332-K341 PolarHBondContact SG-O 3.49Å; C332-K341 VanDerWaalsContact SG-O 3.36Å; C332-L343 HydrophobicContact CB-CD1 4.23Å; C332-L343 HydrophobicContact CB-CD2 4.36Å; C332-L343 HydrophobicContact CB-CG 4.37Å
333	Y	93.2	Very high	85.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.5	175.9	171.9	-113.8	0	0	0	109.8	V312 I313 P335 E339 W340 Y545 I560 D573	V312-Y333 CarbonylContact C-O 3.53Å; V312-Y333 VanDerWaalsContact CA-O 3.29Å; V312-Y333 WeakPolarHBondContact CA-O 3.44Å; V312-Y333 WeakPolarHBondContact CB-O 3.31Å; I313-Y333 HydrophobicContact CD1-CD1 4.38Å; I313-Y333 PolarHBondContact N-O 3.02Å; I313-Y333 PolarHBondContact O-N 2.75Å; Y333-P335 HydrophobicContact CD1-CB 4.44Å; Y333-P335 HydrophobicContact CD1-CG 3.99Å; Y333-P335 HydrophobicContact CE1-CB 3.82Å; Y333-P335 HydrophobicContact CE1-CG 3.85Å; Y333-P335 WeakPolarHBondContact O-CD 3.47Å; Y333-E339 WeakPolarHBondContact CA-O 3.27Å; Y333-W340 AromaticContact CD2-CD1 3.87Å; Y333-W340 HydrophobicContact CD2-CD2 4.08Å; Y333-W340 AromaticContact CD2-CE2 3.48Å; Y333-W340 VanDerWaalsContact CD2-CE2 3.48Å; Y333-W340 HydrophobicContact CD2-CG 4.31Å; Y333-W340 AromaticContact CD2-CZ2 3.85Å; Y333-W340 HydrophobicContact CD2-CZ2 3.85Å; Y333-W340 AromaticContact CD2-NE1 3.35Å; Y333-W340 VanDerWaalsContact CD2-NE1 3.35Å; Y333-W340 AromaticContact CE2-NE1 3.89Å; Y333-W340 HydrophobicContact CG-CD2 4.41Å; Y333-W340 AromaticContact CG-CE2 3.86Å; Y333-W340 HydrophobicContact CG-CH2 4.34Å; Y333-W340 AromaticContact CG-CZ2 3.82Å; Y333-W340 HydrophobicContact CG-CZ2 3.82Å; Y333-Y545 HydrophobicContact CE1-CE1 4.4Å; Y333-I560 HydrophobicContact CD1-CD1 4.48Å; Y333-I560 HydrophobicContact CE1-CD1 4.28Å; Y333-I560 HydrophobicContact CE2-CD1 4.36Å; Y333-D573 PolarHBondContact OH-OD1 3.27Å; Y333-D573 PolarHBondContact OH-OD2 3.34Å; Y333-D573 VanDerWaalsContact OH-OD2 3.09Å
334	D	91.6	Very high	86.4	Confident	8 Å²	8	45.1 Å²	45.1	4%	0.043	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	110.2	171.5	-176.9	-43.9	0	0	0	109	S310 V312 V336 T337 G338 E339	S310-D334 WeakPolarHBondContact CB-OD2 3.26Å; S310-D334 VanDerWaalsContact OG-CG 3.3Å; S310-D334 PolarHBondContact OG-OD1 3.4Å; S310-D334 PolarHBondContact OG-OD2 3.15Å; V312-D334 HydrophobicContact CG1-CB 4.06Å; D334-V336 PolarHBondContact O-N 3.08Å; D334-V336 WeakPolarHBondContact OD1-CA 3.29Å; D334-V336 VanDerWaalsContact OD1-CB 3.29Å; D334-V336 WeakPolarHBondContact OD1-CB 3.4Å; D334-V336 PolarHBondContact OD1-N 3.16Å; D334-T337 WeakPolarHBondContact CB-OG1 3.14Å; D334-T337 PolarHBondContact O-N 3.48Å; D334-T337 PolarHBondContact OD1-N 3.45Å; D334-G338 WeakPolarHBondContact O-CA 3.44Å; D334-G338 PolarHBondContact O-N 3.01Å; D334-E339 PolarHBondContact N-O 3.4Å
335	P	89.6	Confident	87.3	Confident	18 Å²	18	50.3 Å²	50.3	12%	0.117	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.2	-177	-13.8	29.4	0	0	0	114.6	E311 I313 Y333 A540 Y545	E311-P335 WeakPolarHBondContact O-CD 3.47Å; I313-P335 HydrophobicContact CD1-CG 4.06Å; I313-P335 HydrophobicContact CG1-CG 4.22Å; Y333-P335 HydrophobicContact CD1-CB 4.44Å; Y333-P335 HydrophobicContact CD1-CG 3.99Å; Y333-P335 HydrophobicContact CE1-CB 3.82Å; Y333-P335 HydrophobicContact CE1-CG 3.85Å; Y333-P335 WeakPolarHBondContact O-CD 3.47Å; P335-A540 HydrophobicContact CG-CB 4.09Å; P335-Y545 HydrophobicContact CB-CE1 3.88Å; P335-Y545 HydrophobicContact CB-CE2 4.3Å; P335-Y545 VanDerWaalsContact CB-OH 3.26Å; P335-Y545 WeakPolarHBondContact CB-OH 3.39Å; P335-Y545 HydrophobicContact CG-CE1 4.38Å; P335-Y545 HydrophobicContact CG-CE2 4.41Å
336	V	86	Confident	87.8	Confident	68 Å²	68	42.2 Å²	42.2	41%	0.412	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-36.8	176.7	-172.9	0	0	0	0	110.7	D334	D334-V336 PolarHBondContact O-N 3.08Å; D334-V336 WeakPolarHBondContact OD1-CA 3.29Å; D334-V336 VanDerWaalsContact OD1-CB 3.29Å; D334-V336 WeakPolarHBondContact OD1-CB 3.4Å; D334-V336 PolarHBondContact OD1-N 3.16Å
337	T	86.8	Confident	88.1	Confident	67 Å²	67	43.6 Å²	43.6	41%	0.411	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-20.4	177.7	66.4	0	0	0	0	113.6	D334 E339	D334-T337 WeakPolarHBondContact CB-OG1 3.14Å; D334-T337 PolarHBondContact O-N 3.48Å; D334-T337 PolarHBondContact OD1-N 3.45Å; T337-E339 PolarHBondContact O-N 2.74Å; T337-E339 WeakPolarHBondContact OG1-CB 3.3Å; T337-E339 WeakPolarHBondContact OG1-CG 3.1Å; T337-E339 PolarHBondContact OG1-N 3.36Å
338	G	88.4	Confident	87.5	Confident	18 Å²	18	49.2 Å²	49.2	19%	0.186	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	13.6	-171.2	0	0	0	0	0	113.6	D334	D334-G338 WeakPolarHBondContact O-CA 3.44Å; D334-G338 PolarHBondContact O-N 3.01Å
339	E	90	Very high	86.8	Confident	94 Å²	94	48 Å²	48	44%	0.439	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	147.2	-178.4	-68.4	-174.9	162	0	0	112.7	Y333 D334 T337 K341	Y333-E339 WeakPolarHBondContact CA-O 3.27Å; D334-E339 PolarHBondContact N-O 3.4Å; T337-E339 PolarHBondContact O-N 2.74Å; T337-E339 WeakPolarHBondContact OG1-CB 3.3Å; T337-E339 WeakPolarHBondContact OG1-CG 3.1Å; T337-E339 PolarHBondContact OG1-N 3.36Å; E339-K341 WeakPolarHBondContact OE2-CE 3.49Å; E339-K341 IonicContact OE2-NZ 3.24Å; E339-K341 PolarHBondContact OE2-NZ 3.32Å
340	W	92.1	Very high	85.7	Confident	58 Å²	58	48.9 Å²	48.9	22%	0.22	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.6	171.4	-75.3	89.9	0	0	0	110.6	V315 D331 C332 Y333 L547 I560 M576 P577	V315-W340 HydrophobicContact CG2-CH2 3.96Å; V315-W340 HydrophobicContact CG2-CZ3 4.14Å; D331-W340 HydrophobicContact CB-CE3 3.78Å; D331-W340 HydrophobicContact CB-CZ3 3.95Å; C332-W340 CarbonylContact O-C 3.56Å; C332-W340 WeakPolarHBondContact O-CA 3.15Å; Y333-W340 AromaticContact CD2-CD1 3.87Å; Y333-W340 HydrophobicContact CD2-CD2 4.08Å; Y333-W340 AromaticContact CD2-CE2 3.48Å; Y333-W340 VanDerWaalsContact CD2-CE2 3.48Å; Y333-W340 HydrophobicContact CD2-CG 4.31Å; Y333-W340 AromaticContact CD2-CZ2 3.85Å; Y333-W340 HydrophobicContact CD2-CZ2 3.85Å; Y333-W340 AromaticContact CD2-NE1 3.35Å; Y333-W340 VanDerWaalsContact CD2-NE1 3.35Å; Y333-W340 AromaticContact CE2-NE1 3.89Å; Y333-W340 HydrophobicContact CG-CD2 4.41Å; Y333-W340 AromaticContact CG-CE2 3.86Å; Y333-W340 HydrophobicContact CG-CH2 4.34Å; Y333-W340 AromaticContact CG-CZ2 3.82Å; Y333-W340 HydrophobicContact CG-CZ2 3.82Å; W340-L547 HydrophobicContact CH2-CD2 4.28Å; W340-I560 HydrophobicContact CZ2-CD1 3.71Å; W340-M576 HydrophobicContact CH2-CB 4.17Å; W340-M576 HydrophobicContact CH2-CG 3.77Å; W340-M576 HydrophobicContact CH2-SD 4.24Å; W340-M576 HydrophobicContact CZ2-CB 3.95Å; W340-M576 HydrophobicContact CZ2-CG 3.65Å; W340-P577 HydrophobicContact CB-CG 4.02Å; W340-P577 VanDerWaalsContact CD2-CD 3.47Å; W340-P577 HydrophobicContact CD2-CG 3.73Å; W340-P577 VanDerWaalsContact CE2-CD 3.49Å; W340-P577 HydrophobicContact CE3-CG 4.1Å; W340-P577 HydrophobicContact CG-CG 3.69Å
341	K	91.4	Very high	84.8	Confident	83 Å²	83	51.3 Å²	51.3	36%	0.361	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.6	177.4	-64.2	175.2	-176.3	162.5	0	110.4	C332 E339	C332-K341 PolarHBondContact N-O 2.76Å; C332-K341 PolarHBondContact O-N 2.82Å; C332-K341 PolarHBondContact SG-O 3.49Å; C332-K341 VanDerWaalsContact SG-O 3.36Å; E339-K341 WeakPolarHBondContact OE2-CE 3.49Å; E339-K341 IonicContact OE2-NZ 3.24Å; E339-K341 PolarHBondContact OE2-NZ 3.32Å
342	S	91.8	Very high	84	Confident	91 Å²	91	50.5 Å²	50.5	64%	0.636	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	142	178.3	-56.8	0	0	0	0	112.5	D331	D331-S342 WeakPolarHBondContact OD1-CA 3.42Å; D331-S342 WeakPolarHBondContact OD1-CB 3.42Å; D331-S342 PolarHBondContact OD1-OG 2.68Å
343	L	91.8	Very high	83.7	Confident	14 Å²	14	51 Å²	51	7%	0.073	27%	0.272	C	S	.	.			trans	-105.3	177.5	176.6	-52.8	-176.9	0	0	0	110.8	V314 N330 C332 K345 Y378 R590	V314-L343 HydrophobicContact CB-CD1 4.5Å; V314-L343 HydrophobicContact CG1-CD1 3.64Å; V314-L343 HydrophobicContact CG2-CD1 4.01Å; N330-L343 HydrophobicContact CB-CB 4.01Å; N330-L343 WeakPolarHBondContact O-CB 3.44Å; N330-L343 PolarHBondContact O-N 3.31Å; C332-L343 HydrophobicContact CB-CD1 4.23Å; C332-L343 HydrophobicContact CB-CD2 4.36Å; C332-L343 HydrophobicContact CB-CG 4.37Å; L343-K345 PolarHBondContact O-N 2.8Å; L343-Y378 HydrophobicContact CD1-CE1 4.2Å; L343-R590 VanDerWaalsContact CD2-NH1 3.26Å
344	S	89.6	Confident	83.5	Confident	26 Å²	26	51.8 Å²	51.8	18%	0.182	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-58.5	135.4	173.4	65.8	0	0	0	0	111.4	N330 Y378 N383 W385	N330-S344 PolarHBondContact ND2-O 3.43Å; S344-Y378 WeakPolarHBondContact OG-CE2 3.42Å; S344-N383 WeakPolarHBondContact CB-O 3.21Å; S344-N383 WeakPolarHBondContact CB-OD1 3.33Å; S344-N383 PolarHBondContact N-OD1 2.81Å; S344-N383 PolarHBondContact OG-O 2.89Å; S344-N383 VanDerWaalsContact OG-O 3.1Å; S344-N383 PolarHBondContact OG-OD1 3.16Å; S344-W385 PolarHBondContact O-NE1 3.02Å; S344-W385 VanDerWaalsContact OG-CD1 3.26Å; S344-W385 PolarHBondContact OG-NE1 3.19Å
345	K	89.4	Confident	83.6	Confident	138 Å²	138	51.6 Å²	51.6	60%	0.6	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-66.8	140.3	-178.4	-65.9	-179.9	-177.1	174.7	0	110.8	P328 L343 P347 W385	P328-K345 VanDerWaalsContact O-CA 3.31Å; P328-K345 WeakPolarHBondContact O-CA 3.39Å; P328-K345 WeakPolarHBondContact O-CB 3.37Å; L343-K345 PolarHBondContact O-N 2.8Å; K345-P347 WeakPolarHBondContact O-CD 3.49Å; K345-W385 VanDerWaalsContact O-CD1 3.32Å
346	L	83.1	Confident	83.8	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-67.8	121.8	179.1	-178	60.2	0	0	0	109.8	V316 P328 N330 F349 V365 W376 W385	V316-L346 HydrophobicContact CG1-CD2 4.12Å; P328-L346 PolarHBondContact O-N 3.29Å; N330-L346 PolarHBondContact ND2-N 3.43Å; N330-L346 VanDerWaalsContact ND2-N 3.12Å; L346-F349 HydrophobicContact CB-CB 4.27Å; L346-F349 HydrophobicContact CD1-CD2 4.09Å; L346-F349 HydrophobicContact CD2-CB 3.69Å; L346-F349 HydrophobicContact CD2-CD1 3.92Å; L346-F349 HydrophobicContact CD2-CD2 3.33Å; L346-F349 HydrophobicContact CD2-CE1 4.43Å; L346-F349 HydrophobicContact CD2-CE2 3.88Å; L346-F349 HydrophobicContact CD2-CG 3.32Å; L346-F349 HydrophobicContact CD2-CZ 4.39Å; L346-F349 HydrophobicContact CG-CB 3.72Å; L346-F349 HydrophobicContact CG-CD2 3.49Å; L346-F349 VanDerWaalsContact CG-CD2 3.49Å; L346-F349 HydrophobicContact CG-CE2 4.31Å; L346-F349 HydrophobicContact CG-CG 3.73Å; L346-V365 HydrophobicContact CD1-CB 4.44Å; L346-V365 HydrophobicContact CD1-CG2 4.24Å; L346-V365 HydrophobicContact CD2-CG1 4.21Å; L346-V365 HydrophobicContact CD2-CG2 4.41Å; L346-W376 HydrophobicContact CD1-CB 4.32Å; L346-W385 HydrophobicContact CB-CZ2 4.34Å; L346-W385 HydrophobicContact CD1-CD2 3.6Å; L346-W385 HydrophobicContact CD1-CE3 3.52Å; L346-W385 HydrophobicContact CD1-CG 4.42Å; L346-W385 HydrophobicContact CD1-CH2 3.64Å; L346-W385 HydrophobicContact CD1-CZ2 3.71Å; L346-W385 HydrophobicContact CD1-CZ3 3.54Å
347	P	81.1	Confident	84.3	Confident	38 Å²	38	48.9 Å²	48.9	25%	0.247	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	145.4	-178.7	-25.7	35.7	0	0	0	113	K345 F349 W376 W385	K345-P347 WeakPolarHBondContact O-CD 3.49Å; P347-F349 PolarHBondContact O-N 3.2Å; P347-W376 HydrophobicContact CB-CE3 4.39Å; P347-W376 HydrophobicContact CB-CH2 3.72Å; P347-W376 HydrophobicContact CB-CZ2 3.91Å; P347-W376 HydrophobicContact CB-CZ3 3.98Å; P347-W376 HydrophobicContact CG-CE3 4.1Å; P347-W376 HydrophobicContact CG-CH2 4.12Å; P347-W376 HydrophobicContact CG-CZ3 3.84Å; P347-W385 VanDerWaalsContact CD-CB 3.46Å; P347-W385 VanDerWaalsContact CD-CG 3.44Å; P347-W385 HydrophobicContact CG-CB 3.68Å; P347-W385 HydrophobicContact CG-CG 4.19Å
348	E	68.2	Low	84.6	Confident	143 Å²	143	47 Å²	47	67%	0.668	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	11.6	167.6	-55.3	-178.7	159	0	0	116.4	T350	E348-T350 PolarHBondContact O-N 2.97Å
349	F	63.2	Low	84.8	Confident	22 Å²	22	46.8 Å²	46.8	10%	0.096	24%	0.243	C	C	.	.			trans	-91.2	73.4	-162.7	-125.4	-81	0	0	0	116.1	N326 L346 P347 K351 Y354 V365	N326-F349 PolarHBondContact ND2-O 2.62Å; N326-F349 VanDerWaalsContact ND2-O 3.12Å; L346-F349 HydrophobicContact CB-CB 4.27Å; L346-F349 HydrophobicContact CD1-CD2 4.09Å; L346-F349 HydrophobicContact CD2-CB 3.69Å; L346-F349 HydrophobicContact CD2-CD1 3.92Å; L346-F349 HydrophobicContact CD2-CD2 3.33Å; L346-F349 HydrophobicContact CD2-CE1 4.43Å; L346-F349 HydrophobicContact CD2-CE2 3.88Å; L346-F349 HydrophobicContact CD2-CG 3.32Å; L346-F349 HydrophobicContact CD2-CZ 4.39Å; L346-F349 HydrophobicContact CG-CB 3.72Å; L346-F349 HydrophobicContact CG-CD2 3.49Å; L346-F349 VanDerWaalsContact CG-CD2 3.49Å; L346-F349 HydrophobicContact CG-CE2 4.31Å; L346-F349 HydrophobicContact CG-CG 3.73Å; P347-F349 PolarHBondContact O-N 3.2Å; F349-K351 VanDerWaalsContact C-N 3.34Å; F349-K351 WeakPolarHBondContact CD1-O 3.03Å; F349-K351 HydrophobicContact CE1-CB 4.32Å; F349-K351 WeakPolarHBondContact CE1-O 3.32Å; F349-Y354 HydrophobicContact CD1-CD1 4.19Å; F349-Y354 HydrophobicContact CD1-CE1 4.19Å; F349-Y354 AromaticContact CE1-CD1 3.31Å; F349-Y354 HydrophobicContact CE1-CD1 3.31Å; F349-Y354 HydrophobicContact CE1-CD2 4.31Å; F349-Y354 AromaticContact CE1-CE1 3.73Å; F349-Y354 HydrophobicContact CE1-CE1 3.73Å; F349-Y354 AromaticContact CE1-CG 3.62Å; F349-Y354 HydrophobicContact CE1-CG 3.62Å; F349-Y354 AromaticContact CZ-CD1 3.98Å; F349-Y354 HydrophobicContact CZ-CD1 3.98Å; F349-Y354 HydrophobicContact CZ-CD2 4.32Å; F349-Y354 AromaticContact CZ-CG 3.8Å; F349-Y354 HydrophobicContact CZ-CG 3.8Å; F349-V365 HydrophobicContact CE2-CG1 3.65Å; F349-V365 HydrophobicContact CZ-CG1 3.66Å
350	T	60.2	Low	84.6	Confident	98 Å²	98	48 Å²	48	60%	0.601	24%	0.244	S	C	*	.			trans	-83.9	-6.4	169.4	55	0	0	0	0	114.1	E348	E348-T350 PolarHBondContact O-N 2.97Å
351	K	68.8	Low	84.5	Confident	55 Å²	55	47.1 Å²	47.1	24%	0.239	24%	0.243	C	C	.	.			trans	-99.4	137.6	-168.3	-61.8	167.6	176.8	175.1	0	111.4	N326 F349 R369 S372	N326-K351 VanDerWaalsContact CB-O 3.25Å; N326-K351 WeakPolarHBondContact CB-O 3.47Å; F349-K351 VanDerWaalsContact C-N 3.34Å; F349-K351 WeakPolarHBondContact CD1-O 3.03Å; F349-K351 HydrophobicContact CE1-CB 4.32Å; F349-K351 WeakPolarHBondContact CE1-O 3.32Å; K351-R369 VanDerWaalsContact CD-O 3.26Å; K351-R369 WeakPolarHBondContact CD-O 3.34Å; K351-R369 WeakPolarHBondContact CG-O 3.44Å; K351-S372 PolarHBondContact NZ-OG 2.84Å
352	S	76.3	Confident	84.5	Confident	10 Å²	10	44.9 Å²	44.9	7%	0.07	24%	0.235	C	C	.	.			trans	-96.5	177.4	174	60.8	0	0	0	0	112.2	Y354 G368 R369	S352-Y354 VanDerWaalsContact C-N 3.35Å; S352-Y354 PolarHBondContact O-N 3.17Å; S352-G368 WeakPolarHBondContact O-CA 3.29Å; S352-R369 WeakPolarHBondContact O-CB 3.37Å; S352-R369 PolarHBondContact O-N 3.21Å
353	E	84.4	Confident	84.7	Confident	17 Å²	17	40.5 Å²	40.5	8%	0.079	21%	0.205	C	C	.	.	S	Bend	trans	59.6	38.1	171.3	-55.9	-179	155.4	0	0	115	W396 R397 Y582	E353-W396 HydrophobicContact CB-CE3 4.39Å; E353-W396 WeakPolarHBondContact O-CA 3.2Å; E353-W396 WeakPolarHBondContact OE2-CZ3 3.47Å; E353-R397 HydrophobicContact CB-CG 4Å; E353-R397 HydrophobicContact CG-CG 4.35Å; E353-R397 PolarHBondContact O-N 3.37Å; E353-R397 IonicContact OE1-CZ 3.78Å; E353-R397 IonicContact OE1-NE 2.65Å; E353-R397 PolarHBondContact OE1-NE 3.07Å; E353-R397 VanDerWaalsContact OE1-NE 3.12Å; E353-R397 IonicContact OE1-NH2 3.49Å; E353-R397 PolarHBondContact OE1-NH2 3.22Å; E353-R397 WeakPolarHBondContact OE2-CG 3.28Å; E353-R397 IonicContact OE2-CZ 2.92Å; E353-R397 IonicContact OE2-NE 2.71Å; E353-R397 PolarHBondContact OE2-NE 3.01Å; E353-R397 IonicContact OE2-NH2 3.53Å; E353-R397 PolarHBondContact OE2-NH2 3.36Å; E353-Y582 HydrophobicContact CG-CD1 3.89Å; E353-Y582 HydrophobicContact CG-CE1 4.31Å
354	Y	89.7	Confident	84.9	Confident	16 Å²	16	39.9 Å²	39.9	6%	0.063	20%	0.201	C	C	.	.			trans	-86	172	169.3	53.1	-81.4	0	0	0	111	V316 G317 G318 N326 F349 S352 V356 V365 S366	V316-Y354 HydrophobicContact CG1-CE2 4Å; V316-Y354 PolarHBondContact O-OH 2.83Å; G317-Y354 VanDerWaalsContact CA-OH 3.24Å; G317-Y354 WeakPolarHBondContact CA-OH 3.31Å; G318-Y354 PolarHBondContact N-OH 2.78Å; G318-Y354 VanDerWaalsContact N-OH 3.16Å; N326-Y354 WeakPolarHBondContact OD1-CE1 3.31Å; N326-Y354 PolarHBondContact OD1-OH 2.81Å; F349-Y354 HydrophobicContact CD1-CD1 4.19Å; F349-Y354 HydrophobicContact CD1-CE1 4.19Å; F349-Y354 AromaticContact CE1-CD1 3.31Å; F349-Y354 HydrophobicContact CE1-CD1 3.31Å; F349-Y354 HydrophobicContact CE1-CD2 4.31Å; F349-Y354 AromaticContact CE1-CE1 3.73Å; F349-Y354 HydrophobicContact CE1-CE1 3.73Å; F349-Y354 AromaticContact CE1-CG 3.62Å; F349-Y354 HydrophobicContact CE1-CG 3.62Å; F349-Y354 AromaticContact CZ-CD1 3.98Å; F349-Y354 HydrophobicContact CZ-CD1 3.98Å; F349-Y354 HydrophobicContact CZ-CD2 4.32Å; F349-Y354 AromaticContact CZ-CG 3.8Å; F349-Y354 HydrophobicContact CZ-CG 3.8Å; S352-Y354 VanDerWaalsContact C-N 3.35Å; S352-Y354 PolarHBondContact O-N 3.17Å; Y354-V356 HydrophobicContact CD2-CG2 3.53Å; Y354-V356 HydrophobicContact CE2-CG2 3.43Å; Y354-V356 VanDerWaalsContact CE2-CG2 3.43Å; Y354-V365 HydrophobicContact CD2-CG1 3.63Å; Y354-V365 HydrophobicContact CE2-CG1 4.18Å; Y354-V365 HydrophobicContact CG-CG1 4.26Å; Y354-S366 WeakPolarHBondContact CB-O 3.46Å
355	A	93.5	Very high	85.1	Confident	3 Å²	3	38.7 Å²	38.7	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	151.9	170.9	0	0	0	0	0	111.2	V365 S366 H398 M400	A355-V365 WeakPolarHBondContact O-CA 3.29Å; A355-S366 PolarHBondContact N-O 2.83Å; A355-S366 PolarHBondContact O-N 2.93Å; A355-H398 VanDerWaalsContact CB-NE2 3.35Å; A355-H398 WeakPolarHBondContact CB-NE2 3.46Å; A355-M400 HydrophobicContact CB-CB 4.19Å; A355-M400 HydrophobicContact CB-CE 4.07Å; A355-M400 HydrophobicContact CB-CG 3.79Å; A355-M400 WeakPolarHBondContact O-CE 3.44Å
356	V	94.6	Very high	85.3	Confident	22 Å²	22	32.1 Å²	32.1	13%	0.133	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.5	174.5	-171.6	0	0	0	0	109.6	V316 Y354 I363 L364 V365 V586	V316-V356 HydrophobicContact CB-CG1 4.4Å; V316-V356 HydrophobicContact CB-CG2 4.26Å; V316-V356 HydrophobicContact CG1-CG2 4.09Å; V316-V356 HydrophobicContact CG2-CG1 4.09Å; Y354-V356 HydrophobicContact CD2-CG2 3.53Å; Y354-V356 HydrophobicContact CE2-CG2 3.43Å; Y354-V356 VanDerWaalsContact CE2-CG2 3.43Å; V356-I363 HydrophobicContact CG1-CG2 3.45Å; V356-I363 VanDerWaalsContact CG1-CG2 3.45Å; V356-L364 VanDerWaalsContact CA-O 3.27Å; V356-L364 WeakPolarHBondContact CA-O 3.17Å; V356-V365 HydrophobicContact CG1-CG2 4.29Å; V356-V365 HydrophobicContact CG2-CG2 4.02Å; V356-V586 HydrophobicContact CG1-CG1 3.86Å; V356-V586 HydrophobicContact CG1-CG2 4.42Å
357	C	95.2	Very high	85.7	Confident	8 Å²	8	31.9 Å²	31.9	5%	0.054	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	152.9	170.7	63.9	0	0	0	0	111.1	L364 M400 V402 V407	C357-L364 PolarHBondContact N-O 2.9Å; C357-L364 PolarHBondContact O-N 2.83Å; C357-M400 HydrophobicContact CB-CB 3.86Å; C357-V402 HydrophobicContact CB-CG2 3.94Å; C357-V407 WeakPolarHBondContact SG-CG1 3.34Å
358	A	93.9	Very high	85.9	Confident	26 Å²	26	30.1 Å²	30.1	22%	0.215	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.1	169.4	0	0	0	0	0	110.2	D362 V402 V586 I588	A358-D362 CarbonylContact C-O 3.49Å; A358-D362 WeakPolarHBondContact CA-O 3.41Å; A358-V402 VanDerWaalsContact O-CG2 3.23Å; A358-V402 WeakPolarHBondContact O-CG2 3.29Å; A358-V586 HydrophobicContact CB-CB 4.03Å; A358-V586 HydrophobicContact CB-CG1 4.43Å; A358-V586 HydrophobicContact CB-CG2 4.48Å; A358-I588 HydrophobicContact CB-CG2 4.36Å
359	L	92.2	Very high	86.3	Confident	14 Å²	14	28.5 Å²	28.5	7%	0.073	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	108.8	169.5	175.3	64.9	0	0	0	107.7	N361 D362 L364 V402 V407	L359-N361 PolarHBondContact O-N 2.73Å; L359-D362 PolarHBondContact N-O 2.91Å; L359-D362 PolarHBondContact O-N 2.99Å; L359-L364 HydrophobicContact CB-CD1 3.69Å; L359-L364 HydrophobicContact CD2-CD1 4.19Å; L359-V402 HydrophobicContact CD1-CG1 3.55Å; L359-V407 HydrophobicContact CB-CG2 4.06Å; L359-V407 HydrophobicContact CD1-CG2 4.18Å; L359-V407 HydrophobicContact CD2-CG2 4.05Å; L359-V407 HydrophobicContact CG-CG2 4.32Å
360	R	87.3	Confident	86.9	Confident	121 Å²	121	33.9 Å²	33.9	46%	0.457	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	-105.3	-167.7	-56.1	173.3	174.5	156.7	-2.5	110	V291 N294	V291-R360 PolarHBondContact O-NE 3.25Å; V291-R360 PolarHBondContact O-NH2 3.07Å; N294-R360 PolarHBondContact ND2-O 2.95Å; N294-R360 VanDerWaalsContact ND2-O 3.14Å
361	N	88.9	Confident	87.5	Confident	38 Å²	38	32.1 Å²	32.1	20%	0.203	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-2	179.3	-149.9	57.9	0	0	0	114.1	L359 S380 I588 H589	L359-N361 PolarHBondContact O-N 2.73Å; N361-S380 PolarHBondContact ND2-OG 3.01Å; N361-S380 WeakPolarHBondContact O-CB 2.93Å; N361-S380 PolarHBondContact O-OG 2.95Å; N361-I588 WeakPolarHBondContact O-CG2 3.32Å; N361-H589 PolarHBondContact ND2-O 3.15Å; N361-H589 WeakPolarHBondContact OD1-CA 3.46Å; N361-H589 PolarHBondContact OD1-N 2.96Å; N361-H589 PolarHBondContact OD1-O 3Å
362	D	92.5	Very high	88.2	Confident	36 Å²	36	30 Å²	30	19%	0.193	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	150.4	-178.8	-73.3	-15.7	0	0	0	110.6	A358 L359 L377 Y378 N379 S380	A358-D362 CarbonylContact C-O 3.49Å; A358-D362 WeakPolarHBondContact CA-O 3.41Å; L359-D362 PolarHBondContact N-O 2.91Å; L359-D362 PolarHBondContact O-N 2.99Å; D362-L377 HydrophobicContact CB-CD2 4.16Å; D362-L377 HydrophobicContact CB-CG 4.36Å; D362-Y378 WeakPolarHBondContact CA-O 3.44Å; D362-Y378 WeakPolarHBondContact CB-O 3.48Å; D362-N379 WeakPolarHBondContact OD1-CA 3.23Å; D362-N379 PolarHBondContact OD2-ND2 2.87Å; D362-N379 VanDerWaalsContact OD2-ND2 3.12Å; D362-S380 PolarHBondContact OD1-N 2.93Å; D362-S380 PolarHBondContact OD1-OG 3.37Å
363	I	95.2	Very high	88.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.4	-172.9	-54.6	173.6	0	0	0	109.3	V314 V316 V356 L377 Y378 V586 I588	V314-I363 HydrophobicContact CB-CD1 3.72Å; V314-I363 HydrophobicContact CG1-CD1 3.71Å; V314-I363 HydrophobicContact CG2-CD1 3.83Å; V316-I363 HydrophobicContact CG2-CG2 4.33Å; V356-I363 HydrophobicContact CG1-CG2 3.45Å; V356-I363 VanDerWaalsContact CG1-CG2 3.45Å; I363-L377 CarbonylContact O-C 3.52Å; I363-L377 WeakPolarHBondContact O-CA 3.32Å; I363-Y378 HydrophobicContact CB-CD1 4.28Å; I363-Y378 HydrophobicContact CD1-CD1 3.95Å; I363-Y378 HydrophobicContact CD1-CE1 4.4Å; I363-Y378 HydrophobicContact CG1-CD1 4.13Å; I363-Y378 PolarHBondContact N-O 3.01Å; I363-Y378 VanDerWaalsContact N-O 3.08Å; I363-Y378 PolarHBondContact O-N 3.05Å; I363-V586 HydrophobicContact CB-CG2 4.46Å; I363-V586 HydrophobicContact CD1-CG2 3.6Å; I363-V586 HydrophobicContact CG1-CG2 3.77Å; I363-V586 HydrophobicContact CG2-CG2 3.91Å; I363-I588 HydrophobicContact CD1-CD1 4.37Å; I363-I588 HydrophobicContact CD1-CG2 4.07Å; I363-I588 HydrophobicContact CG1-CG2 3.82Å
364	L	95.2	Very high	89.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	137.4	171.7	-75.8	82.1	0	0	0	110.4	V356 C357 L359 V375 W376 L377 M400 V407 Y425	V356-L364 VanDerWaalsContact CA-O 3.27Å; V356-L364 WeakPolarHBondContact CA-O 3.17Å; C357-L364 PolarHBondContact N-O 2.9Å; C357-L364 PolarHBondContact O-N 2.83Å; L359-L364 HydrophobicContact CB-CD1 3.69Å; L359-L364 HydrophobicContact CD2-CD1 4.19Å; L364-V375 HydrophobicContact CD2-CG1 4.24Å; L364-W376 CarbonylContact C-O 3.54Å; L364-W376 WeakPolarHBondContact CA-O 3.34Å; L364-L377 HydrophobicContact CD1-CD1 3.97Å; L364-L377 HydrophobicContact CD1-CG 4.25Å; L364-L377 HydrophobicContact CG-CB 4.38Å; L364-L377 HydrophobicContact CG-CD1 4.28Å; L364-L377 HydrophobicContact CG-CG 4.39Å; L364-M400 HydrophobicContact CB-CE 4.21Å; L364-M400 VanDerWaalsContact O-CE 3.29Å; L364-M400 WeakPolarHBondContact O-CE 3.5Å; L364-V407 HydrophobicContact CD2-CG2 4.26Å; L364-Y425 HydrophobicContact CD2-CD1 3.9Å; L364-Y425 HydrophobicContact CD2-CE1 3.83Å
365	V	94.4	Very high	89.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.2	171.4	177.1	0	0	0	0	108.1	V316 L346 F349 Y354 A355 V356 V375 W376 W385	V316-V365 HydrophobicContact CG1-CG2 3.86Å; L346-V365 HydrophobicContact CD1-CB 4.44Å; L346-V365 HydrophobicContact CD1-CG2 4.24Å; L346-V365 HydrophobicContact CD2-CG1 4.21Å; L346-V365 HydrophobicContact CD2-CG2 4.41Å; F349-V365 HydrophobicContact CE2-CG1 3.65Å; F349-V365 HydrophobicContact CZ-CG1 3.66Å; Y354-V365 HydrophobicContact CD2-CG1 3.63Å; Y354-V365 HydrophobicContact CE2-CG1 4.18Å; Y354-V365 HydrophobicContact CG-CG1 4.26Å; A355-V365 WeakPolarHBondContact O-CA 3.29Å; V356-V365 HydrophobicContact CG1-CG2 4.29Å; V356-V365 HydrophobicContact CG2-CG2 4.02Å; V365-V375 CarbonylContact O-C 3.59Å; V365-V375 VanDerWaalsContact O-CA 3.29Å; V365-V375 WeakPolarHBondContact O-CA 3.44Å; V365-V375 WeakPolarHBondContact O-CG1 3.19Å; V365-W376 PolarHBondContact N-O 2.59Å; V365-W376 PolarHBondContact O-N 3.44Å; V365-W385 HydrophobicContact CB-CZ3 4.2Å; V365-W385 HydrophobicContact CG2-CH2 3.48Å; V365-W385 VanDerWaalsContact CG2-CH2 3.48Å; V365-W385 HydrophobicContact CG2-CZ3 3.57Å
366	S	93.8	Very high	89.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.8	179.8	70.2	0	0	0	0	114	Y354 A355 H398 M400	Y354-S366 WeakPolarHBondContact CB-O 3.46Å; A355-S366 PolarHBondContact N-O 2.83Å; A355-S366 PolarHBondContact O-N 2.93Å; S366-H398 PolarHBondContact O-CE1 3.25Å; S366-H398 PolarHBondContact O-NE2 2.68Å; S366-H398 PolarHBondContact OG-NE2 2.94Å; S366-M400 WeakPolarHBondContact OG-CE 3.49Å; S366-M400 PolarHBondContact OG-SD 3.45Å
367	G	90.4	Very high	89.6	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	18%	0.175	C	C	.	.			trans	68.6	-142.1	170.4	0	0	0	0	0	114.3	S372 D374 R395	G367-S372 WeakPolarHBondContact CA-O 3.49Å; G367-D374 PolarHBondContact N-O 2.79Å; G367-R395 WeakPolarHBondContact CA-O 3.47Å
368	G	85.3	Confident	89.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.173	C	C	.	.			trans	109.1	168.4	-177.9	0	0	0	0	0	113.6	S352 N371 S372 R395 W396	S352-G368 WeakPolarHBondContact O-CA 3.29Å; G368-N371 PolarHBondContact O-N 3.2Å; G368-S372 PolarHBondContact O-N 2.83Å; G368-R395 PolarHBondContact N-O 2.91Å; G368-W396 VanDerWaalsContact C-CB 3.49Å
369	R	77.8	Confident	89.5	Confident	110 Å²	110	37 Å²	37	42%	0.415	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	142.9	-171	-171	161.8	-169.6	177.7	3.4	112.5	K351 S352 W396	K351-R369 VanDerWaalsContact CD-O 3.26Å; K351-R369 WeakPolarHBondContact CD-O 3.34Å; K351-R369 WeakPolarHBondContact CG-O 3.44Å; S352-R369 WeakPolarHBondContact O-CB 3.37Å; S352-R369 PolarHBondContact O-N 3.21Å; R369-W396 HydrophobicContact CB-CD2 4.42Å; R369-W396 HydrophobicContact CB-CE3 3.69Å; R369-W396 HydrophobicContact CB-CZ3 4.08Å; R369-W396 HydrophobicContact CG-CD2 4.46Å; R369-W396 HydrophobicContact CG-CE3 3.64Å; R369-W396 HydrophobicContact CG-CH2 4.17Å; R369-W396 HydrophobicContact CG-CZ3 3.49Å; R369-W396 VanDerWaalsContact CG-CZ3 3.49Å
370	I	76.3	Confident	89.4	Confident	135 Å²	135	37 Å²	37	69%	0.692	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	36.4	-165.9	-37.1	162.3	0	0	0	111.4	S372	I370-S372 VanDerWaalsContact C-N 3.3Å; I370-S372 PolarHBondContact O-N 2.89Å; I370-S372 VanDerWaalsContact O-N 3.12Å
371	N	71.3	Confident	89.4	Confident	61 Å²	61	39.2 Å²	39.2	33%	0.326	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	45.2	169.8	-56.1	-28.2	0	0	0	114.5	G368 G394 W396 D414 G415	G368-N371 PolarHBondContact O-N 3.2Å; N371-G394 WeakPolarHBondContact O-CA 3.4Å; N371-W396 PolarHBondContact OD1-NE1 2.83Å; N371-D414 VanDerWaalsContact CG-C 3.43Å; N371-D414 VanDerWaalsContact ND2-C 3.33Å; N371-D414 PolarHBondContact ND2-O 2.79Å; N371-D414 PolarHBondContact OD1-O 2.82Å; N371-G415 PolarHBondContact OD1-N 2.81Å
372	S	84.3	Confident	89.4	Confident	10 Å²	10	42.9 Å²	42.9	7%	0.07	20%	0.204	C	C	.	.			trans	-61.3	143.3	-178.1	-149.2	0	0	0	0	110.8	K351 G367 G368 I370 D374 G394 R395	K351-S372 PolarHBondContact NZ-OG 2.84Å; G367-S372 WeakPolarHBondContact CA-O 3.49Å; G368-S372 PolarHBondContact O-N 2.83Å; I370-S372 VanDerWaalsContact C-N 3.3Å; I370-S372 PolarHBondContact O-N 2.89Å; I370-S372 VanDerWaalsContact O-N 3.12Å; S372-D374 PolarHBondContact OG-OD2 3.17Å; S372-G394 VanDerWaalsContact O-CA 3.32Å; S372-G394 WeakPolarHBondContact O-CA 3.46Å; S372-R395 PolarHBondContact O-N 3.03Å
373	R	91.7	Very high	89.4	Confident	127 Å²	127	44 Å²	44	48%	0.479	21%	0.21	S	C	.	.			trans	-99.7	-10.6	169	-69.4	179.1	60.7	-168.5	-4.2	112.4	S390 L391 V392 G394	R373-S390 CarbonylContact O-C 3.58Å; R373-S390 WeakPolarHBondContact O-CA 3.14Å; R373-S390 VanDerWaalsContact O-CB 3.25Å; R373-S390 WeakPolarHBondContact O-CB 3.42Å; R373-L391 PolarHBondContact NE-O 3.3Å; R373-L391 PolarHBondContact NH2-O 2.91Å; R373-L391 PolarHBondContact O-N 2.92Å; R373-V392 PolarHBondContact NE-O 3.46Å; R373-G394 VanDerWaalsContact CG-CA 3.47Å
374	D	92.1	Very high	89.3	Confident	44 Å²	44	48.7 Å²	48.7	24%	0.235	24%	0.235	C	C	.	.			trans	-63.9	143.3	-174.4	-64.1	-50.2	0	0	0	112.2	G367 S372 K387	G367-D374 PolarHBondContact N-O 2.79Å; S372-D374 PolarHBondContact OG-OD2 3.17Å; D374-K387 WeakPolarHBondContact OD1-CE 3.44Å; D374-K387 IonicContact OD1-NZ 2.77Å; D374-K387 PolarHBondContact OD1-NZ 2.91Å; D374-K387 IonicContact OD2-NZ 3.55Å
375	V	94.3	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.4	173.9	-172.8	0	0	0	0	108.1	L364 V365 V388 A389 L391 W432	L364-V375 HydrophobicContact CD2-CG1 4.24Å; V365-V375 CarbonylContact O-C 3.59Å; V365-V375 VanDerWaalsContact O-CA 3.29Å; V365-V375 WeakPolarHBondContact O-CA 3.44Å; V365-V375 WeakPolarHBondContact O-CG1 3.19Å; V375-V388 HydrophobicContact CB-CG2 3.75Å; V375-V388 HydrophobicContact CG1-CG2 3.47Å; V375-V388 VanDerWaalsContact CG1-CG2 3.47Å; V375-V388 PolarHBondContact O-N 3.26Å; V375-A389 WeakPolarHBondContact CG2-O 3.49Å; V375-L391 HydrophobicContact CG2-CD2 4.46Å; V375-L391 HydrophobicContact CG2-CG 3.89Å; V375-W432 HydrophobicContact CG1-CZ2 4.17Å; V375-W432 HydrophobicContact CG2-CZ2 3.96Å
376	W	94.1	Very high	89.2	Confident	28 Å²	28	54 Å²	54	11%	0.106	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.2	179.1	-69	94.6	0	0	0	109.4	L346 P347 L364 V365 W385 K387	L346-W376 HydrophobicContact CD1-CB 4.32Å; P347-W376 HydrophobicContact CB-CE3 4.39Å; P347-W376 HydrophobicContact CB-CH2 3.72Å; P347-W376 HydrophobicContact CB-CZ2 3.91Å; P347-W376 HydrophobicContact CB-CZ3 3.98Å; P347-W376 HydrophobicContact CG-CE3 4.1Å; P347-W376 HydrophobicContact CG-CH2 4.12Å; P347-W376 HydrophobicContact CG-CZ3 3.84Å; L364-W376 CarbonylContact C-O 3.54Å; L364-W376 WeakPolarHBondContact CA-O 3.34Å; V365-W376 PolarHBondContact N-O 2.59Å; V365-W376 PolarHBondContact O-N 3.44Å; W376-W385 HydrophobicContact CB-CE3 3.77Å; W376-W385 HydrophobicContact CB-CZ3 4.17Å; W376-W385 HydrophobicContact CE3-CB 4.21Å; W376-K387 HydrophobicContact CD2-CB 4.33Å; W376-K387 HydrophobicContact CD2-CG 4.47Å; W376-K387 HydrophobicContact CE3-CB 3.93Å; W376-K387 HydrophobicContact CH2-CB 4.03Å; W376-K387 HydrophobicContact CH2-CD 4.21Å; W376-K387 HydrophobicContact CH2-CG 4.47Å; W376-K387 HydrophobicContact CZ2-CB 4.42Å; W376-K387 HydrophobicContact CZ2-CD 3.99Å; W376-K387 HydrophobicContact CZ2-CG 4.39Å; W376-K387 HydrophobicContact CZ3-CB 3.77Å
377	L	95.1	Very high	89.2	Confident	25 Å²	25	58.7 Å²	58.7	13%	0.131	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.4	175	-176.8	151.5	0	0	0	108.5	D362 I363 L364 N379 W385 I386 V388	D362-L377 HydrophobicContact CB-CD2 4.16Å; D362-L377 HydrophobicContact CB-CG 4.36Å; I363-L377 CarbonylContact O-C 3.52Å; I363-L377 WeakPolarHBondContact O-CA 3.32Å; L364-L377 HydrophobicContact CD1-CD1 3.97Å; L364-L377 HydrophobicContact CD1-CG 4.25Å; L364-L377 HydrophobicContact CG-CB 4.38Å; L364-L377 HydrophobicContact CG-CD1 4.28Å; L364-L377 HydrophobicContact CG-CG 4.39Å; L377-N379 HydrophobicContact CD2-CB 4.34Å; L377-W385 CarbonylContact O-C 3.57Å; L377-W385 WeakPolarHBondContact O-CA 3.39Å; L377-I386 PolarHBondContact N-O 2.77Å; L377-I386 PolarHBondContact O-N 3.14Å; L377-V388 HydrophobicContact CB-CG1 3.68Å; L377-V388 HydrophobicContact CB-CG2 4.47Å; L377-V388 HydrophobicContact CD1-CG1 4.31Å
378	Y	94.9	Very high	89.4	Confident	1 Å²	1	59.5 Å²	59.5	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.2	168.3	170.2	-103.7	0	0	0	109.1	L343 S344 D362 I363 N383 L384 W385 I588	L343-Y378 HydrophobicContact CD1-CE1 4.2Å; S344-Y378 WeakPolarHBondContact OG-CE2 3.42Å; D362-Y378 WeakPolarHBondContact CA-O 3.44Å; D362-Y378 WeakPolarHBondContact CB-O 3.48Å; I363-Y378 HydrophobicContact CB-CD1 4.28Å; I363-Y378 HydrophobicContact CD1-CD1 3.95Å; I363-Y378 HydrophobicContact CD1-CE1 4.4Å; I363-Y378 HydrophobicContact CG1-CD1 4.13Å; I363-Y378 PolarHBondContact N-O 3.01Å; I363-Y378 VanDerWaalsContact N-O 3.08Å; I363-Y378 PolarHBondContact O-N 3.05Å; Y378-N383 HydrophobicContact CE2-CB 4.47Å; Y378-N383 WeakPolarHBondContact CE2-OD1 3.41Å; Y378-N383 PolarHBondContact OH-OD1 2.86Å; Y378-N383 VanDerWaalsContact OH-OD1 3.12Å; Y378-L384 WeakPolarHBondContact CA-O 3.34Å; Y378-W385 VanDerWaalsContact CB-CZ3 3.47Å; Y378-W385 HydrophobicContact CD2-CD2 4.24Å; Y378-W385 AromaticContact CD2-CE2 3.86Å; Y378-W385 HydrophobicContact CD2-CG 4.4Å; Y378-W385 HydrophobicContact CD2-CZ2 4.25Å; Y378-W385 AromaticContact CD2-NE1 3.76Å; Y378-W385 HydrophobicContact CG-CD2 4.42Å; Y378-W385 HydrophobicContact CG-CH2 4.42Å; Y378-W385 HydrophobicContact CG-CZ2 4.12Å; Y378-I588 HydrophobicContact CE1-CD1 4.4Å
379	N	92.9	Very high	89.9	Confident	25 Å²	25	60.7 Å²	60.7	13%	0.134	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.8	171.4	-177.3	-88.3	0	0	0	109.4	D362 L377 Q381 L382 N383 L384	D362-N379 WeakPolarHBondContact OD1-CA 3.23Å; D362-N379 PolarHBondContact OD2-ND2 2.87Å; D362-N379 VanDerWaalsContact OD2-ND2 3.12Å; L377-N379 HydrophobicContact CD2-CB 4.34Å; N379-Q381 VanDerWaalsContact C-N 3.33Å; N379-Q381 PolarHBondContact O-N 3.21Å; N379-Q381 PolarHBondContact OD1-N 2.95Å; N379-L382 HydrophobicContact CB-CB 4.4Å; N379-L382 WeakPolarHBondContact OD1-CB 3.3Å; N379-L382 VanDerWaalsContact OD1-CG 3.32Å; N379-L382 WeakPolarHBondContact OD1-CG 3.42Å; N379-L382 PolarHBondContact OD1-N 3.28Å; N379-N383 WeakPolarHBondContact O-CA 3.45Å; N379-N383 PolarHBondContact O-N 2.95Å; N379-L384 PolarHBondContact N-O 3.5Å; N379-L384 PolarHBondContact O-N 3.35Å
380	S	88.9	Confident	90.8	Very high	14 Å²	14	57.7 Å²	57.7	10%	0.098	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-31.4	-173.8	52.5	0	0	0	0	114.2	N361 D362	N361-S380 PolarHBondContact ND2-OG 3.01Å; N361-S380 WeakPolarHBondContact O-CB 2.93Å; N361-S380 PolarHBondContact O-OG 2.95Å; D362-S380 PolarHBondContact OD1-N 2.93Å; D362-S380 PolarHBondContact OD1-OG 3.37Å
381	Q	87.3	Confident	91.7	Very high	167 Å²	167	51.2 Å²	51.2	78%	0.78	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-42.5	-178.9	-63	-180	-21.2	0	0	111.9	N379	N379-Q381 VanDerWaalsContact C-N 3.33Å; N379-Q381 PolarHBondContact O-N 3.21Å; N379-Q381 PolarHBondContact OD1-N 2.95Å
382	L	90.1	Very high	92.8	Very high	115 Å²	115	51.5 Å²	51.5	60%	0.602	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-15	-179.4	-61.8	176.9	0	0	0	113.2	N379 L384	N379-L382 HydrophobicContact CB-CB 4.4Å; N379-L382 WeakPolarHBondContact OD1-CB 3.3Å; N379-L382 VanDerWaalsContact OD1-CG 3.32Å; N379-L382 WeakPolarHBondContact OD1-CG 3.42Å; N379-L382 PolarHBondContact OD1-N 3.28Å; L382-L384 VanDerWaalsContact C-N 3.32Å; L382-L384 HydrophobicContact CB-CB 4.37Å; L382-L384 HydrophobicContact CB-CD1 4.35Å; L382-L384 HydrophobicContact CB-CG 4.45Å; L382-L384 PolarHBondContact O-N 2.82Å
383	N	91.1	Very high	93.1	Very high	58 Å²	58	54.8 Å²	54.8	31%	0.31	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	47.2	-172.1	-176.1	30	0	0	0	111.9	S344 Y378 N379	S344-N383 WeakPolarHBondContact CB-O 3.21Å; S344-N383 WeakPolarHBondContact CB-OD1 3.33Å; S344-N383 PolarHBondContact N-OD1 2.81Å; S344-N383 PolarHBondContact OG-O 2.89Å; S344-N383 VanDerWaalsContact OG-O 3.1Å; S344-N383 PolarHBondContact OG-OD1 3.16Å; Y378-N383 HydrophobicContact CE2-CB 4.47Å; Y378-N383 WeakPolarHBondContact CE2-OD1 3.41Å; Y378-N383 PolarHBondContact OH-OD1 2.86Å; Y378-N383 VanDerWaalsContact OH-OD1 3.12Å; N379-N383 WeakPolarHBondContact O-CA 3.45Å; N379-N383 PolarHBondContact O-N 2.95Å
384	L	93.6	Very high	93.1	Very high	100 Å²	100	49.2 Å²	49.2	52%	0.524	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147.4	-176.8	-72.5	175.1	0	0	0	111.7	Y378 N379 L382	Y378-L384 WeakPolarHBondContact CA-O 3.34Å; N379-L384 PolarHBondContact N-O 3.5Å; N379-L384 PolarHBondContact O-N 3.35Å; L382-L384 VanDerWaalsContact C-N 3.32Å; L382-L384 HydrophobicContact CB-CB 4.37Å; L382-L384 HydrophobicContact CB-CD1 4.35Å; L382-L384 HydrophobicContact CB-CG 4.45Å; L382-L384 PolarHBondContact O-N 2.82Å
385	W	93.6	Very high	93.1	Very high	28 Å²	28	47.1 Å²	47.1	11%	0.106	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.5	173	-69.5	92.3	0	0	0	111.2	N330 S344 K345 L346 P347 V365 W376 L377 Y378	N330-W385 WeakPolarHBondContact ND2-CZ2 3.34Å; N330-W385 PolarHBondContact ND2-NE1 3.07Å; S344-W385 PolarHBondContact O-NE1 3.02Å; S344-W385 VanDerWaalsContact OG-CD1 3.26Å; S344-W385 PolarHBondContact OG-NE1 3.19Å; K345-W385 VanDerWaalsContact O-CD1 3.32Å; L346-W385 HydrophobicContact CB-CZ2 4.34Å; L346-W385 HydrophobicContact CD1-CD2 3.6Å; L346-W385 HydrophobicContact CD1-CE3 3.52Å; L346-W385 HydrophobicContact CD1-CG 4.42Å; L346-W385 HydrophobicContact CD1-CH2 3.64Å; L346-W385 HydrophobicContact CD1-CZ2 3.71Å; L346-W385 HydrophobicContact CD1-CZ3 3.54Å; P347-W385 VanDerWaalsContact CD-CB 3.46Å; P347-W385 VanDerWaalsContact CD-CG 3.44Å; P347-W385 HydrophobicContact CG-CB 3.68Å; P347-W385 HydrophobicContact CG-CG 4.19Å; V365-W385 HydrophobicContact CB-CZ3 4.2Å; V365-W385 HydrophobicContact CG2-CH2 3.48Å; V365-W385 VanDerWaalsContact CG2-CH2 3.48Å; V365-W385 HydrophobicContact CG2-CZ3 3.57Å; W376-W385 HydrophobicContact CB-CE3 3.77Å; W376-W385 HydrophobicContact CB-CZ3 4.17Å; W376-W385 HydrophobicContact CE3-CB 4.21Å; L377-W385 CarbonylContact O-C 3.57Å; L377-W385 WeakPolarHBondContact O-CA 3.39Å; Y378-W385 VanDerWaalsContact CB-CZ3 3.47Å; Y378-W385 HydrophobicContact CD2-CD2 4.24Å; Y378-W385 AromaticContact CD2-CE2 3.86Å; Y378-W385 HydrophobicContact CD2-CG 4.4Å; Y378-W385 HydrophobicContact CD2-CZ2 4.25Å; Y378-W385 AromaticContact CD2-NE1 3.76Å; Y378-W385 HydrophobicContact CG-CD2 4.42Å; Y378-W385 HydrophobicContact CG-CH2 4.42Å; Y378-W385 HydrophobicContact CG-CZ2 4.12Å
386	I	94.1	Very high	93	Very high	85 Å²	85	48.8 Å²	48.8	44%	0.436	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.6	-178.5	-56.4	173	0	0	0	108	L377	L377-I386 PolarHBondContact N-O 2.77Å; L377-I386 PolarHBondContact O-N 3.14Å
387	K	93.3	Very high	93	Very high	97 Å²	97	51.3 Å²	51.3	42%	0.422	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	124.7	175.4	-164.4	165.1	-174.8	163.8	0	109.4	D374 W376	D374-K387 WeakPolarHBondContact OD1-CE 3.44Å; D374-K387 IonicContact OD1-NZ 2.77Å; D374-K387 PolarHBondContact OD1-NZ 2.91Å; D374-K387 IonicContact OD2-NZ 3.55Å; W376-K387 HydrophobicContact CD2-CB 4.33Å; W376-K387 HydrophobicContact CD2-CG 4.47Å; W376-K387 HydrophobicContact CE3-CB 3.93Å; W376-K387 HydrophobicContact CH2-CB 4.03Å; W376-K387 HydrophobicContact CH2-CD 4.21Å; W376-K387 HydrophobicContact CH2-CG 4.47Å; W376-K387 HydrophobicContact CZ2-CB 4.42Å; W376-K387 HydrophobicContact CZ2-CD 3.99Å; W376-K387 HydrophobicContact CZ2-CG 4.39Å; W376-K387 HydrophobicContact CZ3-CB 3.77Å
388	V	95.7	Very high	93	Very high	19 Å²	19	50.2 Å²	50.2	12%	0.115	26%	0.255	C	S	.	.			trans	-110.1	-175.5	179	-60.3	0	0	0	0	110.4	V375 L377 S390	V375-V388 HydrophobicContact CB-CG2 3.75Å; V375-V388 HydrophobicContact CG1-CG2 3.47Å; V375-V388 VanDerWaalsContact CG1-CG2 3.47Å; V375-V388 PolarHBondContact O-N 3.26Å; L377-V388 HydrophobicContact CB-CG1 3.68Å; L377-V388 HydrophobicContact CB-CG2 4.47Å; L377-V388 HydrophobicContact CD1-CG1 4.31Å; V388-S390 PolarHBondContact O-N 2.86Å
389	A	96.4	Very high	93.1	Very high	25 Å²	25	53.4 Å²	53.4	21%	0.207	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-56.1	130.3	180	0	0	0	0	0	111.8	V375 Y425 N430 W432	V375-A389 WeakPolarHBondContact CG2-O 3.49Å; A389-Y425 HydrophobicContact CB-CE2 4.39Å; A389-N430 WeakPolarHBondContact CB-O 3.38Å; A389-N430 VanDerWaalsContact CB-OD1 3.22Å; A389-N430 WeakPolarHBondContact CB-OD1 3.46Å; A389-N430 PolarHBondContact N-OD1 2.96Å; A389-W432 VanDerWaalsContact O-CD1 3.27Å; A389-W432 PolarHBondContact O-NE1 2.81Å
390	S	95.6	Very high	93.2	Very high	47 Å²	47	52.8 Å²	52.8	33%	0.329	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-65.4	148.6	174.9	-56.9	0	0	0	0	111.8	R373 V388 W432	R373-S390 CarbonylContact O-C 3.58Å; R373-S390 WeakPolarHBondContact O-CA 3.14Å; R373-S390 VanDerWaalsContact O-CB 3.25Å; R373-S390 WeakPolarHBondContact O-CB 3.42Å; V388-S390 PolarHBondContact O-N 2.86Å; S390-W432 VanDerWaalsContact O-CD1 3.24Å
391	L	95.5	Very high	93.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-51.9	151	167.6	-66.2	167.9	0	0	0	110.7	R373 V375 R395 A409 E423 W432	R373-L391 PolarHBondContact NE-O 3.3Å; R373-L391 PolarHBondContact NH2-O 2.91Å; R373-L391 PolarHBondContact O-N 2.92Å; V375-L391 HydrophobicContact CG2-CD2 4.46Å; V375-L391 HydrophobicContact CG2-CG 3.89Å; L391-R395 HydrophobicContact CD1-CG 3.78Å; L391-A409 HydrophobicContact CD2-CB 3.77Å; L391-E423 WeakPolarHBondContact CA-OE2 3.23Å; L391-W432 HydrophobicContact CD2-CD2 3.75Å; L391-W432 HydrophobicContact CD2-CE3 3.82Å; L391-W432 HydrophobicContact CD2-CG 4.47Å; L391-W432 HydrophobicContact CD2-CH2 3.79Å; L391-W432 HydrophobicContact CD2-CZ2 3.72Å; L391-W432 HydrophobicContact CD2-CZ3 3.84Å
392	V	94.1	Very high	94	Very high	67 Å²	67	45 Å²	45	41%	0.406	23%	0.23	S	C	.	.	S	Bend	trans	-63.7	-51.1	170.2	-175.9	0	0	0	0	109.3	R373 E423 W432	R373-V392 PolarHBondContact NE-O 3.46Å; V392-E423 HydrophobicContact CB-CG 4.42Å; V392-E423 HydrophobicContact CG2-CG 4.48Å; V392-E423 PolarHBondContact N-OE2 2.79Å; V392-W432 HydrophobicContact CG2-CB 4.12Å
393	K	90.6	Very high	94.2	Very high	79 Å²	79	39.6 Å²	39.6	34%	0.343	20%	0.202	S	C	.	.	S	Bend	trans	-115.7	128.6	179.2	-165.7	171.2	-176.6	-176.9	0	112	R395 D414 L419 E423	K393-R395 PolarHBondContact O-NE 2.78Å; K393-D414 WeakPolarHBondContact CE-OD2 3.4Å; K393-D414 IonicContact NZ-OD2 3.64Å; K393-D414 PolarHBondContact NZ-OD2 3.21Å; K393-L419 HydrophobicContact CD-CD1 4.38Å; K393-L419 HydrophobicContact CD-CD2 3.92Å; K393-L419 VanDerWaalsContact NZ-CD2 3.25Å; K393-E423 PolarHBondContact N-OE1 2.87Å
394	G	91.6	Very high	94.2	Very high	9 Å²	9	40.6 Å²	40.6	9%	0.093	21%	0.206	C	C	.	.			trans	-69.3	134.3	178.9	0	0	0	0	0	111.6	N371 S372 R373	N371-G394 WeakPolarHBondContact O-CA 3.4Å; S372-G394 VanDerWaalsContact O-CA 3.32Å; S372-G394 WeakPolarHBondContact O-CA 3.46Å; R373-G394 VanDerWaalsContact CG-CA 3.47Å
395	R	92.8	Very high	94.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.187	C	C	.	.			trans	-154	154.9	-168.1	57.3	179.7	79.1	-149.9	10.9	113.4	G367 G368 S372 L391 K393 H398 G411 Y413 L419 S421 E423	G367-R395 WeakPolarHBondContact CA-O 3.47Å; G368-R395 PolarHBondContact N-O 2.91Å; S372-R395 PolarHBondContact O-N 3.03Å; L391-R395 HydrophobicContact CD1-CG 3.78Å; K393-R395 PolarHBondContact O-NE 2.78Å; R395-H398 HydrophobicContact CG-CB 4.23Å; R395-G411 PolarHBondContact NH1-O 3.13Å; R395-Y413 WeakPolarHBondContact CA-O 3.2Å; R395-L419 HydrophobicContact CB-CD1 3.84Å; R395-S421 PolarHBondContact NH1-O 3.09Å; R395-S421 PolarHBondContact NH2-OG 3.02Å; R395-E423 IonicContact CZ-OE1 2.64Å; R395-E423 IonicContact NE-OE1 3.83Å; R395-E423 IonicContact NH2-OE1 3.06Å; R395-E423 PolarHBondContact NH2-OE1 2.75Å
396	W	91.9	Very high	94.1	Very high	35 Å²	35	39.1 Å²	39.1	13%	0.133	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-142.1	160	174	57.6	-48.1	0	0	0	109.6	E353 G368 R369 N371 H398 G412 Y413	E353-W396 HydrophobicContact CB-CE3 4.39Å; E353-W396 WeakPolarHBondContact O-CA 3.2Å; E353-W396 WeakPolarHBondContact OE2-CZ3 3.47Å; G368-W396 VanDerWaalsContact C-CB 3.49Å; R369-W396 HydrophobicContact CB-CD2 4.42Å; R369-W396 HydrophobicContact CB-CE3 3.69Å; R369-W396 HydrophobicContact CB-CZ3 4.08Å; R369-W396 HydrophobicContact CG-CD2 4.46Å; R369-W396 HydrophobicContact CG-CE3 3.64Å; R369-W396 HydrophobicContact CG-CH2 4.17Å; R369-W396 HydrophobicContact CG-CZ3 3.49Å; R369-W396 VanDerWaalsContact CG-CZ3 3.49Å; N371-W396 PolarHBondContact OD1-NE1 2.83Å; W396-H398 PolarHBondContact O-N 2.63Å; W396-H398 VanDerWaalsContact O-N 3.08Å; W396-G412 CarbonylContact O-C 3.52Å; W396-G412 WeakPolarHBondContact O-CA 3.24Å; W396-Y413 AromaticContact CE2-CD1 3.61Å; W396-Y413 AromaticContact CZ2-CD1 3.7Å; W396-Y413 HydrophobicContact CZ2-CD1 3.7Å; W396-Y413 AromaticContact CZ2-CE1 3.97Å; W396-Y413 HydrophobicContact CZ2-CE1 3.97Å; W396-Y413 PolarHBondContact N-O 3.1Å; W396-Y413 VanDerWaalsContact N-O 3.08Å; W396-Y413 AromaticContact NE1-CD1 3.37Å; W396-Y413 PolarHBondContact O-N 2.88Å
397	R	93.3	Very high	94.3	Very high	82 Å²	82	35 Å²	35	31%	0.309	18%	0.179	S	C	.	.	S	Bend	trans	57.1	17.1	-170.6	-56.4	177.4	175.1	-161.2	-15.3	114	E353 S444	E353-R397 HydrophobicContact CB-CG 4Å; E353-R397 HydrophobicContact CG-CG 4.35Å; E353-R397 PolarHBondContact O-N 3.37Å; E353-R397 IonicContact OE1-CZ 3.78Å; E353-R397 IonicContact OE1-NE 2.65Å; E353-R397 PolarHBondContact OE1-NE 3.07Å; E353-R397 VanDerWaalsContact OE1-NE 3.12Å; E353-R397 IonicContact OE1-NH2 3.49Å; E353-R397 PolarHBondContact OE1-NH2 3.22Å; E353-R397 WeakPolarHBondContact OE2-CG 3.28Å; E353-R397 IonicContact OE2-CZ 2.92Å; E353-R397 IonicContact OE2-NE 2.71Å; E353-R397 PolarHBondContact OE2-NE 3.01Å; E353-R397 IonicContact OE2-NH2 3.53Å; E353-R397 PolarHBondContact OE2-NH2 3.36Å; R397-S444 WeakPolarHBondContact O-CA 3.42Å; R397-S444 PolarHBondContact O-N 2.84Å
398	H	95.6	Very high	94.5	Very high	2 Å²	2	31 Å²	31	1%	0.009	16%	0.161	C	C	.	.			trans	-78.5	172	166.8	64	-63.1	0	0	0	109.8	A355 S366 R395 W396 V410 G411	A355-H398 VanDerWaalsContact CB-NE2 3.35Å; A355-H398 WeakPolarHBondContact CB-NE2 3.46Å; S366-H398 PolarHBondContact O-CE1 3.25Å; S366-H398 PolarHBondContact O-NE2 2.68Å; S366-H398 PolarHBondContact OG-NE2 2.94Å; R395-H398 HydrophobicContact CG-CB 4.23Å; W396-H398 PolarHBondContact O-N 2.63Å; W396-H398 VanDerWaalsContact O-N 3.08Å; H398-V410 WeakPolarHBondContact CB-O 3.33Å; H398-G411 WeakPolarHBondContact CB-O 3.46Å
399	K	96.4	Very high	94.6	Very high	68 Å²	68	30.1 Å²	30.1	30%	0.296	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	160.7	166.9	-68.6	-65.8	-174.2	171.6	0	109.9	V410 P445 V447	K399-V410 PolarHBondContact N-O 3.06Å; K399-V410 PolarHBondContact O-N 2.85Å; K399-P445 VanDerWaalsContact CE-O 3.32Å; K399-P445 WeakPolarHBondContact CE-O 3.2Å; K399-P445 HydrophobicContact CG-CG 4.35Å; K399-P445 WeakPolarHBondContact CG-O 3.26Å; K399-V447 HydrophobicContact CB-CB 3.78Å; K399-V447 HydrophobicContact CB-CG2 3.57Å; K399-V447 HydrophobicContact CG-CB 4.45Å; K399-V447 HydrophobicContact CG-CG2 4.17Å
400	M	96.8	Very high	94.7	Very high	12 Å²	12	29 Å²	29	6%	0.059	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.4	167.2	-74	-170.9	-61.1	0	0	109.5	A355 C357 L364 S366 V407 Y408 A409 W432	A355-M400 HydrophobicContact CB-CB 4.19Å; A355-M400 HydrophobicContact CB-CE 4.07Å; A355-M400 HydrophobicContact CB-CG 3.79Å; A355-M400 WeakPolarHBondContact O-CE 3.44Å; C357-M400 HydrophobicContact CB-CB 3.86Å; L364-M400 HydrophobicContact CB-CE 4.21Å; L364-M400 VanDerWaalsContact O-CE 3.29Å; L364-M400 WeakPolarHBondContact O-CE 3.5Å; S366-M400 WeakPolarHBondContact OG-CE 3.49Å; S366-M400 PolarHBondContact OG-SD 3.45Å; M400-V407 HydrophobicContact CB-CG1 4Å; M400-V407 HydrophobicContact CG-CG1 4.06Å; M400-V407 HydrophobicContact SD-CG1 3.65Å; M400-Y408 VanDerWaalsContact CA-O 3.24Å; M400-Y408 WeakPolarHBondContact CA-O 3.49Å; M400-A409 HydrophobicContact CG-CB 4.19Å; M400-W432 HydrophobicContact SD-CH2 4.08Å
401	G	95.8	Very high	94.7	Very high	6 Å²	6	26.7 Å²	26.7	6%	0.062	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149	167.6	0	0	0	0	0	109.8	Y408	G401-Y408 PolarHBondContact N-O 2.93Å; G401-Y408 VanDerWaalsContact N-O 3.08Å; G401-Y408 PolarHBondContact O-N 3.02Å
402	V	95.5	Very high	94.7	Very high	11 Å²	11	26.7 Å²	26.7	7%	0.067	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.8	179.6	-170.8	0	0	0	0	109.2	E295 C357 A358 L359 K406 V407 S449	E295-V402 HydrophobicContact CG-CB 4.47Å; E295-V402 HydrophobicContact CG-CG1 4.15Å; E295-V402 WeakPolarHBondContact OE1-CG1 3.34Å; C357-V402 HydrophobicContact CB-CG2 3.94Å; A358-V402 VanDerWaalsContact O-CG2 3.23Å; A358-V402 WeakPolarHBondContact O-CG2 3.29Å; L359-V402 HydrophobicContact CD1-CG1 3.55Å; V402-K406 CarbonylContact C-O 3.53Å; V402-K406 WeakPolarHBondContact CA-O 3.41Å; V402-K406 WeakPolarHBondContact CG1-O 3.37Å; V402-V407 HydrophobicContact CG2-CG2 4.05Å; V402-S449 WeakPolarHBondContact O-CB 3.39Å; V402-S449 PolarHBondContact O-OG 2.86Å
403	L	94.6	Very high	94.7	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	125.1	-178.9	173.9	65.1	0	0	0	110.2	E295 G405 K406 Y408 G452 L454 Y473 P475	E295-L403 WeakPolarHBondContact OE2-CA 3.41Å; L403-G405 VanDerWaalsContact C-N 3.3Å; L403-G405 PolarHBondContact O-N 3.42Å; L403-K406 PolarHBondContact N-O 2.87Å; L403-K406 PolarHBondContact O-N 3.19Å; L403-K406 VanDerWaalsContact O-N 3.15Å; L403-Y408 HydrophobicContact CB-CD2 4.01Å; L403-Y408 HydrophobicContact CB-CE2 3.77Å; L403-Y408 HydrophobicContact CD2-CE2 4.45Å; L403-Y408 HydrophobicContact CG-CE2 4.39Å; L403-G452 VanDerWaalsContact CD1-C 3.47Å; L403-L454 HydrophobicContact CD2-CB 3.97Å; L403-Y473 HydrophobicContact CD2-CD1 4.41Å; L403-P475 HydrophobicContact CD2-CB 4.38Å; L403-P475 HydrophobicContact CD2-CG 3.98Å
404	L	91.9	Very high	94.7	Very high	78 Å²	78	22.8 Å²	22.8	41%	0.408	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	42.7	177.1	-57.6	179.2	0	0	0	113.3	L292 E295 K406 P475	L292-L404 HydrophobicContact CD2-CD2 4.39Å; E295-L404 PolarHBondContact OE1-N 3.06Å; E295-L404 PolarHBondContact OE2-N 2.82Å; L404-K406 VanDerWaalsContact C-N 3.3Å; L404-K406 PolarHBondContact O-N 2.84Å; L404-P475 HydrophobicContact CD1-CB 4.42Å; L404-P475 HydrophobicContact CD1-CG 3.72Å
405	G	91.1	Very high	94.6	Very high	12 Å²	12	23.9 Å²	23.9	12%	0.124	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	7.5	179.3	0	0	0	0	0	114.9	E295 L403	E295-G405 WeakPolarHBondContact OE1-CA 3.37Å; E295-G405 PolarHBondContact OE1-N 2.81Å; L403-G405 VanDerWaalsContact C-N 3.3Å; L403-G405 PolarHBondContact O-N 3.42Å
406	K	94.4	Very high	94.4	Very high	85 Å²	85	32.2 Å²	32.2	37%	0.37	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.3	-178.7	-61.5	-169.3	-177.9	-173.5	0	111.8	V402 L403 L404 Y408 C424 Y425	V402-K406 CarbonylContact C-O 3.53Å; V402-K406 WeakPolarHBondContact CA-O 3.41Å; V402-K406 WeakPolarHBondContact CG1-O 3.37Å; L403-K406 PolarHBondContact N-O 2.87Å; L403-K406 PolarHBondContact O-N 3.19Å; L403-K406 VanDerWaalsContact O-N 3.15Å; L404-K406 VanDerWaalsContact C-N 3.3Å; L404-K406 PolarHBondContact O-N 2.84Å; K406-Y408 HydrophobicContact CB-CE2 3.96Å; K406-C424 VanDerWaalsContact CD-SG 3.57Å; K406-Y425 WeakPolarHBondContact CB-O 3.41Å
407	V	97.1	Very high	94.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.2	178.6	-176.3	0	0	0	0	109.8	C357 L359 L364 M400 V402 C424 Y425 W432	C357-V407 WeakPolarHBondContact SG-CG1 3.34Å; L359-V407 HydrophobicContact CB-CG2 4.06Å; L359-V407 HydrophobicContact CD1-CG2 4.18Å; L359-V407 HydrophobicContact CD2-CG2 4.05Å; L359-V407 HydrophobicContact CG-CG2 4.32Å; L364-V407 HydrophobicContact CD2-CG2 4.26Å; M400-V407 HydrophobicContact CB-CG1 4Å; M400-V407 HydrophobicContact CG-CG1 4.06Å; M400-V407 HydrophobicContact SD-CG1 3.65Å; V402-V407 HydrophobicContact CG2-CG2 4.05Å; V407-C424 CarbonylContact O-C 3.59Å; V407-C424 WeakPolarHBondContact O-CA 3.23Å; V407-Y425 HydrophobicContact CB-CD1 4.49Å; V407-Y425 HydrophobicContact CG2-CD1 4.4Å; V407-Y425 PolarHBondContact N-O 3.12Å; V407-Y425 PolarHBondContact O-N 3.08Å; V407-W432 HydrophobicContact CB-CH2 4.49Å; V407-W432 HydrophobicContact CG1-CH2 4.18Å
408	Y	98	Very high	94.6	Very high	13 Å²	13	31.4 Å²	31.4	5%	0.051	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.2	178.6	-68.8	-99.8	0	0	0	109.8	M400 G401 L403 K406 V422 E423 C424 V435 L454 Y473	M400-Y408 VanDerWaalsContact CA-O 3.24Å; M400-Y408 WeakPolarHBondContact CA-O 3.49Å; G401-Y408 PolarHBondContact N-O 2.93Å; G401-Y408 VanDerWaalsContact N-O 3.08Å; G401-Y408 PolarHBondContact O-N 3.02Å; L403-Y408 HydrophobicContact CB-CD2 4.01Å; L403-Y408 HydrophobicContact CB-CE2 3.77Å; L403-Y408 HydrophobicContact CD2-CE2 4.45Å; L403-Y408 HydrophobicContact CG-CE2 4.39Å; K406-Y408 HydrophobicContact CB-CE2 3.96Å; Y408-V422 HydrophobicContact CD1-CG1 4.27Å; Y408-E423 CarbonylContact C-O 3.54Å; Y408-E423 VanDerWaalsContact CA-O 3.28Å; Y408-E423 WeakPolarHBondContact CA-O 3.26Å; Y408-C424 HydrophobicContact CD1-CB 3.97Å; Y408-C424 HydrophobicContact CE1-CB 3.75Å; Y408-C424 VanDerWaalsContact CE1-SG 3.55Å; Y408-V435 HydrophobicContact CD1-CG2 4.26Å; Y408-V435 HydrophobicContact CE1-CG1 4.47Å; Y408-V435 HydrophobicContact CE1-CG2 4.27Å; Y408-L454 HydrophobicContact CD1-CD2 4.48Å; Y408-L454 HydrophobicContact CG-CD2 3.98Å; Y408-Y473 HydrophobicContact CD1-CE1 4.41Å; Y408-Y473 HydrophobicContact CE1-CD1 4.41Å; Y408-Y473 AromaticContact CE1-CE1 3.67Å; Y408-Y473 HydrophobicContact CE1-CE1 3.67Å
409	A	97.9	Very high	94.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.8	172	0	0	0	0	0	109.3	L391 M400 V422 E423 W432	L391-A409 HydrophobicContact CD2-CB 3.77Å; M400-A409 HydrophobicContact CG-CB 4.19Å; A409-V422 WeakPolarHBondContact O-CA 3.41Å; A409-E423 PolarHBondContact N-O 2.76Å; A409-E423 PolarHBondContact O-N 3.11Å; A409-W432 HydrophobicContact CB-CE3 4.45Å; A409-W432 HydrophobicContact CB-CH2 3.96Å; A409-W432 HydrophobicContact CB-CZ3 3.6Å
410	V	97.7	Very high	94.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.2	-164.6	-176.5	0	0	0	0	111.7	H398 K399 V422 L438 V447 L454 V456	H398-V410 WeakPolarHBondContact CB-O 3.33Å; K399-V410 PolarHBondContact N-O 3.06Å; K399-V410 PolarHBondContact O-N 2.85Å; V410-V422 HydrophobicContact CG1-CG2 4.13Å; V410-V422 HydrophobicContact CG2-CG1 3.98Å; V410-L438 HydrophobicContact CG1-CD1 3.93Å; V410-L438 HydrophobicContact CG1-CD2 3.95Å; V410-L438 HydrophobicContact CG1-CG 4.3Å; V410-V447 HydrophobicContact CB-CG2 4.32Å; V410-V447 HydrophobicContact CG1-CG2 4.47Å; V410-V447 HydrophobicContact CG2-CG1 4.43Å; V410-L454 HydrophobicContact CG2-CD2 3.77Å; V410-V456 HydrophobicContact CG1-CG1 4.24Å; V410-V456 HydrophobicContact CG1-CG2 3.64Å
411	G	96.3	Very high	94.7	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.			trans	57.7	-140.6	171.5	0	0	0	0	0	113.5	R395 H398 L419 S421	R395-G411 PolarHBondContact NH1-O 3.13Å; H398-G411 WeakPolarHBondContact CB-O 3.46Å; G411-L419 VanDerWaalsContact CA-O 3.26Å; G411-L419 WeakPolarHBondContact CA-O 3.22Å; G411-S421 PolarHBondContact N-O 2.92Å
412	G	95.4	Very high	94.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.			trans	99.5	-159.7	-176.7	0	0	0	0	0	113.1	W396 R418 L419 V442	W396-G412 CarbonylContact O-C 3.52Å; W396-G412 WeakPolarHBondContact O-CA 3.24Å; G412-R418 WeakPolarHBondContact O-CA 3.2Å; G412-L419 PolarHBondContact O-N 2.94Å; G412-V442 PolarHBondContact N-O 2.77Å
413	Y	93.6	Very high	94.9	Very high	46 Å²	46	30.1 Å²	30.1	18%	0.18	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-124.4	144.2	178.3	-171.1	-130.1	0	0	0	108.8	R395 W396 G415 S417 R418	R395-Y413 WeakPolarHBondContact CA-O 3.2Å; W396-Y413 AromaticContact CE2-CD1 3.61Å; W396-Y413 AromaticContact CZ2-CD1 3.7Å; W396-Y413 HydrophobicContact CZ2-CD1 3.7Å; W396-Y413 AromaticContact CZ2-CE1 3.97Å; W396-Y413 HydrophobicContact CZ2-CE1 3.97Å; W396-Y413 PolarHBondContact N-O 3.1Å; W396-Y413 VanDerWaalsContact N-O 3.08Å; W396-Y413 AromaticContact NE1-CD1 3.37Å; W396-Y413 PolarHBondContact O-N 2.88Å; Y413-G415 VanDerWaalsContact OH-C 3.26Å; Y413-G415 PolarHBondContact OH-O 2.99Å; Y413-G415 VanDerWaalsContact OH-O 3.05Å; Y413-S417 VanDerWaalsContact CD2-C 3.44Å; Y413-S417 WeakPolarHBondContact CD2-O 3.32Å; Y413-R418 HydrophobicContact CD2-CG 4.31Å
414	D	92.1	Very high	95.1	Very high	18 Å²	18	30.2 Å²	30.2	10%	0.096	16%	0.164	C	C	.	.			trans	-108.1	19.2	174.5	68.9	4.6	0	0	0	113.1	N371 K393 Q416 S417 L419	N371-D414 VanDerWaalsContact CG-C 3.43Å; N371-D414 VanDerWaalsContact ND2-C 3.33Å; N371-D414 PolarHBondContact ND2-O 2.79Å; N371-D414 PolarHBondContact OD1-O 2.82Å; K393-D414 WeakPolarHBondContact CE-OD2 3.4Å; K393-D414 IonicContact NZ-OD2 3.64Å; K393-D414 PolarHBondContact NZ-OD2 3.21Å; D414-Q416 PolarHBondContact O-N 2.8Å; D414-Q416 PolarHBondContact OD1-N 3.35Å; D414-S417 PolarHBondContact N-O 2.93Å; D414-S417 VanDerWaalsContact N-O 3.12Å; D414-S417 PolarHBondContact OD1-N 2.73Å; D414-S417 VanDerWaalsContact OD1-O 3.09Å; D414-S417 PolarHBondContact OD1-OG 2.84Å; D414-S417 PolarHBondContact OD2-OG 3.41Å; D414-S417 VanDerWaalsContact OD2-OG 3.14Å; D414-L419 HydrophobicContact CB-CD1 4.27Å; D414-L419 HydrophobicContact CB-CD2 3.99Å; D414-L419 HydrophobicContact CB-CG 4.32Å
415	G	88.5	Confident	95.3	Very high	32 Å²	32	26.9 Å²	26.9	33%	0.33	15%	0.146	S	C	.	.	S	Bend	trans	81.1	-10.6	-176.8	0	0	0	0	0	114.5	N371 Y413	N371-G415 PolarHBondContact OD1-N 2.81Å; Y413-G415 VanDerWaalsContact OH-C 3.26Å; Y413-G415 PolarHBondContact OH-O 2.99Å; Y413-G415 VanDerWaalsContact OH-O 3.05Å
416	Q	89.5	Confident	95.5	Very high	174 Å²	174	28.3 Å²	28.3	81%	0.813	15%	0.151	S	C	*	.	S	Bend	trans	-123.5	-40.8	174.3	-60.6	-177.5	-2.8	0	0	112.4	D414	D414-Q416 PolarHBondContact O-N 2.8Å; D414-Q416 PolarHBondContact OD1-N 3.35Å
417	S	92.6	Very high	95.4	Very high	51 Å²	51	26.5 Å²	26.5	36%	0.357	15%	0.149	S	C	.	.	S	Bend	trans	-143.4	153.6	-168.6	68.8	0	0	0	0	112.1	Y413 D414	Y413-S417 VanDerWaalsContact CD2-C 3.44Å; Y413-S417 WeakPolarHBondContact CD2-O 3.32Å; D414-S417 PolarHBondContact N-O 2.93Å; D414-S417 VanDerWaalsContact N-O 3.12Å; D414-S417 PolarHBondContact OD1-N 2.73Å; D414-S417 VanDerWaalsContact OD1-O 3.09Å; D414-S417 PolarHBondContact OD1-OG 2.84Å; D414-S417 PolarHBondContact OD2-OG 3.41Å; D414-S417 VanDerWaalsContact OD2-OG 3.14Å
418	R	95.3	Very high	95.1	Very high	49 Å²	49	35.8 Å²	35.8	19%	0.185	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-79	137.4	173	-78.4	74.4	-172	-174.7	1.6	108.3	G412 Y413 A441 P461 D463	G412-R418 WeakPolarHBondContact O-CA 3.2Å; Y413-R418 HydrophobicContact CD2-CG 4.31Å; R418-A441 HydrophobicContact CB-CB 4.17Å; R418-A441 WeakPolarHBondContact O-CB 3.34Å; R418-P461 WeakPolarHBondContact CB-O 3.39Å; R418-P461 WeakPolarHBondContact CD-O 3.42Å; R418-P461 VanDerWaalsContact CG-O 3.23Å; R418-P461 WeakPolarHBondContact CG-O 3.23Å; R418-D463 IonicContact CZ-OD1 2.82Å; R418-D463 IonicContact CZ-OD2 3.53Å; R418-D463 VanDerWaalsContact CZ-OD2 3.23Å; R418-D463 IonicContact NH1-OD1 2.75Å; R418-D463 IonicContact NH1-OD2 3.97Å; R418-D463 PolarHBondContact NH1-OD2 3.25Å; R418-D463 IonicContact NH2-OD1 3.35Å; R418-D463 PolarHBondContact NH2-OD1 2.95Å; R418-D463 IonicContact NH2-OD2 2.71Å; R418-D463 PolarHBondContact NH2-OD2 2.75Å
419	L	96.2	Very high	94.9	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	21%	0.205	C	C	.	.			trans	-92.7	130.9	-172.3	-61.8	-179.1	0	0	0	111.2	K393 R395 G411 G412 D414 A441 V442	K393-L419 HydrophobicContact CD-CD1 4.38Å; K393-L419 HydrophobicContact CD-CD2 3.92Å; K393-L419 VanDerWaalsContact NZ-CD2 3.25Å; R395-L419 HydrophobicContact CB-CD1 3.84Å; G411-L419 VanDerWaalsContact CA-O 3.26Å; G411-L419 WeakPolarHBondContact CA-O 3.22Å; G412-L419 PolarHBondContact O-N 2.94Å; D414-L419 HydrophobicContact CB-CD1 4.27Å; D414-L419 HydrophobicContact CB-CD2 3.99Å; D414-L419 HydrophobicContact CB-CG 4.32Å; L419-A441 VanDerWaalsContact C-CB 3.48Å; L419-A441 WeakPolarHBondContact O-CA 3.36Å; L419-V442 PolarHBondContact O-N 3.11Å
420	S	97.4	Very high	94.8	Very high	47 Å²	47	41.2 Å²	41.2	33%	0.329	22%	0.223	S	C	.	.			trans	-90.5	-13.5	158.2	55.6	0	0	0	0	112.2	P437 L438	S420-P437 CarbonylContact O-C 3.59Å; S420-P437 VanDerWaalsContact O-CA 3.23Å; S420-P437 WeakPolarHBondContact O-CA 3.22Å; S420-P437 WeakPolarHBondContact O-CB 3.18Å; S420-L438 PolarHBondContact O-N 3.36Å
421	S	97.4	Very high	94.8	Very high	20 Å²	20	49.4 Å²	49.4	14%	0.14	26%	0.255	C	S	.	.			trans	-66.1	134.4	-176.3	61.1	0	0	0	0	112.5	R395 G411	R395-S421 PolarHBondContact NH1-O 3.09Å; R395-S421 PolarHBondContact NH2-OG 3.02Å; G411-S421 PolarHBondContact N-O 2.92Å
422	V	98.1	Very high	94.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129	177.7	-175.8	0	0	0	0	108.5	Y408 A409 V410 V435 L438 W480	Y408-V422 HydrophobicContact CD1-CG1 4.27Å; A409-V422 WeakPolarHBondContact O-CA 3.41Å; V410-V422 HydrophobicContact CG1-CG2 4.13Å; V410-V422 HydrophobicContact CG2-CG1 3.98Å; V422-V435 HydrophobicContact CB-CG2 3.78Å; V422-V435 HydrophobicContact CG1-CG2 3.61Å; V422-V435 PolarHBondContact O-N 2.89Å; V422-L438 HydrophobicContact CG2-CD2 4.21Å; V422-L438 HydrophobicContact CG2-CG 3.93Å; V422-W480 HydrophobicContact CG1-CZ2 4.45Å; V422-W480 HydrophobicContact CG2-CZ2 3.9Å
423	E	97.9	Very high	95	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.5	178.6	-64.7	175.1	-138.4	0	0	110	L391 V392 K393 R395 Y408 A409 W432 T433 E434	L391-E423 WeakPolarHBondContact CA-OE2 3.23Å; V392-E423 HydrophobicContact CB-CG 4.42Å; V392-E423 HydrophobicContact CG2-CG 4.48Å; V392-E423 PolarHBondContact N-OE2 2.79Å; K393-E423 PolarHBondContact N-OE1 2.87Å; R395-E423 IonicContact CZ-OE1 2.64Å; R395-E423 IonicContact NE-OE1 3.83Å; R395-E423 IonicContact NH2-OE1 3.06Å; R395-E423 PolarHBondContact NH2-OE1 2.75Å; Y408-E423 CarbonylContact C-O 3.54Å; Y408-E423 VanDerWaalsContact CA-O 3.28Å; Y408-E423 WeakPolarHBondContact CA-O 3.26Å; A409-E423 PolarHBondContact N-O 2.76Å; A409-E423 PolarHBondContact O-N 3.11Å; E423-W432 HydrophobicContact CB-CE3 3.68Å; E423-W432 HydrophobicContact CB-CZ3 4.3Å; E423-T433 CarbonylContact C-O 3.53Å; E423-T433 WeakPolarHBondContact CA-O 3.09Å; E423-E434 HydrophobicContact CG-CG 4.31Å
424	C	97.8	Very high	95.1	Very high	4 Å²	4	57.8 Å²	57.8	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.4	178.2	-175.1	0	0	0	0	109.8	K406 V407 Y408 W432 T433 V435	K406-C424 VanDerWaalsContact CD-SG 3.57Å; V407-C424 CarbonylContact O-C 3.59Å; V407-C424 WeakPolarHBondContact O-CA 3.23Å; Y408-C424 HydrophobicContact CD1-CB 3.97Å; Y408-C424 HydrophobicContact CE1-CB 3.75Å; Y408-C424 VanDerWaalsContact CE1-SG 3.55Å; C424-W432 CarbonylContact O-C 3.49Å; C424-W432 WeakPolarHBondContact O-CA 3.49Å; C424-T433 PolarHBondContact N-O 2.87Å; C424-T433 PolarHBondContact O-N 3.05Å; C424-T433 PolarHBondContact O-OG1 2.84Å; C424-V435 HydrophobicContact CB-CG1 3.67Å
425	Y	97.6	Very high	95.4	Very high	7 Å²	7	58.2 Å²	58.2	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.9	174.4	-178.3	-116.7	0	0	0	110.8	L364 A389 K406 V407 N430 R431 W432	L364-Y425 HydrophobicContact CD2-CD1 3.9Å; L364-Y425 HydrophobicContact CD2-CE1 3.83Å; A389-Y425 HydrophobicContact CB-CE2 4.39Å; K406-Y425 WeakPolarHBondContact CB-O 3.41Å; V407-Y425 HydrophobicContact CB-CD1 4.49Å; V407-Y425 HydrophobicContact CG2-CD1 4.4Å; V407-Y425 PolarHBondContact N-O 3.12Å; V407-Y425 PolarHBondContact O-N 3.08Å; Y425-N430 PolarHBondContact OH-OD1 3.01Å; Y425-N430 VanDerWaalsContact OH-OD1 3.11Å; Y425-R431 WeakPolarHBondContact CA-O 3.4Å; Y425-W432 AromaticContact CD2-CD1 3.84Å; Y425-W432 HydrophobicContact CD2-CD2 4.04Å; Y425-W432 AromaticContact CD2-CE2 3.69Å; Y425-W432 HydrophobicContact CD2-CG 4.14Å; Y425-W432 HydrophobicContact CD2-CZ2 4.22Å; Y425-W432 AromaticContact CD2-NE1 3.54Å; Y425-W432 HydrophobicContact CG-CD2 4.27Å; Y425-W432 AromaticContact CG-CE2 3.93Å; Y425-W432 HydrophobicContact CG-CH2 4.45Å; Y425-W432 HydrophobicContact CG-CZ2 4.04Å
426	D	94.3	Very high	95.9	Very high	42 Å²	42	57.5 Å²	57.5	23%	0.225	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.9	163.1	171	31.9	0	0	0	109.6	F428 S429 N430 R431	D426-F428 VanDerWaalsContact C-N 3.31Å; D426-F428 PolarHBondContact O-N 3.49Å; D426-F428 WeakPolarHBondContact OD1-CB 3.27Å; D426-F428 PolarHBondContact OD1-N 2.98Å; D426-S429 VanDerWaalsContact OD2-CB 3.23Å; D426-S429 WeakPolarHBondContact OD2-CB 3.33Å; D426-S429 PolarHBondContact OD2-N 3.41Å; D426-S429 PolarHBondContact OD2-OG 2.89Å; D426-N430 VanDerWaalsContact O-CA 3.3Å; D426-N430 WeakPolarHBondContact O-CA 3.28Å; D426-N430 PolarHBondContact O-N 2.89Å; D426-R431 PolarHBondContact N-O 2.88Å; D426-R431 PolarHBondContact O-N 3.24Å
427	S	92.1	Very high	96.3	Very high	47 Å²	47	52.8 Å²	52.8	33%	0.329	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-21.1	179.3	57.3	0	0	0	0	113.3
428	F	90.6	Very high	96.5	Very high	195 Å²	195	50.8 Å²	50.8	86%	0.855	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-47.9	177.4	-179.1	-97.6	0	0	0	111.5	D426	D426-F428 VanDerWaalsContact C-N 3.31Å; D426-F428 PolarHBondContact O-N 3.49Å; D426-F428 WeakPolarHBondContact OD1-CB 3.27Å; D426-F428 PolarHBondContact OD1-N 2.98Å
429	S	94.4	Very high	96.7	Very high	54 Å²	54	54.5 Å²	54.5	38%	0.378	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.4	175.1	63.5	0	0	0	0	114.5	D426	D426-S429 VanDerWaalsContact OD2-CB 3.23Å; D426-S429 WeakPolarHBondContact OD2-CB 3.33Å; D426-S429 PolarHBondContact OD2-N 3.41Å; D426-S429 PolarHBondContact OD2-OG 2.89Å
430	N	96.3	Very high	96.7	Very high	73 Å²	73	56.1 Å²	56.1	39%	0.39	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	56.2	-173.3	-176.3	22.5	0	0	0	111.3	A389 Y425 D426	A389-N430 WeakPolarHBondContact CB-O 3.38Å; A389-N430 VanDerWaalsContact CB-OD1 3.22Å; A389-N430 WeakPolarHBondContact CB-OD1 3.46Å; A389-N430 PolarHBondContact N-OD1 2.96Å; Y425-N430 PolarHBondContact OH-OD1 3.01Å; Y425-N430 VanDerWaalsContact OH-OD1 3.11Å; D426-N430 VanDerWaalsContact O-CA 3.3Å; D426-N430 WeakPolarHBondContact O-CA 3.28Å; D426-N430 PolarHBondContact O-N 2.89Å
431	R	97.2	Very high	96.7	Very high	173 Å²	173	55.2 Å²	55.2	65%	0.653	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.5	-176.5	-72.2	177.5	-173.6	-148.6	-1.4	112	Y425 D426	Y425-R431 WeakPolarHBondContact CA-O 3.4Å; D426-R431 PolarHBondContact N-O 2.88Å; D426-R431 PolarHBondContact O-N 3.24Å
432	W	97.9	Very high	96.7	Very high	20 Å²	20	54.2 Å²	54.2	8%	0.076	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.5	165.5	-66.4	90	0	0	0	110.1	V375 A389 S390 L391 V392 M400 V407 A409 E423 C424 Y425	V375-W432 HydrophobicContact CG1-CZ2 4.17Å; V375-W432 HydrophobicContact CG2-CZ2 3.96Å; A389-W432 VanDerWaalsContact O-CD1 3.27Å; A389-W432 PolarHBondContact O-NE1 2.81Å; S390-W432 VanDerWaalsContact O-CD1 3.24Å; L391-W432 HydrophobicContact CD2-CD2 3.75Å; L391-W432 HydrophobicContact CD2-CE3 3.82Å; L391-W432 HydrophobicContact CD2-CG 4.47Å; L391-W432 HydrophobicContact CD2-CH2 3.79Å; L391-W432 HydrophobicContact CD2-CZ2 3.72Å; L391-W432 HydrophobicContact CD2-CZ3 3.84Å; V392-W432 HydrophobicContact CG2-CB 4.12Å; M400-W432 HydrophobicContact SD-CH2 4.08Å; V407-W432 HydrophobicContact CB-CH2 4.49Å; V407-W432 HydrophobicContact CG1-CH2 4.18Å; A409-W432 HydrophobicContact CB-CE3 4.45Å; A409-W432 HydrophobicContact CB-CH2 3.96Å; A409-W432 HydrophobicContact CB-CZ3 3.6Å; E423-W432 HydrophobicContact CB-CE3 3.68Å; E423-W432 HydrophobicContact CB-CZ3 4.3Å; C424-W432 CarbonylContact O-C 3.49Å; C424-W432 WeakPolarHBondContact O-CA 3.49Å; Y425-W432 AromaticContact CD2-CD1 3.84Å; Y425-W432 HydrophobicContact CD2-CD2 4.04Å; Y425-W432 AromaticContact CD2-CE2 3.69Å; Y425-W432 HydrophobicContact CD2-CG 4.14Å; Y425-W432 HydrophobicContact CD2-CZ2 4.22Å; Y425-W432 AromaticContact CD2-NE1 3.54Å; Y425-W432 HydrophobicContact CG-CD2 4.27Å; Y425-W432 AromaticContact CG-CE2 3.93Å; Y425-W432 HydrophobicContact CG-CH2 4.45Å; Y425-W432 HydrophobicContact CG-CZ2 4.04Å
433	T	97.3	Very high	96.6	Very high	80 Å²	80	54.5 Å²	54.5	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.1	174.9	53.5	0	0	0	0	110.2	E423 C424	E423-T433 CarbonylContact C-O 3.53Å; E423-T433 WeakPolarHBondContact CA-O 3.09Å; C424-T433 PolarHBondContact N-O 2.87Å; C424-T433 PolarHBondContact O-N 3.05Å; C424-T433 PolarHBondContact O-OG1 2.84Å
434	E	97.3	Very high	96.5	Very high	122 Å²	122	55.1 Å²	55.1	57%	0.57	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.9	174	-65.7	-168.9	142.9	0	0	110.6	E423	E423-E434 HydrophobicContact CG-CG 4.31Å
435	V	97.9	Very high	96.5	Very high	26 Å²	26	55 Å²	55	16%	0.158	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-179	171.9	-60.8	0	0	0	0	109.3	Y408 V422 C424 Y473	Y408-V435 HydrophobicContact CD1-CG2 4.26Å; Y408-V435 HydrophobicContact CE1-CG1 4.47Å; Y408-V435 HydrophobicContact CE1-CG2 4.27Å; V422-V435 HydrophobicContact CB-CG2 3.78Å; V422-V435 HydrophobicContact CG1-CG2 3.61Å; V422-V435 PolarHBondContact O-N 2.89Å; C424-V435 HydrophobicContact CB-CG1 3.67Å; V435-Y473 HydrophobicContact CG2-CE2 4.47Å
436	A	98.2	Very high	96.5	Very high	18 Å²	18	54.6 Å²	54.6	15%	0.149	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-54.1	135.2	-177.3	0	0	0	0	0	112	Y473 N478 W480	A436-Y473 HydrophobicContact CB-CE2 4.46Å; A436-N478 WeakPolarHBondContact CB-O 3.49Å; A436-N478 WeakPolarHBondContact CB-OD1 3.47Å; A436-N478 PolarHBondContact N-OD1 2.85Å; A436-W480 PolarHBondContact O-NE1 3.41Å
437	P	98.2	Very high	96.6	Very high	75 Å²	75	53.2 Å²	53.2	49%	0.487	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-73.6	155.6	-179.2	30.9	-35.7	0	0	0	111.5	S420 W480	S420-P437 CarbonylContact O-C 3.59Å; S420-P437 VanDerWaalsContact O-CA 3.23Å; S420-P437 WeakPolarHBondContact O-CA 3.22Å; S420-P437 WeakPolarHBondContact O-CB 3.18Å; P437-W480 PolarHBondContact O-NE1 3.08Å
438	L	98.1	Very high	96.8	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.042	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-54.1	147.3	169.3	-60.7	173.3	0	0	0	111	V410 S420 V422 E440 V442 V456 W480	V410-L438 HydrophobicContact CG1-CD1 3.93Å; V410-L438 HydrophobicContact CG1-CD2 3.95Å; V410-L438 HydrophobicContact CG1-CG 4.3Å; S420-L438 PolarHBondContact O-N 3.36Å; V422-L438 HydrophobicContact CG2-CD2 4.21Å; V422-L438 HydrophobicContact CG2-CG 3.93Å; L438-E440 VanDerWaalsContact C-N 3.26Å; L438-E440 VanDerWaalsContact CB-O 3.28Å; L438-E440 WeakPolarHBondContact CB-O 3.32Å; L438-V442 HydrophobicContact CD1-CG2 4.01Å; L438-V456 HydrophobicContact CD2-CB 4.34Å; L438-V456 HydrophobicContact CD2-CG1 4.35Å; L438-V456 HydrophobicContact CD2-CG2 3.98Å; L438-W480 HydrophobicContact CD2-CD2 3.99Å; L438-W480 HydrophobicContact CD2-CE3 3.93Å; L438-W480 HydrophobicContact CD2-CH2 3.5Å; L438-W480 HydrophobicContact CD2-CZ2 3.55Å; L438-W480 HydrophobicContact CD2-CZ3 3.69Å
439	K	97.6	Very high	97.1	Very high	127 Å²	127	43.7 Å²	43.7	55%	0.552	23%	0.232	S	C	*	.	S	Bend	trans	-67.9	-31	171.1	-64	-170.5	-172.1	-61.4	0	111.9	W480 L482	K439-W480 WeakPolarHBondContact CE-O 3.44Å; K439-W480 HydrophobicContact CG-CB 4.18Å; K439-W480 PolarHBondContact NZ-O 3.43Å; K439-L482 HydrophobicContact CD-CD2 4.06Å; K439-L482 HydrophobicContact CD-CG 3.92Å
440	E	97.3	Very high	97.1	Very high	41 Å²	41	41.4 Å²	41.4	19%	0.192	22%	0.216	C	C	.	.	S	Bend	trans	-129.7	123.2	174.3	-176.8	170.3	-91.7	0	0	109.1	L438 V442 P461 S467 K469 Q471	L438-E440 VanDerWaalsContact C-N 3.26Å; L438-E440 VanDerWaalsContact CB-O 3.28Å; L438-E440 WeakPolarHBondContact CB-O 3.32Å; E440-V442 HydrophobicContact CG-CG1 4.22Å; E440-P461 HydrophobicContact CG-CB 4.14Å; E440-S467 WeakPolarHBondContact OE2-CB 3.41Å; E440-S467 PolarHBondContact OE2-OG 2.91Å; E440-K469 IonicContact OE1-NZ 2.92Å; E440-K469 PolarHBondContact OE1-NZ 3.05Å; E440-K469 IonicContact OE2-NZ 3.12Å; E440-Q471 PolarHBondContact O-NE2 2.79Å
441	A	97.7	Very high	96.8	Very high	27 Å²	27	41.2 Å²	41.2	22%	0.223	22%	0.22	C	C	.	.			trans	-67.1	131.4	173.9	0	0	0	0	0	109.8	R418 L419 P461	R418-A441 HydrophobicContact CB-CB 4.17Å; R418-A441 WeakPolarHBondContact O-CB 3.34Å; L419-A441 VanDerWaalsContact C-CB 3.48Å; L419-A441 WeakPolarHBondContact O-CA 3.36Å; A441-P461 VanDerWaalsContact O-CA 3.23Å; A441-P461 WeakPolarHBondContact O-CA 3.36Å; A441-P461 VanDerWaalsContact O-CB 3.3Å; A441-P461 WeakPolarHBondContact O-CB 3.41Å
442	V	97.4	Very high	96.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.206	C	C	.	.			trans	-142.7	146.8	-176.9	-70.6	0	0	0	0	112.6	G412 L419 L438 E440 P445 V456 P461	G412-V442 PolarHBondContact N-O 2.77Å; L419-V442 PolarHBondContact O-N 3.11Å; L438-V442 HydrophobicContact CD1-CG2 4.01Å; E440-V442 HydrophobicContact CG-CG1 4.22Å; V442-P445 HydrophobicContact CG2-CB 3.91Å; V442-P445 HydrophobicContact CG2-CG 4.11Å; V442-V456 HydrophobicContact CG2-CG1 4.07Å; V442-P461 HydrophobicContact CG1-CB 4.4Å
443	S	96.3	Very high	96.4	Very high	5 Å²	5	36 Å²	36	4%	0.035	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-117.9	147.8	172.6	61.9	0	0	0	0	111.2	G459 G460	S443-G459 CarbonylContact O-C 3.59Å; S443-G459 WeakPolarHBondContact O-CA 3.36Å; S443-G460 PolarHBondContact N-O 3.44Å; S443-G460 PolarHBondContact O-N 2.64Å; S443-G460 PolarHBondContact OG-O 2.9Å
444	S	95.5	Very high	96.5	Very high	14 Å²	14	32.2 Å²	32.2	10%	0.098	19%	0.189	C	C	.	.	S	Bend	trans	48.9	44	-169.4	-56.7	0	0	0	0	115.2	R397 C492	R397-S444 WeakPolarHBondContact O-CA 3.42Å; R397-S444 PolarHBondContact O-N 2.84Å; S444-C492 PolarHBondContact O-N 2.82Å
445	P	97.1	Very high	96.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.163	C	C	.	.			trans	-74	169.6	172.5	36.3	-37.5	0	0	0	111.1	K399 V442 V447 V456	K399-P445 VanDerWaalsContact CE-O 3.32Å; K399-P445 WeakPolarHBondContact CE-O 3.2Å; K399-P445 HydrophobicContact CG-CG 4.35Å; K399-P445 WeakPolarHBondContact CG-O 3.26Å; V442-P445 HydrophobicContact CG2-CB 3.91Å; V442-P445 HydrophobicContact CG2-CG 4.11Å; P445-V447 HydrophobicContact CG-CG2 4.26Å; P445-V456 HydrophobicContact CB-CG1 3.9Å; P445-V456 HydrophobicContact CG-CG1 4.29Å
446	A	97.2	Very high	96.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	143	158.2	0	0	0	0	0	109.8	V456 I457 I493 A495	A446-V456 WeakPolarHBondContact O-CA 3.28Å; A446-I457 HydrophobicContact CB-CB 4.33Å; A446-I457 PolarHBondContact N-O 2.94Å; A446-I457 PolarHBondContact O-N 3.09Å; A446-I493 HydrophobicContact CB-CB 4.28Å; A446-I493 HydrophobicContact CB-CD1 3.86Å; A446-I493 HydrophobicContact CB-CG1 3.82Å; A446-A495 HydrophobicContact CB-CB 3.7Å
447	V	97.6	Very high	96.6	Very high	13 Å²	13	24.6 Å²	24.6	8%	0.079	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133	179	175.8	0	0	0	0	109.8	K399 V410 P445 L454 Y455 V456	K399-V447 HydrophobicContact CB-CB 3.78Å; K399-V447 HydrophobicContact CB-CG2 3.57Å; K399-V447 HydrophobicContact CG-CB 4.45Å; K399-V447 HydrophobicContact CG-CG2 4.17Å; V410-V447 HydrophobicContact CB-CG2 4.32Å; V410-V447 HydrophobicContact CG1-CG2 4.47Å; V410-V447 HydrophobicContact CG2-CG1 4.43Å; P445-V447 HydrophobicContact CG-CG2 4.26Å; V447-L454 HydrophobicContact CG1-CD1 3.77Å; V447-L454 HydrophobicContact CG1-CD2 4.42Å; V447-L454 HydrophobicContact CG1-CG 4.1Å; V447-Y455 VanDerWaalsContact CA-O 3.28Å; V447-Y455 WeakPolarHBondContact CA-O 3.49Å; V447-V456 HydrophobicContact CG2-CB 4.47Å; V447-V456 HydrophobicContact CG2-CG1 4.24Å; V447-V456 HydrophobicContact CG2-CG2 4.08Å
448	A	96.6	Very high	96.5	Very high	7 Å²	7	21.1 Å²	21.1	6%	0.058	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	146.4	175.9	0	0	0	0	0	111	Y455 A495 I502	A448-Y455 PolarHBondContact N-O 2.89Å; A448-Y455 VanDerWaalsContact N-O 3.07Å; A448-Y455 PolarHBondContact O-N 2.96Å; A448-A495 HydrophobicContact CB-CB 3.86Å; A448-I502 HydrophobicContact CB-CG2 3.86Å
449	S	95.3	Very high	96.4	Very high	34 Å²	34	20.8 Å²	20.8	24%	0.238	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.4	172	46.6	0	0	0	0	110.1	V402 K453 S497	V402-S449 WeakPolarHBondContact O-CB 3.39Å; V402-S449 PolarHBondContact O-OG 2.86Å; S449-K453 CarbonylContact C-O 3.59Å; S449-K453 WeakPolarHBondContact CA-O 3.46Å; S449-S497 WeakPolarHBondContact O-CB 3.37Å; S449-S497 PolarHBondContact O-OG 2.83Å
450	C	94.3	Very high	96.4	Very high	7 Å²	7	14.7 Å²	14.7	5%	0.047	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	142.2	-179.2	-165.1	0	0	0	0	110.5	G452 K453 Y455 N500 I502 P517	C450-G452 PolarHBondContact O-N 2.89Å; C450-K453 PolarHBondContact N-O 2.56Å; C450-K453 PolarHBondContact O-N 3.47Å; C450-K453 VanDerWaalsContact O-O 3.13Å; C450-Y455 HydrophobicContact CB-CD2 4.25Å; C450-Y455 HydrophobicContact CB-CE2 4.09Å; C450-N500 VanDerWaalsContact SG-CA 3.59Å; C450-N500 PolarHBondContact SG-O 2.98Å; C450-I502 HydrophobicContact CB-CD1 3.74Å; C450-I502 HydrophobicContact CB-CG1 3.67Å; C450-P517 HydrophobicContact CB-CG 4.28Å
451	S	90.1	Very high	96.3	Very high	69 Å²	69	14.2 Å²	14.2	48%	0.483	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	37.2	175.8	-61.5	0	0	0	0	114.6
452	G	92	Very high	96.1	Very high	33 Å²	33	15.8 Å²	15.8	34%	0.34	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	14.7	179.7	0	0	0	0	0	115.8	L403 C450	L403-G452 VanDerWaalsContact CD1-C 3.47Å; C450-G452 PolarHBondContact O-N 2.89Å
453	K	96.4	Very high	95.7	Very high	51 Å²	51	20.5 Å²	20.5	22%	0.222	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.6	177.3	-57.6	-164.9	-167.3	-142.9	0	111.3	S449 C450 Y455 Y473 D474	S449-K453 CarbonylContact C-O 3.59Å; S449-K453 WeakPolarHBondContact CA-O 3.46Å; C450-K453 PolarHBondContact N-O 2.56Å; C450-K453 PolarHBondContact O-N 3.47Å; C450-K453 VanDerWaalsContact O-O 3.13Å; K453-Y455 HydrophobicContact CB-CE2 3.72Å; K453-Y473 WeakPolarHBondContact CA-O 3.47Å; K453-Y473 VanDerWaalsContact CB-O 3.32Å; K453-Y473 WeakPolarHBondContact CB-O 3.23Å; K453-D474 WeakPolarHBondContact CE-OD2 3.38Å; K453-D474 IonicContact NZ-OD2 2.64Å; K453-D474 PolarHBondContact NZ-OD2 2.79Å
454	L	97.9	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.6	176	-168.2	70.2	0	0	0	109.6	L403 Y408 V410 V447 C472 Y473 W480	L403-L454 HydrophobicContact CD2-CB 3.97Å; Y408-L454 HydrophobicContact CD1-CD2 4.48Å; Y408-L454 HydrophobicContact CG-CD2 3.98Å; V410-L454 HydrophobicContact CG2-CD2 3.77Å; V447-L454 HydrophobicContact CG1-CD1 3.77Å; V447-L454 HydrophobicContact CG1-CD2 4.42Å; V447-L454 HydrophobicContact CG1-CG 4.1Å; L454-C472 CarbonylContact O-C 3.52Å; L454-C472 WeakPolarHBondContact O-CA 3.41Å; L454-Y473 HydrophobicContact CB-CD1 4.42Å; L454-Y473 PolarHBondContact N-O 2.82Å; L454-Y473 PolarHBondContact O-N 2.9Å; L454-W480 HydrophobicContact CD2-CH2 4.42Å
455	Y	98.4	Very high	95.4	Very high	5 Å²	5	31.5 Å²	31.5	2%	0.02	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136	-178.8	-64.4	-100.6	0	0	0	109.9	V447 A448 C450 K453 V470 Q471 C472 R483 I502 Y515 P517	V447-Y455 VanDerWaalsContact CA-O 3.28Å; V447-Y455 WeakPolarHBondContact CA-O 3.49Å; A448-Y455 PolarHBondContact N-O 2.89Å; A448-Y455 VanDerWaalsContact N-O 3.07Å; A448-Y455 PolarHBondContact O-N 2.96Å; C450-Y455 HydrophobicContact CB-CD2 4.25Å; C450-Y455 HydrophobicContact CB-CE2 4.09Å; K453-Y455 HydrophobicContact CB-CE2 3.72Å; Y455-V470 HydrophobicContact CD1-CG1 4.12Å; Y455-Q471 CarbonylContact C-O 3.52Å; Y455-Q471 WeakPolarHBondContact CA-O 3.35Å; Y455-C472 HydrophobicContact CD1-CB 3.97Å; Y455-C472 HydrophobicContact CE1-CB 3.8Å; Y455-C472 WeakPolarHBondContact CE1-SG 3.05Å; Y455-C472 VanDerWaalsContact CZ-SG 3.51Å; Y455-R483 HydrophobicContact CE1-CG 4.39Å; Y455-I502 HydrophobicContact CD1-CD1 4.07Å; Y455-I502 HydrophobicContact CD2-CD1 3.46Å; Y455-I502 VanDerWaalsContact CD2-CD1 3.46Å; Y455-I502 HydrophobicContact CE2-CD1 4.11Å; Y455-I502 HydrophobicContact CG-CD1 3.46Å; Y455-I502 VanDerWaalsContact CG-CD1 3.46Å; Y455-Y515 AromaticContact CD1-CE1 3.96Å; Y455-Y515 HydrophobicContact CD1-CE1 3.96Å; Y455-Y515 AromaticContact CE1-CE1 3.75Å; Y455-Y515 HydrophobicContact CE1-CE1 3.75Å; Y455-P517 HydrophobicContact CE1-CB 4.12Å; Y455-P517 HydrophobicContact CE2-CB 4.36Å; Y455-P517 VanDerWaalsContact OH-CB 3.31Å; Y455-P517 WeakPolarHBondContact OH-CB 3.4Å
456	V	98.5	Very high	95.3	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.3	178.6	-176.4	0	0	0	0	106.7	V410 L438 V442 P445 A446 V447 V470 Q471 W480	V410-V456 HydrophobicContact CG1-CG1 4.24Å; V410-V456 HydrophobicContact CG1-CG2 3.64Å; L438-V456 HydrophobicContact CD2-CB 4.34Å; L438-V456 HydrophobicContact CD2-CG1 4.35Å; L438-V456 HydrophobicContact CD2-CG2 3.98Å; V442-V456 HydrophobicContact CG2-CG1 4.07Å; P445-V456 HydrophobicContact CB-CG1 3.9Å; P445-V456 HydrophobicContact CG-CG1 4.29Å; A446-V456 WeakPolarHBondContact O-CA 3.28Å; V447-V456 HydrophobicContact CG2-CB 4.47Å; V447-V456 HydrophobicContact CG2-CG1 4.24Å; V447-V456 HydrophobicContact CG2-CG2 4.08Å; V456-V470 WeakPolarHBondContact O-CA 3.19Å; V456-Q471 HydrophobicContact CB-CB 4.29Å; V456-Q471 PolarHBondContact N-O 2.87Å; V456-Q471 PolarHBondContact O-N 2.71Å; V456-W480 HydrophobicContact CB-CZ3 4.2Å; V456-W480 HydrophobicContact CG2-CH2 3.44Å; V456-W480 VanDerWaalsContact CG2-CH2 3.44Å; V456-W480 HydrophobicContact CG2-CZ3 3.45Å; V456-W480 VanDerWaalsContact CG2-CZ3 3.45Å
457	I	98.4	Very high	95.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.7	-165.5	-63.2	152.7	0	0	0	107.9	A446 V470 I486 I493 A495 I502 V504 W522	A446-I457 HydrophobicContact CB-CB 4.33Å; A446-I457 PolarHBondContact N-O 2.94Å; A446-I457 PolarHBondContact O-N 3.09Å; I457-V470 HydrophobicContact CG1-CG1 3.95Å; I457-V470 HydrophobicContact CG1-CG2 4.18Å; I457-V470 HydrophobicContact CG2-CG2 4.39Å; I457-I486 HydrophobicContact CG2-CB 4.03Å; I457-I486 HydrophobicContact CG2-CD1 3.79Å; I457-I486 HydrophobicContact CG2-CG1 4.48Å; I457-I486 HydrophobicContact CG2-CG2 3.89Å; I457-I493 HydrophobicContact CG2-CD1 4.08Å; I457-I493 WeakPolarHBondContact O-CD1 3.4Å; I457-A495 HydrophobicContact CD1-CB 4.49Å; I457-I502 HydrophobicContact CD1-CG2 3.96Å; I457-V504 HydrophobicContact CD1-CG2 3.98Å; I457-W522 HydrophobicContact CD1-CH2 4.3Å; I457-W522 HydrophobicContact CG2-CH2 4.1Å; I457-W522 HydrophobicContact CG2-CZ2 4.32Å
458	G	97.3	Very high	95.3	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.021	21%	0.208	C	C	.	.			trans	56.4	-142.2	177.6	0	0	0	0	0	114.4	S467 K469	G458-S467 VanDerWaalsContact CA-O 3.23Å; G458-S467 WeakPolarHBondContact CA-O 3.18Å; G458-K469 PolarHBondContact N-O 3.28Å
459	G	96.4	Very high	95.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.			trans	99.4	178.1	-170.6	0	0	0	0	0	112.9	S443 C466 S467 K490	S443-G459 CarbonylContact O-C 3.59Å; S443-G459 WeakPolarHBondContact O-CA 3.36Å; G459-C466 WeakPolarHBondContact O-CA 3.1Å; G459-S467 PolarHBondContact O-N 2.87Å; G459-K490 PolarHBondContact N-O 2.84Å
460	G	96.4	Very high	95.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-104.6	114.4	174.5	0	0	0	0	0	110.6	S443 D462	S443-G460 PolarHBondContact N-O 3.44Å; S443-G460 PolarHBondContact O-N 2.64Å; S443-G460 PolarHBondContact OG-O 2.9Å; G460-D462 VanDerWaalsContact C-N 3.34Å
461	P	95.9	Very high	95.7	Very high	31 Å²	31	37.1 Å²	37.1	20%	0.201	21%	0.207	C	C	.	.	S	Bend	trans	-74.8	-28.1	173	31.5	-33.3	0	0	0	112	R418 E440 A441 V442 T465	R418-P461 WeakPolarHBondContact CB-O 3.39Å; R418-P461 WeakPolarHBondContact CD-O 3.42Å; R418-P461 VanDerWaalsContact CG-O 3.23Å; R418-P461 WeakPolarHBondContact CG-O 3.23Å; E440-P461 HydrophobicContact CG-CB 4.14Å; A441-P461 VanDerWaalsContact O-CA 3.23Å; A441-P461 WeakPolarHBondContact O-CA 3.36Å; A441-P461 VanDerWaalsContact O-CB 3.3Å; A441-P461 WeakPolarHBondContact O-CB 3.41Å; V442-P461 HydrophobicContact CG1-CB 4.4Å; P461-T465 WeakPolarHBondContact CG-OG1 3.34Å
462	D	92.9	Very high	96.1	Very high	60 Å²	60	34 Å²	34	32%	0.321	19%	0.185	S	C	.	.	S	Bend	trans	-136.8	-166.5	172.5	61.8	68.5	0	0	0	110.5	G460 E464 T465	G460-D462 VanDerWaalsContact C-N 3.34Å; D462-E464 WeakPolarHBondContact OD1-CA 3.24Å; D462-E464 PolarHBondContact OD1-N 2.86Å; D462-T465 VanDerWaalsContact CG-OG1 3.25Å; D462-T465 PolarHBondContact OD1-N 2.88Å; D462-T465 PolarHBondContact OD1-OG1 3.26Å; D462-T465 PolarHBondContact OD2-OG1 3.06Å
463	D	88.9	Confident	96.4	Very high	99 Å²	99	32.7 Å²	32.7	53%	0.529	17%	0.17	S	C	.	.	S	Bend	trans	-83.6	-27.8	-178	-75	-68	0	0	0	113.9	R418 R491	R418-D463 IonicContact CZ-OD1 2.82Å; R418-D463 IonicContact CZ-OD2 3.53Å; R418-D463 VanDerWaalsContact CZ-OD2 3.23Å; R418-D463 IonicContact NH1-OD1 2.75Å; R418-D463 IonicContact NH1-OD2 3.97Å; R418-D463 PolarHBondContact NH1-OD2 3.25Å; R418-D463 IonicContact NH2-OD1 3.35Å; R418-D463 PolarHBondContact NH2-OD1 2.95Å; R418-D463 IonicContact NH2-OD2 2.71Å; R418-D463 PolarHBondContact NH2-OD2 2.75Å; D463-R491 PolarHBondContact O-NH1 3.01Å; D463-R491 PolarHBondContact O-NH2 3.49Å
464	E	90.4	Very high	96.5	Very high	187 Å²	187	31.4 Å²	31.4	87%	0.874	17%	0.166	S	C	*	.	S	Bend	trans	-94.1	-35.9	-172.8	-61.1	-175.3	179.5	0	0	112.2	D462	D462-E464 WeakPolarHBondContact OD1-CA 3.24Å; D462-E464 PolarHBondContact OD1-N 2.86Å
465	T	94.6	Very high	96.4	Very high	63 Å²	63	32.8 Å²	32.8	39%	0.387	18%	0.175	S	C	.	.			trans	-102.4	164.8	-173.5	78	0	0	0	0	113.2	P461 D462	P461-T465 WeakPolarHBondContact CG-OG1 3.34Å; D462-T465 VanDerWaalsContact CG-OG1 3.25Å; D462-T465 PolarHBondContact OD1-N 2.88Å; D462-T465 PolarHBondContact OD1-OG1 3.26Å; D462-T465 PolarHBondContact OD2-OG1 3.06Å
466	C	96.1	Very high	96.2	Very high	41 Å²	41	39 Å²	39	28%	0.277	21%	0.209	S	C	.	.			trans	-130.6	145.6	166.8	-71.7	0	0	0	0	108.4	G459 A489	G459-C466 WeakPolarHBondContact O-CA 3.1Å; C466-A489 HydrophobicContact CB-CB 4.32Å; C466-A489 WeakPolarHBondContact CB-O 3.28Å
467	S	96.8	Very high	96.2	Very high	7 Å²	7	43.5 Å²	43.5	5%	0.049	24%	0.236	C	C	.	.			trans	-88	144.3	176.4	-168.2	0	0	0	0	110.9	E440 G458 G459 K469 A489 K490	E440-S467 WeakPolarHBondContact OE2-CB 3.41Å; E440-S467 PolarHBondContact OE2-OG 2.91Å; G458-S467 VanDerWaalsContact CA-O 3.23Å; G458-S467 WeakPolarHBondContact CA-O 3.18Å; G459-S467 PolarHBondContact O-N 2.87Å; S467-K469 WeakPolarHBondContact OG-CB 3.4Å; S467-K469 PolarHBondContact OG-N 3.28Å; S467-K469 VanDerWaalsContact OG-N 3.13Å; S467-A489 WeakPolarHBondContact O-CA 3.41Å; S467-K490 PolarHBondContact O-N 3.29Å
468	D	97.3	Very high	96.1	Very high	56 Å²	56	47.3 Å²	47.3	30%	0.299	26%	0.256	S	S	.	.			trans	-101.2	-1.3	165.4	67	-24.2	0	0	0	112	N485 I486 A489	D468-N485 HydrophobicContact CB-CB 4.26Å; D468-N485 CarbonylContact O-C 3.59Å; D468-N485 VanDerWaalsContact O-CA 3.23Å; D468-N485 WeakPolarHBondContact O-CA 3.39Å; D468-N485 VanDerWaalsContact O-CB 3.28Å; D468-N485 WeakPolarHBondContact O-CB 3.45Å; D468-N485 PolarHBondContact OD1-ND2 3.19Å; D468-N485 PolarHBondContact OD2-ND2 3.07Å; D468-I486 VanDerWaalsContact O-CG2 3.27Å; D468-I486 WeakPolarHBondContact O-CG2 3.41Å; D468-I486 PolarHBondContact O-N 2.75Å; D468-A489 HydrophobicContact CB-CB 4.12Å
469	K	98.2	Very high	96.1	Very high	72 Å²	72	49 Å²	49	31%	0.313	27%	0.27	S	S	.	.			trans	-72.9	146.5	-172.5	-62.5	176.3	-169.9	160	0	111.6	E440 G458 S467	E440-K469 IonicContact OE1-NZ 2.92Å; E440-K469 PolarHBondContact OE1-NZ 3.05Å; E440-K469 IonicContact OE2-NZ 3.12Å; G458-K469 PolarHBondContact N-O 3.28Å; S467-K469 WeakPolarHBondContact OG-CB 3.4Å; S467-K469 PolarHBondContact OG-N 3.28Å; S467-K469 VanDerWaalsContact OG-N 3.13Å
470	V	98.5	Very high	96.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.1	170	-177.8	0	0	0	0	108.2	Y455 V456 I457 L482 R483 A484 I486 W522	Y455-V470 HydrophobicContact CD1-CG1 4.12Å; V456-V470 WeakPolarHBondContact O-CA 3.19Å; I457-V470 HydrophobicContact CG1-CG1 3.95Å; I457-V470 HydrophobicContact CG1-CG2 4.18Å; I457-V470 HydrophobicContact CG2-CG2 4.39Å; V470-L482 WeakPolarHBondContact O-CA 3.29Å; V470-R483 HydrophobicContact CB-CB 3.88Å; V470-R483 HydrophobicContact CG1-CB 3.77Å; V470-R483 HydrophobicContact CG1-CG 4.46Å; V470-R483 PolarHBondContact O-N 2.87Å; V470-A484 WeakPolarHBondContact CG2-O 3.34Å; V470-I486 HydrophobicContact CG2-CB 4.49Å; V470-W522 HydrophobicContact CG2-CZ2 3.77Å
471	Q	98.5	Very high	96.3	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.009	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.1	178.4	-47.3	-175.2	67	0	0	108.5	E440 Y455 V456 W480 L482	E440-Q471 PolarHBondContact O-NE2 2.79Å; Y455-Q471 CarbonylContact C-O 3.52Å; Y455-Q471 WeakPolarHBondContact CA-O 3.35Å; V456-Q471 HydrophobicContact CB-CB 4.29Å; V456-Q471 PolarHBondContact N-O 2.87Å; V456-Q471 PolarHBondContact O-N 2.71Å; Q471-W480 HydrophobicContact CB-CE3 3.72Å; Q471-W480 HydrophobicContact CB-CZ3 4.08Å; Q471-W480 WeakPolarHBondContact O-CZ3 3.48Å; Q471-L482 HydrophobicContact CG-CD2 4.12Å
472	C	98.4	Very high	96.4	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	119	-176.2	177.2	0	0	0	0	110.1	L454 Y455 W480 L481 R483	L454-C472 CarbonylContact O-C 3.52Å; L454-C472 WeakPolarHBondContact O-CA 3.41Å; Y455-C472 HydrophobicContact CD1-CB 3.97Å; Y455-C472 HydrophobicContact CE1-CB 3.8Å; Y455-C472 WeakPolarHBondContact CE1-SG 3.05Å; Y455-C472 VanDerWaalsContact CZ-SG 3.51Å; C472-W480 CarbonylContact O-C 3.38Å; C472-W480 VanDerWaalsContact O-CA 3.32Å; C472-W480 WeakPolarHBondContact O-CA 3.38Å; C472-L481 PolarHBondContact N-O 2.84Å; C472-L481 PolarHBondContact O-N 3.12Å; C472-R483 HydrophobicContact CB-CG 3.63Å
473	Y	98.6	Very high	96.7	Very high	6 Å²	6	57 Å²	57	2%	0.024	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.4	177.1	177.6	-109.5	0	0	0	111.5	L403 Y408 V435 A436 K453 L454 P475 N478 A479 W480	L403-Y473 HydrophobicContact CD2-CD1 4.41Å; Y408-Y473 HydrophobicContact CD1-CE1 4.41Å; Y408-Y473 HydrophobicContact CE1-CD1 4.41Å; Y408-Y473 AromaticContact CE1-CE1 3.67Å; Y408-Y473 HydrophobicContact CE1-CE1 3.67Å; V435-Y473 HydrophobicContact CG2-CE2 4.47Å; A436-Y473 HydrophobicContact CB-CE2 4.46Å; K453-Y473 WeakPolarHBondContact CA-O 3.47Å; K453-Y473 VanDerWaalsContact CB-O 3.32Å; K453-Y473 WeakPolarHBondContact CB-O 3.23Å; L454-Y473 HydrophobicContact CB-CD1 4.42Å; L454-Y473 PolarHBondContact N-O 2.82Å; L454-Y473 PolarHBondContact O-N 2.9Å; Y473-P475 HydrophobicContact CE1-CB 3.87Å; Y473-N478 PolarHBondContact OH-OD1 2.8Å; Y473-A479 WeakPolarHBondContact CA-O 3.37Å; Y473-W480 HydrophobicContact CD2-CD2 4.14Å; Y473-W480 AromaticContact CD2-CE2 3.64Å; Y473-W480 HydrophobicContact CD2-CG 4.34Å; Y473-W480 AromaticContact CD2-CZ2 3.99Å; Y473-W480 HydrophobicContact CD2-CZ2 3.99Å; Y473-W480 AromaticContact CD2-NE1 3.57Å; Y473-W480 HydrophobicContact CG-CD2 4.41Å; Y473-W480 AromaticContact CG-CE2 3.99Å; Y473-W480 HydrophobicContact CG-CH2 4.33Å; Y473-W480 AromaticContact CG-CZ2 3.94Å; Y473-W480 HydrophobicContact CG-CZ2 3.94Å
474	D	97.4	Very high	97.1	Very high	24 Å²	24	54 Å²	54	13%	0.128	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.4	169.6	-166.2	-43.8	0	0	0	109.9	K453 N476 T477 N478 A479	K453-D474 WeakPolarHBondContact CE-OD2 3.38Å; K453-D474 IonicContact NZ-OD2 2.64Å; K453-D474 PolarHBondContact NZ-OD2 2.79Å; D474-N476 PolarHBondContact O-N 3.46Å; D474-N476 WeakPolarHBondContact OD1-CB 3.2Å; D474-N476 PolarHBondContact OD1-N 3.1Å; D474-N476 PolarHBondContact OD1-ND2 2.7Å; D474-T477 PolarHBondContact O-N 2.89Å; D474-N478 WeakPolarHBondContact O-CA 3.48Å; D474-N478 PolarHBondContact O-N 2.94Å; D474-A479 PolarHBondContact N-O 3.04Å; D474-A479 PolarHBondContact O-N 2.99Å
475	P	95.8	Very high	97.5	Very high	29 Å²	29	48.6 Å²	48.6	19%	0.188	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.2	-177.5	29.3	-35.9	0	0	0	113.3	L403 L404 Y473	L403-P475 HydrophobicContact CD2-CB 4.38Å; L403-P475 HydrophobicContact CD2-CG 3.98Å; L404-P475 HydrophobicContact CD1-CB 4.42Å; L404-P475 HydrophobicContact CD1-CG 3.72Å; Y473-P475 HydrophobicContact CE1-CB 3.87Å
476	N	95.8	Very high	97.5	Very high	137 Å²	137	45.7 Å²	45.7	73%	0.733	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-33.7	-178.9	-51.9	-76	0	0	0	111.9	D474	D474-N476 PolarHBondContact O-N 3.46Å; D474-N476 WeakPolarHBondContact OD1-CB 3.2Å; D474-N476 PolarHBondContact OD1-N 3.1Å; D474-N476 PolarHBondContact OD1-ND2 2.7Å
477	T	96.9	Very high	97.5	Very high	95 Å²	95	47.4 Å²	47.4	58%	0.583	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-8	178.4	61.4	0	0	0	0	112.8	D474 A479	D474-T477 PolarHBondContact O-N 2.89Å; T477-A479 VanDerWaalsContact C-N 3.27Å; T477-A479 PolarHBondContact O-N 3.34Å
478	N	97.4	Very high	97.3	Very high	80 Å²	80	48.3 Å²	48.3	43%	0.428	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	51.4	-171.5	-175.2	26.2	0	0	0	110.8	A436 Y473 D474	A436-N478 WeakPolarHBondContact CB-O 3.49Å; A436-N478 WeakPolarHBondContact CB-OD1 3.47Å; A436-N478 PolarHBondContact N-OD1 2.85Å; Y473-N478 PolarHBondContact OH-OD1 2.8Å; D474-N478 WeakPolarHBondContact O-CA 3.48Å; D474-N478 PolarHBondContact O-N 2.94Å
479	A	97.9	Very high	97.2	Very high	37 Å²	37	48.1 Å²	48.1	31%	0.306	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.8	-174.5	0	0	0	0	0	112.3	Y473 D474 T477	Y473-A479 WeakPolarHBondContact CA-O 3.37Å; D474-A479 PolarHBondContact N-O 3.04Å; D474-A479 PolarHBondContact O-N 2.99Å; T477-A479 VanDerWaalsContact C-N 3.27Å; T477-A479 PolarHBondContact O-N 3.34Å
480	W	98.4	Very high	97.1	Very high	8 Å²	8	48.2 Å²	48.2	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	142.1	173.4	-65.6	86.6	0	0	0	111.1	V422 A436 P437 L438 K439 L454 V456 Q471 C472 Y473	V422-W480 HydrophobicContact CG1-CZ2 4.45Å; V422-W480 HydrophobicContact CG2-CZ2 3.9Å; A436-W480 PolarHBondContact O-NE1 3.41Å; P437-W480 PolarHBondContact O-NE1 3.08Å; L438-W480 HydrophobicContact CD2-CD2 3.99Å; L438-W480 HydrophobicContact CD2-CE3 3.93Å; L438-W480 HydrophobicContact CD2-CH2 3.5Å; L438-W480 HydrophobicContact CD2-CZ2 3.55Å; L438-W480 HydrophobicContact CD2-CZ3 3.69Å; K439-W480 WeakPolarHBondContact CE-O 3.44Å; K439-W480 HydrophobicContact CG-CB 4.18Å; K439-W480 PolarHBondContact NZ-O 3.43Å; L454-W480 HydrophobicContact CD2-CH2 4.42Å; V456-W480 HydrophobicContact CB-CZ3 4.2Å; V456-W480 HydrophobicContact CG2-CH2 3.44Å; V456-W480 VanDerWaalsContact CG2-CH2 3.44Å; V456-W480 HydrophobicContact CG2-CZ3 3.45Å; V456-W480 VanDerWaalsContact CG2-CZ3 3.45Å; Q471-W480 HydrophobicContact CB-CE3 3.72Å; Q471-W480 HydrophobicContact CB-CZ3 4.08Å; Q471-W480 WeakPolarHBondContact O-CZ3 3.48Å; C472-W480 CarbonylContact O-C 3.38Å; C472-W480 VanDerWaalsContact O-CA 3.32Å; C472-W480 WeakPolarHBondContact O-CA 3.38Å; Y473-W480 HydrophobicContact CD2-CD2 4.14Å; Y473-W480 AromaticContact CD2-CE2 3.64Å; Y473-W480 HydrophobicContact CD2-CG 4.34Å; Y473-W480 AromaticContact CD2-CZ2 3.99Å; Y473-W480 HydrophobicContact CD2-CZ2 3.99Å; Y473-W480 AromaticContact CD2-NE1 3.57Å; Y473-W480 HydrophobicContact CG-CD2 4.41Å; Y473-W480 AromaticContact CG-CE2 3.99Å; Y473-W480 HydrophobicContact CG-CH2 4.33Å; Y473-W480 AromaticContact CG-CZ2 3.94Å; Y473-W480 HydrophobicContact CG-CZ2 3.94Å
481	L	97.9	Very high	96.8	Very high	91 Å²	91	52.6 Å²	52.6	48%	0.476	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	154.2	170.1	-64.5	176.5	0	0	0	109.7	C472	C472-L481 PolarHBondContact N-O 2.84Å; C472-L481 PolarHBondContact O-N 3.12Å
482	L	98.3	Very high	96.6	Very high	92 Å²	92	53.4 Å²	53.4	48%	0.482	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	149.6	168.4	-64.6	179.1	0	0	0	109.7	K439 V470 Q471	K439-L482 HydrophobicContact CD-CD2 4.06Å; K439-L482 HydrophobicContact CD-CG 3.92Å; V470-L482 WeakPolarHBondContact O-CA 3.29Å; Q471-L482 HydrophobicContact CG-CD2 4.12Å
483	R	98.3	Very high	96.4	Very high	68 Å²	68	53.3 Å²	53.3	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	174.4	179.7	-71.7	-62.6	-176.3	-179	4.8	110.1	Y455 V470 C472 N485 Y515 D520	Y455-R483 HydrophobicContact CE1-CG 4.39Å; V470-R483 HydrophobicContact CB-CB 3.88Å; V470-R483 HydrophobicContact CG1-CB 3.77Å; V470-R483 HydrophobicContact CG1-CG 4.46Å; V470-R483 PolarHBondContact O-N 2.87Å; C472-R483 HydrophobicContact CB-CG 3.63Å; R483-N485 PolarHBondContact O-N 2.85Å; R483-Y515 WeakPolarHBondContact CB-OH 3.26Å; R483-Y515 WeakPolarHBondContact CD-OH 3.42Å; R483-D520 WeakPolarHBondContact CB-OD1 3.48Å; R483-D520 WeakPolarHBondContact CD-OD1 3.4Å; R483-D520 WeakPolarHBondContact CD-OD2 3.17Å; R483-D520 IonicContact CZ-OD2 2.75Å; R483-D520 IonicContact NE-OD2 2.68Å; R483-D520 IonicContact NH1-OD2 3.08Å; R483-D520 PolarHBondContact NH1-OD2 3.37Å
484	A	97.8	Very high	96.3	Very high	36 Å²	36	53.7 Å²	53.7	30%	0.298	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-54.1	125	177.6	0	0	0	0	0	110.9	V470 Y515 D520 W522	V470-A484 WeakPolarHBondContact CG2-O 3.34Å; A484-Y515 HydrophobicContact CB-CE2 4.47Å; A484-D520 WeakPolarHBondContact CB-O 3.41Å; A484-D520 WeakPolarHBondContact CB-OD1 3.31Å; A484-D520 PolarHBondContact N-OD1 3.11Å; A484-W522 PolarHBondContact O-NE1 2.89Å
485	N	98.1	Very high	96.2	Very high	73 Å²	73	53.1 Å²	53.1	39%	0.39	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-58.6	143.2	-177.4	-69.7	5	0	0	0	111.1	D468 R483 W522	D468-N485 HydrophobicContact CB-CB 4.26Å; D468-N485 CarbonylContact O-C 3.59Å; D468-N485 VanDerWaalsContact O-CA 3.23Å; D468-N485 WeakPolarHBondContact O-CA 3.39Å; D468-N485 VanDerWaalsContact O-CB 3.28Å; D468-N485 WeakPolarHBondContact O-CB 3.45Å; D468-N485 PolarHBondContact OD1-ND2 3.19Å; D468-N485 PolarHBondContact OD2-ND2 3.07Å; R483-N485 PolarHBondContact O-N 2.85Å; N485-W522 PolarHBondContact O-NE1 3.09Å
486	I	96.4	Very high	96.2	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-65.6	139.1	172.3	-179.2	170.6	0	0	0	108.7	I457 D468 V470 I488 V504 W522	I457-I486 HydrophobicContact CG2-CB 4.03Å; I457-I486 HydrophobicContact CG2-CD1 3.79Å; I457-I486 HydrophobicContact CG2-CG1 4.48Å; I457-I486 HydrophobicContact CG2-CG2 3.89Å; D468-I486 VanDerWaalsContact O-CG2 3.27Å; D468-I486 WeakPolarHBondContact O-CG2 3.41Å; D468-I486 PolarHBondContact O-N 2.75Å; V470-I486 HydrophobicContact CG2-CB 4.49Å; I486-I488 HydrophobicContact CD1-CD1 4.2Å; I486-I488 HydrophobicContact CD1-CG1 3.75Å; I486-I488 HydrophobicContact CG1-CG1 3.78Å; I486-I488 WeakPolarHBondContact CG2-O 3.29Å; I486-I488 PolarHBondContact O-N 3.06Å; I486-V504 HydrophobicContact CD1-CB 4.23Å; I486-V504 HydrophobicContact CD1-CG1 3.79Å; I486-W522 HydrophobicContact CB-CD2 4.46Å; I486-W522 HydrophobicContact CB-CH2 3.91Å; I486-W522 HydrophobicContact CB-CZ2 3.58Å; I486-W522 HydrophobicContact CB-CZ3 4.48Å; I486-W522 HydrophobicContact CD1-CH2 3.77Å; I486-W522 HydrophobicContact CD1-CZ2 4.36Å; I486-W522 HydrophobicContact CD1-CZ3 3.94Å; I486-W522 HydrophobicContact CG1-CD2 4.38Å; I486-W522 HydrophobicContact CG1-CE3 4.23Å; I486-W522 HydrophobicContact CG1-CH2 3.8Å; I486-W522 HydrophobicContact CG1-CZ2 3.97Å; I486-W522 HydrophobicContact CG1-CZ3 3.94Å
487	P	95.1	Very high	96.1	Very high	78 Å²	78	47.5 Å²	47.5	51%	0.506	27%	0.269	S	S	.	.	S	Bend	trans	-63.7	5.6	-179	-25.5	35.7	0	0	0	116.2	Y513 W522	P487-Y513 HydrophobicContact CB-CE1 3.9Å; P487-Y513 HydrophobicContact CG-CD1 4.23Å; P487-Y513 HydrophobicContact CG-CE1 3.96Å; P487-W522 HydrophobicContact CG-CB 3.83Å; P487-W522 HydrophobicContact CG-CG 4.18Å
488	I	92.8	Very high	95.9	Very high	25 Å²	25	43.2 Å²	43.2	13%	0.128	24%	0.242	C	C	.	.	S	Bend	trans	-138.8	122.8	179	50	160.1	0	0	0	111.2	I486 K490 T509 Y513	I486-I488 HydrophobicContact CD1-CD1 4.2Å; I486-I488 HydrophobicContact CD1-CG1 3.75Å; I486-I488 HydrophobicContact CG1-CG1 3.78Å; I486-I488 WeakPolarHBondContact CG2-O 3.29Å; I486-I488 PolarHBondContact O-N 3.06Å; I488-K490 HydrophobicContact CB-CG 4.22Å; I488-K490 HydrophobicContact CD1-CB 4.47Å; I488-K490 HydrophobicContact CD1-CG 4.18Å; I488-K490 PolarHBondContact O-N 2.79Å; I488-T509 HydrophobicContact CD1-CG2 3.89Å; I488-Y513 HydrophobicContact CB-CE2 4.44Å; I488-Y513 HydrophobicContact CD1-CD2 3.96Å; I488-Y513 HydrophobicContact CD1-CE2 3.7Å; I488-Y513 HydrophobicContact CG1-CD2 4.11Å; I488-Y513 HydrophobicContact CG1-CE2 3.72Å; I488-Y513 HydrophobicContact CG2-CE2 3.84Å
489	A	95.1	Very high	95.5	Very high	53 Å²	53	44.2 Å²	44.2	44%	0.438	25%	0.247	S	C	.	.			trans	-79.9	99.1	169.6	0	0	0	0	0	110	C466 S467 D468	C466-A489 HydrophobicContact CB-CB 4.32Å; C466-A489 WeakPolarHBondContact CB-O 3.28Å; S467-A489 WeakPolarHBondContact O-CA 3.41Å; D468-A489 HydrophobicContact CB-CB 4.12Å
490	K	95.1	Very high	95.2	Very high	73 Å²	73	47.7 Å²	47.7	32%	0.317	26%	0.261	S	S	.	.			trans	-144.9	147.2	-174.9	-72	-63.6	-171.1	157.4	0	114.2	G459 S467 I488 I493 G507 T509	G459-K490 PolarHBondContact N-O 2.84Å; S467-K490 PolarHBondContact O-N 3.29Å; I488-K490 HydrophobicContact CB-CG 4.22Å; I488-K490 HydrophobicContact CD1-CB 4.47Å; I488-K490 HydrophobicContact CD1-CG 4.18Å; I488-K490 PolarHBondContact O-N 2.79Å; K490-I493 HydrophobicContact CB-CG2 3.93Å; K490-G507 VanDerWaalsContact CD-O 3.28Å; K490-G507 WeakPolarHBondContact CD-O 3.27Å; K490-G507 VanDerWaalsContact CE-O 3.28Å; K490-G507 WeakPolarHBondContact CE-O 3.37Å; K490-G507 PolarHBondContact NZ-O 3.44Å; K490-G507 VanDerWaalsContact NZ-O 3.09Å; K490-T509 HydrophobicContact CD-CG2 4.49Å; K490-T509 HydrophobicContact CG-CG2 4.07Å
491	R	94	Very high	95	Very high	92 Å²	92	49 Å²	49	35%	0.347	27%	0.268	S	S	.	.	S	Bend	trans	-101.2	169.3	164	65.6	-170.8	169.9	-151.3	0.4	111.1	D463 I493 G507	D463-R491 PolarHBondContact O-NH1 3.01Å; D463-R491 PolarHBondContact O-NH2 3.49Å; R491-I493 PolarHBondContact O-N 3.45Å; R491-G507 VanDerWaalsContact O-CA 3.28Å; R491-G507 WeakPolarHBondContact O-CA 3.39Å
492	C	93.6	Very high	95	Very high	19 Å²	19	44.7 Å²	44.7	13%	0.128	25%	0.245	C	C	.	.	S	Bend	trans	59.7	30.2	-179.7	-55.6	0	0	0	0	113.4	S444 G507 E533 S534	S444-C492 PolarHBondContact O-N 2.82Å; C492-G507 PolarHBondContact O-N 3.13Å; C492-E533 HydrophobicContact CB-CB 3.94Å; C492-E533 HydrophobicContact CB-CG 4.43Å; C492-S534 PolarHBondContact O-N 2.88Å
493	I	94.6	Very high	95	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	162.3	168.8	48.2	165.1	0	0	0	110.6	A446 I457 K490 R491 V504 C505	A446-I493 HydrophobicContact CB-CB 4.28Å; A446-I493 HydrophobicContact CB-CD1 3.86Å; A446-I493 HydrophobicContact CB-CG1 3.82Å; I457-I493 HydrophobicContact CG2-CD1 4.08Å; I457-I493 WeakPolarHBondContact O-CD1 3.4Å; K490-I493 HydrophobicContact CB-CG2 3.93Å; R491-I493 PolarHBondContact O-N 3.45Å; I493-V504 HydrophobicContact CB-CG1 4.31Å; I493-V504 HydrophobicContact CD1-CG1 4.13Å; I493-C505 CarbonylContact C-O 3.55Å; I493-C505 WeakPolarHBondContact CA-O 3.39Å
494	T	95.1	Very high	94.9	Very high	14 Å²	14	38 Å²	38	9%	0.086	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.7	178.7	-174.1	0	0	0	0	109.8	V504 C505 M537	T494-V504 WeakPolarHBondContact O-CA 3.36Å; T494-C505 PolarHBondContact N-O 2.86Å; T494-C505 PolarHBondContact O-N 3.01Å; T494-C505 VanDerWaalsContact O-N 3.1Å; T494-M537 HydrophobicContact CG2-CB 3.61Å; T494-M537 HydrophobicContact CG2-CE 3.93Å; T494-M537 HydrophobicContact CG2-SD 4.19Å; T494-M537 VanDerWaalsContact O-CE 3.24Å; T494-M537 WeakPolarHBondContact O-CE 3.48Å
495	A	96.1	Very high	94.7	Very high	11 Å²	11	36.3 Å²	36.3	9%	0.091	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147	-179	0	0	0	0	0	111.5	A446 A448 I457 I502 Y503 V504 M537	A446-A495 HydrophobicContact CB-CB 3.7Å; A448-A495 HydrophobicContact CB-CB 3.86Å; I457-A495 HydrophobicContact CD1-CB 4.49Å; A495-I502 HydrophobicContact CB-CG2 4.06Å; A495-Y503 CarbonylContact C-O 3.59Å; A495-Y503 WeakPolarHBondContact CA-O 3.46Å; A495-V504 HydrophobicContact CB-CG2 4Å; A495-M537 VanDerWaalsContact CA-CE 3.41Å
496	V	95.8	Very high	94.5	Very high	16 Å²	16	32.8 Å²	32.8	10%	0.097	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.2	170	-57.2	0	0	0	0	110	I502 Y503 M537 V539 V544	V496-I502 WeakPolarHBondContact O-CA 3.37Å; V496-Y503 PolarHBondContact N-O 3.32Å; V496-Y503 PolarHBondContact O-N 3.08Å; V496-M537 HydrophobicContact CB-CE 4.36Å; V496-M537 HydrophobicContact CG1-CB 3.92Å; V496-M537 HydrophobicContact CG1-CE 4.03Å; V496-M537 HydrophobicContact CG1-CG 3.72Å; V496-M537 VanDerWaalsContact CG1-O 3.32Å; V496-M537 WeakPolarHBondContact CG1-O 3.45Å; V496-M537 HydrophobicContact CG2-CE 4.03Å; V496-M537 HydrophobicContact CG2-CG 4.14Å; V496-M537 HydrophobicContact CG2-SD 4.44Å; V496-V539 HydrophobicContact CB-CG2 3.85Å; V496-V539 HydrophobicContact CG2-CG2 3.55Å; V496-V544 HydrophobicContact CG2-CG1 3.83Å; V496-V544 HydrophobicContact CG2-CG2 4.02Å
497	S	94.4	Very high	94.2	Very high	33 Å²	33	32.9 Å²	32.9	23%	0.231	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.1	177	-63.7	0	0	0	0	111.4	S449 M501	S449-S497 WeakPolarHBondContact O-CB 3.37Å; S449-S497 PolarHBondContact O-OG 2.83Å; S497-M501 VanDerWaalsContact CA-O 3.29Å; S497-M501 WeakPolarHBondContact CA-O 3.37Å
498	L	92.7	Very high	94	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	132.5	-180	171	58.6	0	0	0	108.3	N500 M501 Y503 V539 G542 V544 P565	L498-N500 VanDerWaalsContact C-N 3.28Å; L498-N500 PolarHBondContact O-N 2.86Å; L498-M501 PolarHBondContact N-O 2.87Å; L498-M501 WeakPolarHBondContact O-CB 3.32Å; L498-M501 PolarHBondContact O-N 2.86Å; L498-Y503 HydrophobicContact CB-CD2 4.23Å; L498-Y503 HydrophobicContact CB-CE2 3.98Å; L498-Y503 HydrophobicContact CG-CE2 4.49Å; L498-V539 HydrophobicContact CB-CG1 4.35Å; L498-V539 HydrophobicContact CB-CG2 4.09Å; L498-V539 HydrophobicContact CD1-CG1 3.89Å; L498-V539 HydrophobicContact CD2-CG1 4.25Å; L498-V539 HydrophobicContact CG-CG1 4.39Å; L498-G542 WeakPolarHBondContact CD2-O 3.25Å; L498-V544 HydrophobicContact CD2-CG2 3.79Å; L498-P565 HydrophobicContact CD2-CG 3.63Å; L498-P565 HydrophobicContact CG-CG 4.5Å
499	N	88.9	Confident	93.9	Very high	101 Å²	101	30.9 Å²	30.9	54%	0.54	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	40.5	179.4	-56	-21.4	0	0	0	113.9	M501	N499-M501 PolarHBondContact O-N 2.86Å
500	N	90.9	Very high	93.6	Very high	111 Å²	111	32 Å²	32	59%	0.594	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	13.3	-174.5	-56.8	-34.9	0	0	0	116	C450 L498 P517	C450-N500 VanDerWaalsContact SG-CA 3.59Å; C450-N500 PolarHBondContact SG-O 2.98Å; L498-N500 VanDerWaalsContact C-N 3.28Å; L498-N500 PolarHBondContact O-N 2.86Å; N500-P517 VanDerWaalsContact O-CD 3.23Å; N500-P517 WeakPolarHBondContact O-CD 3.42Å
501	M	95.1	Very high	93.5	Very high	36 Å²	36	30 Å²	30	18%	0.177	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	151.2	174.5	-54	-62.8	-75.7	0	0	110.4	S497 L498 N499 Y503 C514 D516	S497-M501 VanDerWaalsContact CA-O 3.29Å; S497-M501 WeakPolarHBondContact CA-O 3.37Å; L498-M501 PolarHBondContact N-O 2.87Å; L498-M501 WeakPolarHBondContact O-CB 3.32Å; L498-M501 PolarHBondContact O-N 2.86Å; N499-M501 PolarHBondContact O-N 2.86Å; M501-Y503 HydrophobicContact CB-CE2 3.93Å; M501-C514 WeakPolarHBondContact CE-SG 3.35Å; M501-D516 HydrophobicContact CE-CB 3.61Å; M501-D516 HydrophobicContact SD-CB 4.09Å
502	I	97.4	Very high	93.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.7	175.9	-51.6	-176.5	0	0	0	109.6	A448 C450 Y455 I457 A495 V496 V504 C514 Y515 P517	A448-I502 HydrophobicContact CB-CG2 3.86Å; C450-I502 HydrophobicContact CB-CD1 3.74Å; C450-I502 HydrophobicContact CB-CG1 3.67Å; Y455-I502 HydrophobicContact CD1-CD1 4.07Å; Y455-I502 HydrophobicContact CD2-CD1 3.46Å; Y455-I502 VanDerWaalsContact CD2-CD1 3.46Å; Y455-I502 HydrophobicContact CE2-CD1 4.11Å; Y455-I502 HydrophobicContact CG-CD1 3.46Å; Y455-I502 VanDerWaalsContact CG-CD1 3.46Å; I457-I502 HydrophobicContact CD1-CG2 3.96Å; A495-I502 HydrophobicContact CB-CG2 4.06Å; V496-I502 WeakPolarHBondContact O-CA 3.37Å; I502-V504 HydrophobicContact CG2-CG2 4.18Å; I502-C514 CarbonylContact O-C 3.54Å; I502-C514 VanDerWaalsContact O-CA 3.32Å; I502-C514 WeakPolarHBondContact O-CA 3.44Å; I502-Y515 HydrophobicContact CB-CD1 4.46Å; I502-Y515 HydrophobicContact CD1-CD1 4.1Å; I502-Y515 HydrophobicContact CG1-CD1 4.4Å; I502-Y515 PolarHBondContact N-O 2.95Å; I502-Y515 PolarHBondContact O-N 3.26Å; I502-P517 HydrophobicContact CD1-CG 4.21Å; I502-P517 HydrophobicContact CG1-CG 4.1Å
503	Y	96.9	Very high	93.7	Very high	18 Å²	18	25.7 Å²	25.7	7%	0.071	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135	176.1	-65.4	-91.2	0	0	0	109.9	A495 V496 L498 M501 L512 Y513 C514 V525 M537 V544 F563	A495-Y503 CarbonylContact C-O 3.59Å; A495-Y503 WeakPolarHBondContact CA-O 3.46Å; V496-Y503 PolarHBondContact N-O 3.32Å; V496-Y503 PolarHBondContact O-N 3.08Å; L498-Y503 HydrophobicContact CB-CD2 4.23Å; L498-Y503 HydrophobicContact CB-CE2 3.98Å; L498-Y503 HydrophobicContact CG-CE2 4.49Å; M501-Y503 HydrophobicContact CB-CE2 3.93Å; Y503-L512 HydrophobicContact CD1-CD2 4.45Å; Y503-Y513 CarbonylContact C-O 3.6Å; Y503-Y513 WeakPolarHBondContact CA-O 3.43Å; Y503-C514 HydrophobicContact CD1-CB 4.03Å; Y503-C514 HydrophobicContact CE1-CB 3.96Å; Y503-V525 HydrophobicContact CE1-CG2 4.37Å; Y503-M537 WeakPolarHBondContact O-CE 3.26Å; Y503-V544 HydrophobicContact CD2-CG2 3.96Å; Y503-V544 HydrophobicContact CE2-CG2 4.45Å; Y503-V544 HydrophobicContact CG-CG2 4.01Å; Y503-F563 HydrophobicContact CD1-CE1 4.48Å; Y503-F563 HydrophobicContact CE1-CD1 4.3Å; Y503-F563 AromaticContact CE1-CE1 3.84Å; Y503-F563 HydrophobicContact CE1-CE1 3.84Å
504	V	96.9	Very high	93.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.3	-177	-173.4	0	0	0	0	111	I457 I486 I493 T494 A495 I502 Y513 W522	I457-V504 HydrophobicContact CD1-CG2 3.98Å; I486-V504 HydrophobicContact CD1-CB 4.23Å; I486-V504 HydrophobicContact CD1-CG1 3.79Å; I493-V504 HydrophobicContact CB-CG1 4.31Å; I493-V504 HydrophobicContact CD1-CG1 4.13Å; T494-V504 WeakPolarHBondContact O-CA 3.36Å; A495-V504 HydrophobicContact CB-CG2 4Å; I502-V504 HydrophobicContact CG2-CG2 4.18Å; V504-Y513 PolarHBondContact N-O 3.19Å; V504-Y513 PolarHBondContact O-N 2.82Å; V504-W522 HydrophobicContact CB-CH2 4.47Å; V504-W522 HydrophobicContact CB-CZ3 4.27Å; V504-W522 HydrophobicContact CG2-CH2 3.75Å; V504-W522 HydrophobicContact CG2-CZ3 3.87Å
505	C	94.8	Very high	93.9	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	167	178.3	-171.5	0	0	0	0	110.4	I493 T494 L512 M537 I546	I493-C505 CarbonylContact C-O 3.55Å; I493-C505 WeakPolarHBondContact CA-O 3.39Å; T494-C505 PolarHBondContact N-O 2.86Å; T494-C505 PolarHBondContact O-N 3.01Å; T494-C505 VanDerWaalsContact O-N 3.1Å; C505-L512 HydrophobicContact CB-CD1 3.96Å; C505-M537 HydrophobicContact CB-SD 4.09Å; C505-I546 HydrophobicContact CB-CD1 4.19Å
506	G	92.4	Very high	94	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	113	-153.2	172.7	0	0	0	0	0	113.8	L508 T509 Q532	G506-L508 VanDerWaalsContact C-N 3.27Å; G506-L508 PolarHBondContact O-N 2.97Å; G506-T509 WeakPolarHBondContact O-CB 3.21Å; G506-T509 PolarHBondContact O-N 3.26Å; G506-T509 PolarHBondContact O-OG1 3.47Å; G506-Q532 CarbonylContact C-O 3.57Å; G506-Q532 WeakPolarHBondContact CA-O 3.38Å
507	G	90.4	Very high	94	Very high	3 Å²	3	25.1 Å²	25.1	3%	0.031	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	29	176.2	0	0	0	0	0	115.6	K490 R491 C492 T509 Q532	K490-G507 VanDerWaalsContact CD-O 3.28Å; K490-G507 WeakPolarHBondContact CD-O 3.27Å; K490-G507 VanDerWaalsContact CE-O 3.28Å; K490-G507 WeakPolarHBondContact CE-O 3.37Å; K490-G507 PolarHBondContact NZ-O 3.44Å; K490-G507 VanDerWaalsContact NZ-O 3.09Å; R491-G507 VanDerWaalsContact O-CA 3.28Å; R491-G507 WeakPolarHBondContact O-CA 3.39Å; C492-G507 PolarHBondContact O-N 3.13Å; G507-T509 PolarHBondContact O-N 3.19Å; G507-Q532 PolarHBondContact N-O 3.1Å
508	L	91.1	Very high	94	Very high	45 Å²	45	28.1 Å²	28.1	24%	0.236	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	34.2	-172.8	-61.2	172	0	0	0	112.6	G506 Q532 E533 E552	G506-L508 VanDerWaalsContact C-N 3.27Å; G506-L508 PolarHBondContact O-N 2.97Å; L508-Q532 WeakPolarHBondContact CA-O 3.44Å; L508-Q532 PolarHBondContact N-O 2.94Å; L508-E533 HydrophobicContact CD2-CB 4.28Å; L508-E533 HydrophobicContact CD2-CG 3.91Å; L508-E533 HydrophobicContact CG-CB 4.09Å; L508-E533 HydrophobicContact CG-CG 3.9Å; L508-E552 HydrophobicContact CD1-CG 4.45Å; L508-E552 HydrophobicContact CD2-CG 4.13Å
509	T	89.8	Confident	94.2	Very high	16 Å²	16	34.2 Å²	34.2	10%	0.098	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	158.6	170	72.8	0	0	0	0	110.5	I488 K490 G506 G507	I488-T509 HydrophobicContact CD1-CG2 3.89Å; K490-T509 HydrophobicContact CD-CG2 4.49Å; K490-T509 HydrophobicContact CG-CG2 4.07Å; G506-T509 WeakPolarHBondContact O-CB 3.21Å; G506-T509 PolarHBondContact O-N 3.26Å; G506-T509 PolarHBondContact O-OG1 3.47Å; G507-T509 PolarHBondContact O-N 3.19Å
510	Q	89.9	Confident	94.6	Very high	78 Å²	78	31.6 Å²	31.6	36%	0.364	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	6.1	169.6	-80	170.2	-42.4	0	0	112.2	Q527 T528 K531	Q510-Q527 CarbonylContact O-C 3.59Å; Q510-Q527 WeakPolarHBondContact O-CA 3.28Å; Q510-T528 WeakPolarHBondContact CA-OG1 3.28Å; Q510-T528 PolarHBondContact O-N 2.68Å; Q510-T528 PolarHBondContact O-OG1 3.34Å; Q510-K531 HydrophobicContact CG-CB 4.5Å; Q510-K531 HydrophobicContact CG-CG 3.73Å
511	N	92.6	Very high	94.9	Very high	30 Å²	30	30.8 Å²	30.8	16%	0.16	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.4	-166	-70.5	-9.9	0	0	0	110.9	Y513 L524 Q527	N511-Y513 HydrophobicContact CB-CD2 3.91Å; N511-Y513 HydrophobicContact CB-CE2 3.34Å; N511-Y513 PolarHBondContact ND2-OH 3.31Å; N511-L524 HydrophobicContact CB-CD1 3.58Å; N511-Q527 PolarHBondContact OD1-NE2 3.28Å; N511-Q527 VanDerWaalsContact OD1-NE2 3.09Å
512	L	94.9	Very high	95	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	106.8	164.7	-177.8	65.4	0	0	0	108.2	Y503 C505 V525 C526 F563	Y503-L512 HydrophobicContact CD1-CD2 4.45Å; C505-L512 HydrophobicContact CB-CD1 3.96Å; L512-V525 PolarHBondContact O-N 2.83Å; L512-C526 PolarHBondContact N-O 2.83Å; L512-F563 HydrophobicContact CD2-CB 3.92Å; L512-F563 HydrophobicContact CD2-CD1 3.73Å; L512-F563 HydrophobicContact CD2-CD2 4.05Å; L512-F563 HydrophobicContact CD2-CE1 4.33Å; L512-F563 HydrophobicContact CD2-CG 3.58Å
513	Y	96.4	Very high	95	Very high	21 Å²	21	33.6 Å²	33.6	8%	0.082	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	150.3	175.4	-71.3	-77.5	0	0	0	110.8	P487 I488 Y503 V504 N511 I523 L524	P487-Y513 HydrophobicContact CB-CE1 3.9Å; P487-Y513 HydrophobicContact CG-CD1 4.23Å; P487-Y513 HydrophobicContact CG-CE1 3.96Å; I488-Y513 HydrophobicContact CB-CE2 4.44Å; I488-Y513 HydrophobicContact CD1-CD2 3.96Å; I488-Y513 HydrophobicContact CD1-CE2 3.7Å; I488-Y513 HydrophobicContact CG1-CD2 4.11Å; I488-Y513 HydrophobicContact CG1-CE2 3.72Å; I488-Y513 HydrophobicContact CG2-CE2 3.84Å; Y503-Y513 CarbonylContact C-O 3.6Å; Y503-Y513 WeakPolarHBondContact CA-O 3.43Å; V504-Y513 PolarHBondContact N-O 3.19Å; V504-Y513 PolarHBondContact O-N 2.82Å; N511-Y513 HydrophobicContact CB-CD2 3.91Å; N511-Y513 HydrophobicContact CB-CE2 3.34Å; N511-Y513 PolarHBondContact ND2-OH 3.31Å; Y513-I523 CarbonylContact C-O 3.52Å; Y513-I523 WeakPolarHBondContact CA-O 3.45Å; Y513-L524 HydrophobicContact CD1-CB 4.4Å; Y513-L524 HydrophobicContact CD1-CD1 4.3Å; Y513-L524 HydrophobicContact CE1-CB 4.2Å; Y513-L524 HydrophobicContact CE1-CD1 4.05Å
514	C	97	Very high	94.9	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.9	171.5	177.3	0	0	0	0	109.2	M501 I502 Y503 W522 I523 V525	M501-C514 WeakPolarHBondContact CE-SG 3.35Å; I502-C514 CarbonylContact O-C 3.54Å; I502-C514 VanDerWaalsContact O-CA 3.32Å; I502-C514 WeakPolarHBondContact O-CA 3.44Å; Y503-C514 HydrophobicContact CD1-CB 4.03Å; Y503-C514 HydrophobicContact CE1-CB 3.96Å; C514-W522 CarbonylContact O-C 3.53Å; C514-W522 WeakPolarHBondContact O-CA 3.34Å; C514-I523 HydrophobicContact CB-CB 4.49Å; C514-I523 PolarHBondContact N-O 3.2Å; C514-I523 PolarHBondContact O-N 3.34Å; C514-V525 HydrophobicContact CB-CG2 3.24Å
515	Y	98	Very high	94.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.8	177.5	173.3	-110.4	0	0	0	109.7	Y455 R483 A484 I502 P517 D520 Y521 W522	Y455-Y515 AromaticContact CD1-CE1 3.96Å; Y455-Y515 HydrophobicContact CD1-CE1 3.96Å; Y455-Y515 AromaticContact CE1-CE1 3.75Å; Y455-Y515 HydrophobicContact CE1-CE1 3.75Å; R483-Y515 WeakPolarHBondContact CB-OH 3.26Å; R483-Y515 WeakPolarHBondContact CD-OH 3.42Å; A484-Y515 HydrophobicContact CB-CE2 4.47Å; I502-Y515 HydrophobicContact CB-CD1 4.46Å; I502-Y515 HydrophobicContact CD1-CD1 4.1Å; I502-Y515 HydrophobicContact CG1-CD1 4.4Å; I502-Y515 PolarHBondContact N-O 2.95Å; I502-Y515 PolarHBondContact O-N 3.26Å; Y515-P517 HydrophobicContact CD1-CB 4.28Å; Y515-P517 HydrophobicContact CD1-CG 3.93Å; Y515-P517 HydrophobicContact CE1-CB 3.76Å; Y515-P517 HydrophobicContact CE1-CG 3.93Å; Y515-P517 WeakPolarHBondContact O-CD 3.46Å; Y515-D520 WeakPolarHBondContact CE2-OD1 3.41Å; Y515-D520 PolarHBondContact OH-OD1 3.25Å; Y515-Y521 WeakPolarHBondContact CA-O 3.35Å; Y515-Y521 VanDerWaalsContact CD2-O 3.27Å; Y515-Y521 WeakPolarHBondContact CD2-O 3.46Å; Y515-W522 AromaticContact CD2-CD1 3.81Å; Y515-W522 AromaticContact CD2-CD2 3.9Å; Y515-W522 HydrophobicContact CD2-CD2 3.9Å; Y515-W522 AromaticContact CD2-CE2 3.5Å; Y515-W522 VanDerWaalsContact CD2-CE2 3.5Å; Y515-W522 HydrophobicContact CD2-CG 4.09Å; Y515-W522 AromaticContact CD2-CZ2 3.95Å; Y515-W522 HydrophobicContact CD2-CZ2 3.95Å; Y515-W522 AromaticContact CD2-NE1 3.42Å; Y515-W522 AromaticContact CE2-NE1 3.91Å; Y515-W522 HydrophobicContact CG-CD2 4.27Å; Y515-W522 AromaticContact CG-CE2 3.89Å; Y515-W522 HydrophobicContact CG-CH2 4.31Å; Y515-W522 AromaticContact CG-CZ2 3.92Å; Y515-W522 HydrophobicContact CG-CZ2 3.92Å
516	D	96.9	Very high	94.6	Very high	16 Å²	16	40.1 Å²	40.1	9%	0.086	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	110.4	169.3	-173.6	-30.5	0	0	0	108.9	M501 A518 Q519 D520 Y521	M501-D516 HydrophobicContact CE-CB 3.61Å; M501-D516 HydrophobicContact SD-CB 4.09Å; D516-A518 VanDerWaalsContact C-N 3.3Å; D516-A518 PolarHBondContact O-N 3.07Å; D516-A518 WeakPolarHBondContact OD1-CA 3.32Å; D516-A518 WeakPolarHBondContact OD1-CB 3.42Å; D516-A518 PolarHBondContact OD1-N 2.93Å; D516-Q519 HydrophobicContact CB-CB 4.22Å; D516-Q519 PolarHBondContact OD1-N 2.99Å; D516-Q519 WeakPolarHBondContact OD2-CG 3.3Å; D516-Q519 PolarHBondContact OD2-NE2 3.19Å; D516-D520 VanDerWaalsContact O-CA 3.29Å; D516-D520 WeakPolarHBondContact O-CA 3.23Å; D516-D520 PolarHBondContact O-N 2.88Å; D516-Y521 HydrophobicContact CB-CD1 3.67Å; D516-Y521 HydrophobicContact CB-CE1 3.42Å; D516-Y521 VanDerWaalsContact CB-CE1 3.42Å; D516-Y521 PolarHBondContact N-O 2.97Å; D516-Y521 PolarHBondContact O-N 2.79Å
517	P	96.3	Very high	94.6	Very high	11 Å²	11	46 Å²	46	7%	0.071	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.8	179.8	-10.4	28	0	0	0	114.4	C450 Y455 N500 I502 Y515	C450-P517 HydrophobicContact CB-CG 4.28Å; Y455-P517 HydrophobicContact CE1-CB 4.12Å; Y455-P517 HydrophobicContact CE2-CB 4.36Å; Y455-P517 VanDerWaalsContact OH-CB 3.31Å; Y455-P517 WeakPolarHBondContact OH-CB 3.4Å; N500-P517 VanDerWaalsContact O-CD 3.23Å; N500-P517 WeakPolarHBondContact O-CD 3.42Å; I502-P517 HydrophobicContact CD1-CG 4.21Å; I502-P517 HydrophobicContact CG1-CG 4.1Å; Y515-P517 HydrophobicContact CD1-CB 4.28Å; Y515-P517 HydrophobicContact CD1-CG 3.93Å; Y515-P517 HydrophobicContact CE1-CB 3.76Å; Y515-P517 HydrophobicContact CE1-CG 3.93Å; Y515-P517 WeakPolarHBondContact O-CD 3.46Å
518	A	95.7	Very high	94.3	Very high	95 Å²	95	46.1 Å²	46.1	79%	0.785	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-38.7	176.6	0	0	0	0	0	111.5	D516	D516-A518 VanDerWaalsContact C-N 3.3Å; D516-A518 PolarHBondContact O-N 3.07Å; D516-A518 WeakPolarHBondContact OD1-CA 3.32Å; D516-A518 WeakPolarHBondContact OD1-CB 3.42Å; D516-A518 PolarHBondContact OD1-N 2.93Å
519	Q	96.4	Very high	93.9	Very high	132 Å²	132	51 Å²	51	62%	0.617	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.2	176.6	-68.9	-178.3	71.3	0	0	114	D516 Y521	D516-Q519 HydrophobicContact CB-CB 4.22Å; D516-Q519 PolarHBondContact OD1-N 2.99Å; D516-Q519 WeakPolarHBondContact OD2-CG 3.3Å; D516-Q519 PolarHBondContact OD2-NE2 3.19Å; Q519-Y521 HydrophobicContact CB-CD1 3.39Å; Q519-Y521 HydrophobicContact CB-CE1 3.52Å; Q519-Y521 HydrophobicContact CG-CD1 4.46Å; Q519-Y521 HydrophobicContact CG-CE1 4.16Å
520	D	97.3	Very high	93.6	Very high	47 Å²	47	52.8 Å²	52.8	25%	0.251	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	48.4	178.7	-152	-3.9	0	0	0	113.5	R483 A484 Y515 D516	R483-D520 WeakPolarHBondContact CB-OD1 3.48Å; R483-D520 WeakPolarHBondContact CD-OD1 3.4Å; R483-D520 WeakPolarHBondContact CD-OD2 3.17Å; R483-D520 IonicContact CZ-OD2 2.75Å; R483-D520 IonicContact NE-OD2 2.68Å; R483-D520 IonicContact NH1-OD2 3.08Å; R483-D520 PolarHBondContact NH1-OD2 3.37Å; A484-D520 WeakPolarHBondContact CB-O 3.41Å; A484-D520 WeakPolarHBondContact CB-OD1 3.31Å; A484-D520 PolarHBondContact N-OD1 3.11Å; Y515-D520 WeakPolarHBondContact CE2-OD1 3.41Å; Y515-D520 PolarHBondContact OH-OD1 3.25Å; D516-D520 VanDerWaalsContact O-CA 3.29Å; D516-D520 WeakPolarHBondContact O-CA 3.23Å; D516-D520 PolarHBondContact O-N 2.88Å
521	Y	96.9	Very high	93.5	Very high	93 Å²	93	52.8 Å²	52.8	37%	0.365	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	164.4	179.3	82.9	-69.7	0	0	0	113.5	Y515 D516 Q519 I523	Y515-Y521 WeakPolarHBondContact CA-O 3.35Å; Y515-Y521 VanDerWaalsContact CD2-O 3.27Å; Y515-Y521 WeakPolarHBondContact CD2-O 3.46Å; D516-Y521 HydrophobicContact CB-CD1 3.67Å; D516-Y521 HydrophobicContact CB-CE1 3.42Å; D516-Y521 VanDerWaalsContact CB-CE1 3.42Å; D516-Y521 PolarHBondContact N-O 2.97Å; D516-Y521 PolarHBondContact O-N 2.79Å; Q519-Y521 HydrophobicContact CB-CD1 3.39Å; Q519-Y521 HydrophobicContact CB-CE1 3.52Å; Q519-Y521 HydrophobicContact CG-CD1 4.46Å; Q519-Y521 HydrophobicContact CG-CE1 4.16Å; Y521-I523 HydrophobicContact CD2-CG1 4.09Å; Y521-I523 HydrophobicContact CE2-CD1 3.79Å; Y521-I523 HydrophobicContact CE2-CG1 3.49Å; Y521-I523 VanDerWaalsContact CE2-CG1 3.49Å
522	W	97.8	Very high	93.4	Very high	35 Å²	35	51.8 Å²	51.8	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.3	-175.7	-72.7	92.3	0	0	0	112.6	I457 V470 A484 N485 I486 P487 V504 C514 Y515	I457-W522 HydrophobicContact CD1-CH2 4.3Å; I457-W522 HydrophobicContact CG2-CH2 4.1Å; I457-W522 HydrophobicContact CG2-CZ2 4.32Å; V470-W522 HydrophobicContact CG2-CZ2 3.77Å; A484-W522 PolarHBondContact O-NE1 2.89Å; N485-W522 PolarHBondContact O-NE1 3.09Å; I486-W522 HydrophobicContact CB-CD2 4.46Å; I486-W522 HydrophobicContact CB-CH2 3.91Å; I486-W522 HydrophobicContact CB-CZ2 3.58Å; I486-W522 HydrophobicContact CB-CZ3 4.48Å; I486-W522 HydrophobicContact CD1-CH2 3.77Å; I486-W522 HydrophobicContact CD1-CZ2 4.36Å; I486-W522 HydrophobicContact CD1-CZ3 3.94Å; I486-W522 HydrophobicContact CG1-CD2 4.38Å; I486-W522 HydrophobicContact CG1-CE3 4.23Å; I486-W522 HydrophobicContact CG1-CH2 3.8Å; I486-W522 HydrophobicContact CG1-CZ2 3.97Å; I486-W522 HydrophobicContact CG1-CZ3 3.94Å; P487-W522 HydrophobicContact CG-CB 3.83Å; P487-W522 HydrophobicContact CG-CG 4.18Å; V504-W522 HydrophobicContact CB-CH2 4.47Å; V504-W522 HydrophobicContact CB-CZ3 4.27Å; V504-W522 HydrophobicContact CG2-CH2 3.75Å; V504-W522 HydrophobicContact CG2-CZ3 3.87Å; C514-W522 CarbonylContact O-C 3.53Å; C514-W522 WeakPolarHBondContact O-CA 3.34Å; Y515-W522 AromaticContact CD2-CD1 3.81Å; Y515-W522 AromaticContact CD2-CD2 3.9Å; Y515-W522 HydrophobicContact CD2-CD2 3.9Å; Y515-W522 AromaticContact CD2-CE2 3.5Å; Y515-W522 VanDerWaalsContact CD2-CE2 3.5Å; Y515-W522 HydrophobicContact CD2-CG 4.09Å; Y515-W522 AromaticContact CD2-CZ2 3.95Å; Y515-W522 HydrophobicContact CD2-CZ2 3.95Å; Y515-W522 AromaticContact CD2-NE1 3.42Å; Y515-W522 AromaticContact CE2-NE1 3.91Å; Y515-W522 HydrophobicContact CG-CD2 4.27Å; Y515-W522 AromaticContact CG-CE2 3.89Å; Y515-W522 HydrophobicContact CG-CH2 4.31Å; Y515-W522 AromaticContact CG-CZ2 3.92Å; Y515-W522 HydrophobicContact CG-CZ2 3.92Å
523	I	95.9	Very high	93.2	Very high	61 Å²	61	53.4 Å²	53.4	31%	0.313	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134	177.8	-49.8	174.2	0	0	0	108	Y513 C514 Y521	Y513-I523 CarbonylContact C-O 3.52Å; Y513-I523 WeakPolarHBondContact CA-O 3.45Å; C514-I523 HydrophobicContact CB-CB 4.49Å; C514-I523 PolarHBondContact N-O 3.2Å; C514-I523 PolarHBondContact O-N 3.34Å; Y521-I523 HydrophobicContact CD2-CG1 4.09Å; Y521-I523 HydrophobicContact CE2-CD1 3.79Å; Y521-I523 HydrophobicContact CE2-CG1 3.49Å; Y521-I523 VanDerWaalsContact CE2-CG1 3.49Å
524	L	95.3	Very high	92.9	Very high	87 Å²	87	53.1 Å²	53.1	46%	0.455	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.1	162.6	176.8	62	0	0	0	108	N511 Y513	N511-L524 HydrophobicContact CB-CD1 3.58Å; Y513-L524 HydrophobicContact CD1-CB 4.4Å; Y513-L524 HydrophobicContact CD1-CD1 4.3Å; Y513-L524 HydrophobicContact CE1-CB 4.2Å; Y513-L524 HydrophobicContact CE1-CD1 4.05Å
525	V	93.3	Very high	92.7	Very high	45 Å²	45	53.2 Å²	53.2	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-51.2	-172.5	-178.4	0	0	0	0	111.6	Y503 L512 C514 F563	Y503-V525 HydrophobicContact CE1-CG2 4.37Å; L512-V525 PolarHBondContact O-N 2.83Å; C514-V525 HydrophobicContact CB-CG2 3.24Å; V525-F563 HydrophobicContact CG1-CE1 3.8Å; V525-F563 HydrophobicContact CG1-CE2 3.68Å; V525-F563 HydrophobicContact CG1-CZ 3.19Å
526	C	92.3	Very high	92.4	Very high	24 Å²	24	53.4 Å²	53.4	16%	0.162	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	177	178.2	70.6	0	0	0	0	110.6	L512	L512-C526 PolarHBondContact N-O 2.83Å
527	Q	91.4	Very high	92.3	Very high	124 Å²	124	53 Å²	53	58%	0.579	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.1	171.7	-61.9	-171.6	-55.9	0	0	111.4	Q510 N511 L570	Q510-Q527 CarbonylContact O-C 3.59Å; Q510-Q527 WeakPolarHBondContact O-CA 3.28Å; N511-Q527 PolarHBondContact OD1-NE2 3.28Å; N511-Q527 VanDerWaalsContact OD1-NE2 3.09Å; Q527-L570 WeakPolarHBondContact O-CD2 3.48Å
528	T	85.9	Confident	92.3	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	152.5	174.1	58.2	0	0	0	0	111	Q510 A530 I546	Q510-T528 WeakPolarHBondContact CA-OG1 3.28Å; Q510-T528 PolarHBondContact O-N 2.68Å; Q510-T528 PolarHBondContact O-OG1 3.34Å; T528-A530 VanDerWaalsContact C-N 3.26Å; T528-A530 PolarHBondContact O-N 2.75Å; T528-A530 PolarHBondContact OG1-O 3.26Å; T528-I546 HydrophobicContact CG2-CD1 4.27Å
529	L	81.4	Confident	92.2	Very high	147 Å²	147	49.4 Å²	49.4	77%	0.77	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.2	-33.9	-177.2	-61.6	173.3	0	0	0	113.1
530	A	83.9	Confident	91.9	Very high	53 Å²	53	43.1 Å²	43.1	44%	0.438	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.1	179.8	0	0	0	0	0	111.5	T528	T528-A530 VanDerWaalsContact C-N 3.26Å; T528-A530 PolarHBondContact O-N 2.75Å; T528-A530 PolarHBondContact OG1-O 3.26Å
531	K	88.3	Confident	91.4	Very high	78 Å²	78	43.1 Å²	43.1	34%	0.339	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.1	163.6	-66	173.9	-176.8	168.4	0	108.5	Q510 E552	Q510-K531 HydrophobicContact CG-CB 4.5Å; Q510-K531 HydrophobicContact CG-CG 3.73Å; K531-E552 VanDerWaalsContact CD-CD 3.46Å; K531-E552 HydrophobicContact CD-CG 4.07Å; K531-E552 WeakPolarHBondContact CD-OE1 3.21Å; K531-E552 WeakPolarHBondContact CE-OE1 3.14Å; K531-E552 IonicContact NZ-OE1 3.46Å; K531-E552 PolarHBondContact NZ-OE1 3.12Å; K531-E552 IonicContact NZ-OE2 2.7Å; K531-E552 PolarHBondContact NZ-OE2 2.9Å
532	Q	90	Very high	91	Very high	9 Å²	9	39.3 Å²	39.3	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	155.1	177.1	60.9	-165	-1.7	0	0	112	G506 G507 L508 I546 G548 Q550	G506-Q532 CarbonylContact C-O 3.57Å; G506-Q532 WeakPolarHBondContact CA-O 3.38Å; G507-Q532 PolarHBondContact N-O 3.1Å; L508-Q532 WeakPolarHBondContact CA-O 3.44Å; L508-Q532 PolarHBondContact N-O 2.94Å; Q532-I546 VanDerWaalsContact NE2-CG2 3.32Å; Q532-G548 PolarHBondContact OE1-O 2.85Å; Q532-Q550 CarbonylContact C-O 3.59Å; Q532-Q550 VanDerWaalsContact CA-O 3.26Å; Q532-Q550 WeakPolarHBondContact CA-O 3.28Å
533	E	90.4	Very high	90.8	Very high	34 Å²	34	40.7 Å²	40.7	16%	0.159	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-135	166.9	166.5	66.2	168.7	-161.3	0	0	111.4	C492 L508 C535 G549 Q550	C492-E533 HydrophobicContact CB-CB 3.94Å; C492-E533 HydrophobicContact CB-CG 4.43Å; L508-E533 HydrophobicContact CD2-CB 4.28Å; L508-E533 HydrophobicContact CD2-CG 3.91Å; L508-E533 HydrophobicContact CG-CB 4.09Å; L508-E533 HydrophobicContact CG-CG 3.9Å; E533-C535 PolarHBondContact O-N 3.25Å; E533-G549 CarbonylContact O-C 3.54Å; E533-G549 VanDerWaalsContact O-CA 3.28Å; E533-G549 WeakPolarHBondContact O-CA 3.28Å; E533-Q550 HydrophobicContact CG-CG 3.73Å; E533-Q550 PolarHBondContact N-O 3.04Å; E533-Q550 PolarHBondContact O-N 3.02Å; E533-Q550 PolarHBondContact OE1-NE2 3.3Å
534	S	90.3	Very high	90.8	Very high	16 Å²	16	37.8 Å²	37.8	11%	0.112	21%	0.207	C	C	.	.	S	Bend	trans	55.5	28.8	176.5	-53.4	0	0	0	0	113.7	C492 Y582	C492-S534 PolarHBondContact O-N 2.88Å; S534-Y582 PolarHBondContact O-N 3.12Å; S534-Y582 WeakPolarHBondContact OG-CE1 3.37Å
535	C	92.4	Very high	90.8	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.034	19%	0.187	C	C	.	.			trans	-79.4	154.4	172.2	55.3	0	0	0	0	111.6	E533 I546 L547 G548	E533-C535 PolarHBondContact O-N 3.25Å; C535-I546 HydrophobicContact CB-CG2 4.07Å; C535-L547 WeakPolarHBondContact CB-O 3.31Å; C535-G548 WeakPolarHBondContact CB-O 3.49Å
536	G	92.8	Very high	90.9	Very high	4 Å²	4	32.1 Å²	32.1	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.9	164.8	0	0	0	0	0	110.3	I546 L547 H583	G536-I546 WeakPolarHBondContact O-CA 3.28Å; G536-L547 PolarHBondContact N-O 3.16Å; G536-L547 PolarHBondContact O-N 3.42Å; G536-H583 VanDerWaalsContact CA-NE2 3.31Å; G536-H583 WeakPolarHBondContact CA-NE2 3.26Å; G536-H583 PolarHBondContact N-NE2 3.3Å; G536-H583 VanDerWaalsContact N-NE2 3.13Å
537	M	94.8	Very high	90.9	Very high	8 Å²	8	31 Å²	31	4%	0.039	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	134.5	168.1	-166.2	164.1	67.1	0	0	108.9	T494 A495 V496 Y503 C505 V544 Y545 I546	T494-M537 HydrophobicContact CG2-CB 3.61Å; T494-M537 HydrophobicContact CG2-CE 3.93Å; T494-M537 HydrophobicContact CG2-SD 4.19Å; T494-M537 VanDerWaalsContact O-CE 3.24Å; T494-M537 WeakPolarHBondContact O-CE 3.48Å; A495-M537 VanDerWaalsContact CA-CE 3.41Å; V496-M537 HydrophobicContact CB-CE 4.36Å; V496-M537 HydrophobicContact CG1-CB 3.92Å; V496-M537 HydrophobicContact CG1-CE 4.03Å; V496-M537 HydrophobicContact CG1-CG 3.72Å; V496-M537 VanDerWaalsContact CG1-O 3.32Å; V496-M537 WeakPolarHBondContact CG1-O 3.45Å; V496-M537 HydrophobicContact CG2-CE 4.03Å; V496-M537 HydrophobicContact CG2-CG 4.14Å; V496-M537 HydrophobicContact CG2-SD 4.44Å; Y503-M537 WeakPolarHBondContact O-CE 3.26Å; C505-M537 HydrophobicContact CB-SD 4.09Å; M537-V544 HydrophobicContact CG-CG1 3.74Å; M537-V544 HydrophobicContact SD-CG1 3.74Å; M537-Y545 CarbonylContact C-O 3.57Å; M537-Y545 VanDerWaalsContact CA-O 3.22Å; M537-Y545 WeakPolarHBondContact CA-O 3.35Å; M537-Y545 WeakPolarHBondContact CG-O 3.37Å; M537-I546 HydrophobicContact CG-CG1 3.96Å; M537-I546 HydrophobicContact SD-CD1 4.35Å; M537-I546 HydrophobicContact SD-CG1 3.76Å
538	S	95.1	Very high	91	Very high	13 Å²	13	25 Å²	25	9%	0.091	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	170.3	177.3	-137.5	0	0	0	0	112	Y545 V586 T587	S538-Y545 PolarHBondContact N-O 3.38Å; S538-Y545 PolarHBondContact O-N 2.77Å; S538-V586 WeakPolarHBondContact OG-CA 3.32Å; S538-T587 PolarHBondContact OG-N 2.92Å; S538-T587 PolarHBondContact OG-OG1 3.18Å
539	V	93.5	Very high	91.3	Very high	17 Å²	17	24.8 Å²	24.8	10%	0.103	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.1	179.3	173.7	0	0	0	0	108.7	V496 L498 K543 V544 T587	V496-V539 HydrophobicContact CB-CG2 3.85Å; V496-V539 HydrophobicContact CG2-CG2 3.55Å; L498-V539 HydrophobicContact CB-CG1 4.35Å; L498-V539 HydrophobicContact CB-CG2 4.09Å; L498-V539 HydrophobicContact CD1-CG1 3.89Å; L498-V539 HydrophobicContact CD2-CG1 4.25Å; L498-V539 HydrophobicContact CG-CG1 4.39Å; V539-K543 WeakPolarHBondContact CA-O 3.41Å; V539-V544 HydrophobicContact CG2-CG2 4.43Å; V539-T587 VanDerWaalsContact O-CB 3.26Å; V539-T587 WeakPolarHBondContact O-CB 3.2Å; V539-T587 WeakPolarHBondContact O-CG2 3.14Å; V539-T587 PolarHBondContact O-OG1 2.71Å
540	A	91.1	Very high	91.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	143.9	174.9	0	0	0	0	0	109.1	E311 I313 P335 G542 K543 Y545 T587	E311-A540 HydrophobicContact CB-CB 4.44Å; I313-A540 HydrophobicContact CD1-CB 4Å; I313-A540 HydrophobicContact CG1-CB 3.8Å; P335-A540 HydrophobicContact CG-CB 4.09Å; A540-G542 PolarHBondContact O-N 3.12Å; A540-K543 PolarHBondContact N-O 3.14Å; A540-K543 VanDerWaalsContact N-O 3.15Å; A540-K543 PolarHBondContact O-N 3.08Å; A540-Y545 HydrophobicContact CB-CD2 4.18Å; A540-Y545 HydrophobicContact CB-CE2 4.1Å; A540-Y545 WeakPolarHBondContact O-CE2 3.46Å; A540-T587 HydrophobicContact CB-CG2 4.17Å
541	N	87.3	Confident	92	Very high	48 Å²	48	16.6 Å²	16.6	26%	0.257	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	24.8	179.9	-60.5	-57.8	0	0	0	114.3	R302 E311	R302-N541 VanDerWaalsContact CZ-C 3.48Å; R302-N541 PolarHBondContact NH1-O 3.46Å; E311-N541 WeakPolarHBondContact OE2-CA 3.16Å; E311-N541 PolarHBondContact OE2-N 2.64Å
542	G	88.7	Confident	91.9	Very high	13 Å²	13	19.1 Å²	19.1	13%	0.134	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	18.1	-178.3	0	0	0	0	0	115.5	L498 A540	L498-G542 WeakPolarHBondContact CD2-O 3.25Å; A540-G542 PolarHBondContact O-N 3.12Å
543	K	93.1	Very high	91.6	Very high	64 Å²	64	23.8 Å²	23.8	28%	0.278	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	154.9	177.1	-53.2	-170.2	-173.7	-149.2	0	110	V539 A540 Y545 C562 F563 D564	V539-K543 WeakPolarHBondContact CA-O 3.41Å; A540-K543 PolarHBondContact N-O 3.14Å; A540-K543 VanDerWaalsContact N-O 3.15Å; A540-K543 PolarHBondContact O-N 3.08Å; K543-Y545 HydrophobicContact CB-CD2 4.4Å; K543-Y545 HydrophobicContact CB-CE2 3.85Å; K543-C562 WeakPolarHBondContact CD-SG 3.01Å; K543-F563 WeakPolarHBondContact CA-O 3.19Å; K543-F563 WeakPolarHBondContact CB-O 2.97Å; K543-D564 HydrophobicContact CD-CB 3.98Å; K543-D564 WeakPolarHBondContact CE-OD2 3.1Å; K543-D564 HydrophobicContact CG-CB 4.3Å; K543-D564 IonicContact NZ-OD2 3.74Å; K543-D564 PolarHBondContact NZ-OD2 2.82Å
544	V	95.1	Very high	91.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.6	175.9	177.5	0	0	0	0	108.3	V496 L498 Y503 M537 V539 I546 C562 F563	V496-V544 HydrophobicContact CG2-CG1 3.83Å; V496-V544 HydrophobicContact CG2-CG2 4.02Å; L498-V544 HydrophobicContact CD2-CG2 3.79Å; Y503-V544 HydrophobicContact CD2-CG2 3.96Å; Y503-V544 HydrophobicContact CE2-CG2 4.45Å; Y503-V544 HydrophobicContact CG-CG2 4.01Å; M537-V544 HydrophobicContact CG-CG1 3.74Å; M537-V544 HydrophobicContact SD-CG1 3.74Å; V539-V544 HydrophobicContact CG2-CG2 4.43Å; V544-I546 HydrophobicContact CG1-CG1 4.49Å; V544-C562 CarbonylContact O-C 3.59Å; V544-C562 WeakPolarHBondContact O-CA 3.45Å; V544-F563 HydrophobicContact CB-CB 4.35Å; V544-F563 PolarHBondContact N-O 2.92Å; V544-F563 PolarHBondContact O-N 3.17Å
545	Y	95.6	Very high	90.9	Very high	11 Å²	11	28.6 Å²	28.6	4%	0.043	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.3	175.7	-71.9	-100.1	0	0	0	109.7	I313 Y333 P335 M537 S538 A540 K543 I560 I561 C562	I313-Y545 VanDerWaalsContact CD1-CB 3.49Å; I313-Y545 HydrophobicContact CD1-CD1 3.94Å; I313-Y545 HydrophobicContact CD1-CD2 3.72Å; I313-Y545 HydrophobicContact CD1-CE2 4.43Å; I313-Y545 HydrophobicContact CD1-CG 3.44Å; I313-Y545 VanDerWaalsContact CD1-CG 3.44Å; Y333-Y545 HydrophobicContact CE1-CE1 4.4Å; P335-Y545 HydrophobicContact CB-CE1 3.88Å; P335-Y545 HydrophobicContact CB-CE2 4.3Å; P335-Y545 VanDerWaalsContact CB-OH 3.26Å; P335-Y545 WeakPolarHBondContact CB-OH 3.39Å; P335-Y545 HydrophobicContact CG-CE1 4.38Å; P335-Y545 HydrophobicContact CG-CE2 4.41Å; M537-Y545 CarbonylContact C-O 3.57Å; M537-Y545 VanDerWaalsContact CA-O 3.22Å; M537-Y545 WeakPolarHBondContact CA-O 3.35Å; M537-Y545 WeakPolarHBondContact CG-O 3.37Å; S538-Y545 PolarHBondContact N-O 3.38Å; S538-Y545 PolarHBondContact O-N 2.77Å; A540-Y545 HydrophobicContact CB-CD2 4.18Å; A540-Y545 HydrophobicContact CB-CE2 4.1Å; A540-Y545 WeakPolarHBondContact O-CE2 3.46Å; K543-Y545 HydrophobicContact CB-CD2 4.4Å; K543-Y545 HydrophobicContact CB-CE2 3.85Å; Y545-I560 HydrophobicContact CD1-CG2 4.05Å; Y545-I561 CarbonylContact C-O 3.57Å; Y545-I561 WeakPolarHBondContact CA-O 3.32Å; Y545-C562 HydrophobicContact CD1-CB 3.89Å; Y545-C562 HydrophobicContact CE1-CB 3.67Å; Y545-C562 VanDerWaalsContact CZ-SG 3.54Å
546	I	94.8	Very high	90.8	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.2	174.6	-49.1	163.5	0	0	0	107.2	C505 T528 Q532 C535 G536 M537 V544 I561	C505-I546 HydrophobicContact CB-CD1 4.19Å; T528-I546 HydrophobicContact CG2-CD1 4.27Å; Q532-I546 VanDerWaalsContact NE2-CG2 3.32Å; C535-I546 HydrophobicContact CB-CG2 4.07Å; G536-I546 WeakPolarHBondContact O-CA 3.28Å; M537-I546 HydrophobicContact CG-CG1 3.96Å; M537-I546 HydrophobicContact SD-CD1 4.35Å; M537-I546 HydrophobicContact SD-CG1 3.76Å; V544-I546 HydrophobicContact CG1-CG1 4.49Å; I546-I561 HydrophobicContact CB-CB 4.45Å; I546-I561 PolarHBondContact N-O 2.79Å; I546-I561 PolarHBondContact O-N 3.01Å
547	L	94.1	Very high	90.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.6	-171.7	-67.4	88.8	0	0	0	110.6	I313 V315 W340 C535 G536 G549 I560 M576 H583	I313-L547 HydrophobicContact CD1-CD1 4.41Å; I313-L547 HydrophobicContact CG2-CD1 4.18Å; I313-L547 HydrophobicContact CG2-CD2 4.21Å; V315-L547 HydrophobicContact CG2-CD2 3.83Å; W340-L547 HydrophobicContact CH2-CD2 4.28Å; C535-L547 WeakPolarHBondContact CB-O 3.31Å; G536-L547 PolarHBondContact N-O 3.16Å; G536-L547 PolarHBondContact O-N 3.42Å; L547-G549 PolarHBondContact O-N 2.83Å; L547-I560 HydrophobicContact CD2-CD1 4.26Å; L547-I560 HydrophobicContact CD2-CG1 4.28Å; L547-I560 HydrophobicContact CG-CG1 4.26Å; L547-I560 HydrophobicContact CG-CG2 4.28Å; L547-M576 HydrophobicContact CB-SD 3.91Å; L547-M576 HydrophobicContact CD2-CG 4.44Å; L547-M576 HydrophobicContact CD2-SD 4.07Å; L547-H583 PolarHBondContact O-CE1 2.87Å; L547-H583 PolarHBondContact O-NE2 3.05Å
548	G	93	Very high	90.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.			trans	48	-131.7	175.1	0	0	0	0	0	114.5	Q532 C535 S557 A559 M576	Q532-G548 PolarHBondContact OE1-O 2.85Å; C535-G548 WeakPolarHBondContact CB-O 3.49Å; G548-S557 WeakPolarHBondContact CA-O 3.36Å; G548-A559 PolarHBondContact N-O 3.05Å; G548-M576 VanDerWaalsContact CA-CE 3.47Å
549	G	91.8	Very high	90.5	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.198	C	C	.	.			trans	91.3	-162.7	-166.4	0	0	0	0	0	111	E533 L547 A556 S557 I580	E533-G549 CarbonylContact O-C 3.54Å; E533-G549 VanDerWaalsContact O-CA 3.28Å; E533-G549 WeakPolarHBondContact O-CA 3.28Å; L547-G549 PolarHBondContact O-N 2.83Å; G549-A556 CarbonylContact O-C 3.6Å; G549-A556 VanDerWaalsContact O-CA 3.32Å; G549-A556 WeakPolarHBondContact O-CA 3.15Å; G549-S557 PolarHBondContact O-N 2.59Å; G549-I580 PolarHBondContact N-O 3.22Å
550	Q	90.6	Very high	90.5	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.028	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-136.1	147.8	-177.8	69.3	-168.6	17.7	0	0	112.8	Q532 E533 E555 C581 Y582	Q532-Q550 CarbonylContact C-O 3.59Å; Q532-Q550 VanDerWaalsContact CA-O 3.26Å; Q532-Q550 WeakPolarHBondContact CA-O 3.28Å; E533-Q550 HydrophobicContact CG-CG 3.73Å; E533-Q550 PolarHBondContact N-O 3.04Å; E533-Q550 PolarHBondContact O-N 3.02Å; E533-Q550 PolarHBondContact OE1-NE2 3.3Å; Q550-E555 VanDerWaalsContact CA-O 3.26Å; Q550-E555 WeakPolarHBondContact CA-O 3.43Å; Q550-E555 WeakPolarHBondContact CB-O 3.38Å; Q550-C581 HydrophobicContact CB-CB 4.03Å; Q550-C581 HydrophobicContact CG-CB 4.49Å; Q550-C581 PolarHBondContact OE1-SG 3.3Å; Q550-Y582 PolarHBondContact NE2-OH 2.72Å
551	G	88.7	Confident	90.6	Very high	21 Å²	21	34.8 Å²	34.8	22%	0.216	20%	0.196	C	C	.	.			trans	-85.5	-175.8	175.3	0	0	0	0	0	113.7	N553 G554 E555	G551-N553 PolarHBondContact O-N 2.87Å; G551-G554 PolarHBondContact O-N 3.34Å; G551-E555 PolarHBondContact N-O 2.83Å
552	E	86.2	Confident	91	Very high	132 Å²	132	32.6 Å²	32.6	62%	0.617	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.8	178.8	-63.5	-175	140.2	0	0	113.3	L508 K531	L508-E552 HydrophobicContact CD1-CG 4.45Å; L508-E552 HydrophobicContact CD2-CG 4.13Å; K531-E552 VanDerWaalsContact CD-CD 3.46Å; K531-E552 HydrophobicContact CD-CG 4.07Å; K531-E552 WeakPolarHBondContact CD-OE1 3.21Å; K531-E552 WeakPolarHBondContact CE-OE1 3.14Å; K531-E552 IonicContact NZ-OE1 3.46Å; K531-E552 PolarHBondContact NZ-OE1 3.12Å; K531-E552 IonicContact NZ-OE2 2.7Å; K531-E552 PolarHBondContact NZ-OE2 2.9Å
553	N	84.1	Confident	91.3	Very high	106 Å²	106	32 Å²	32	57%	0.567	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6	175	65.2	-9.8	0	0	0	114	G551 E555	G551-N553 PolarHBondContact O-N 2.87Å; N553-E555 WeakPolarHBondContact ND2-CG 3.34Å; N553-E555 PolarHBondContact ND2-OE2 2.95Å; N553-E555 PolarHBondContact O-N 3.12Å; N553-E555 PolarHBondContact OD1-N 2.89Å; N553-E555 VanDerWaalsContact OD1-N 3.13Å
554	G	81.7	Confident	91.3	Very high	20 Å²	20	30.1 Å²	30.1	21%	0.206	17%	0.171	C	C	.	.			trans	73.4	9.9	-177.2	0	0	0	0	0	114.9	G551	G551-G554 PolarHBondContact O-N 3.34Å
555	E	85.2	Confident	91.1	Very high	132 Å²	132	31.4 Å²	31.4	62%	0.617	18%	0.18	S	C	*	.	B	Isolated β-bridge	trans	-80.5	137.9	169.6	-64.9	-179.8	161.4	0	0	109.8	Q550 G551 N553	Q550-E555 VanDerWaalsContact CA-O 3.26Å; Q550-E555 WeakPolarHBondContact CA-O 3.43Å; Q550-E555 WeakPolarHBondContact CB-O 3.38Å; G551-E555 PolarHBondContact N-O 2.83Å; N553-E555 WeakPolarHBondContact ND2-CG 3.34Å; N553-E555 PolarHBondContact ND2-OE2 2.95Å; N553-E555 PolarHBondContact O-N 3.12Å; N553-E555 PolarHBondContact OD1-N 2.89Å; N553-E555 VanDerWaalsContact OD1-N 3.13Å
556	A	90.4	Very high	90.8	Very high	17 Å²	17	35.5 Å²	35.5	14%	0.14	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-74.1	152.2	174.7	0	0	0	0	0	111.2	E320 G549 P579 C581	E320-A556 VanDerWaalsContact O-CB 3.27Å; E320-A556 WeakPolarHBondContact O-CB 3.24Å; G549-A556 CarbonylContact O-C 3.6Å; G549-A556 VanDerWaalsContact O-CA 3.32Å; G549-A556 WeakPolarHBondContact O-CA 3.15Å; A556-P579 HydrophobicContact CB-CB 4.14Å; A556-P579 WeakPolarHBondContact O-CB 3.32Å; A556-C581 HydrophobicContact CB-CB 4.33Å
557	S	91.1	Very high	90.6	Very high	36 Å²	36	39.4 Å²	39.4	25%	0.252	24%	0.24	S	C	.	.			trans	-110.4	147.9	176.2	-171.6	0	0	0	0	111.4	G548 G549 A559 M576 P579 I580	G548-S557 WeakPolarHBondContact CA-O 3.36Å; G549-S557 PolarHBondContact O-N 2.59Å; S557-A559 WeakPolarHBondContact OG-CB 3.32Å; S557-A559 PolarHBondContact OG-N 2.96Å; S557-A559 VanDerWaalsContact OG-N 3.11Å; S557-M576 WeakPolarHBondContact O-CE 3.12Å; S557-P579 WeakPolarHBondContact O-CA 3.49Å; S557-I580 PolarHBondContact O-N 2.93Å
558	D	92.3	Very high	90.4	Very high	77 Å²	77	43.3 Å²	43.3	41%	0.412	27%	0.267	S	S	.	.			trans	-95.5	-2.6	168.5	65.1	-26.4	0	0	0	112.4	G575 M576 P579	D558-G575 CarbonylContact O-C 3.11Å; D558-G575 VanDerWaalsContact O-CA 3.28Å; D558-G575 WeakPolarHBondContact O-CA 3.33Å; D558-M576 HydrophobicContact CB-CB 4.36Å; D558-M576 WeakPolarHBondContact O-CG 3.23Å; D558-M576 PolarHBondContact O-N 3.07Å; D558-P579 HydrophobicContact CB-CB 4.25Å
559	A	92.1	Very high	90.4	Very high	33 Å²	33	46.8 Å²	46.8	27%	0.273	29%	0.288	S	S	.	.			trans	-62.2	140.5	-172.9	0	0	0	0	0	112.8	G548 S557	G548-A559 PolarHBondContact N-O 3.05Å; S557-A559 WeakPolarHBondContact OG-CB 3.32Å; S557-A559 PolarHBondContact OG-N 2.96Å; S557-A559 VanDerWaalsContact OG-N 3.11Å
560	I	93.6	Very high	90.4	Very high	3 Å²	3	49 Å²	49	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.6	168.5	-55.5	-179.3	0	0	0	107.9	Y333 W340 Y545 L547 G572 D573 R574 M576	Y333-I560 HydrophobicContact CD1-CD1 4.48Å; Y333-I560 HydrophobicContact CE1-CD1 4.28Å; Y333-I560 HydrophobicContact CE2-CD1 4.36Å; W340-I560 HydrophobicContact CZ2-CD1 3.71Å; Y545-I560 HydrophobicContact CD1-CG2 4.05Å; L547-I560 HydrophobicContact CD2-CD1 4.26Å; L547-I560 HydrophobicContact CD2-CG1 4.28Å; L547-I560 HydrophobicContact CG-CG1 4.26Å; L547-I560 HydrophobicContact CG-CG2 4.28Å; I560-G572 WeakPolarHBondContact O-CA 3.33Å; I560-D573 HydrophobicContact CB-CB 4.04Å; I560-D573 HydrophobicContact CG2-CB 3.93Å; I560-D573 PolarHBondContact O-N 3.12Å; I560-R574 WeakPolarHBondContact CD1-O 3.22Å; I560-R574 WeakPolarHBondContact CG1-O 3.28Å; I560-M576 HydrophobicContact CD1-CG 3.98Å; I560-M576 HydrophobicContact CG1-CG 3.82Å
561	I	93.6	Very high	90.5	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.051	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.3	178	-54.8	178.8	0	0	0	107.9	Y545 I546 L570	Y545-I561 CarbonylContact C-O 3.57Å; Y545-I561 WeakPolarHBondContact CA-O 3.32Å; I546-I561 HydrophobicContact CB-CB 4.45Å; I546-I561 PolarHBondContact N-O 2.79Å; I546-I561 PolarHBondContact O-N 3.01Å; I561-L570 HydrophobicContact CG2-CD1 3.41Å; I561-L570 VanDerWaalsContact CG2-CD1 3.41Å; I561-L570 HydrophobicContact CG2-CD2 3.86Å; I561-L570 HydrophobicContact CG2-CG 3.55Å
562	C	94.7	Very high	90.4	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.02	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.3	176.1	177.4	0	0	0	0	109.7	K543 V544 Y545 L570 T571	K543-C562 WeakPolarHBondContact CD-SG 3.01Å; V544-C562 CarbonylContact O-C 3.59Å; V544-C562 WeakPolarHBondContact O-CA 3.45Å; Y545-C562 HydrophobicContact CD1-CB 3.89Å; Y545-C562 HydrophobicContact CE1-CB 3.67Å; Y545-C562 VanDerWaalsContact CZ-SG 3.54Å; C562-L570 WeakPolarHBondContact O-CA 3.44Å; C562-T571 PolarHBondContact N-O 2.82Å; C562-T571 PolarHBondContact O-N 2.7Å; C562-T571 PolarHBondContact O-OG1 2.8Å
563	F	94.9	Very high	90.4	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.3	170.6	175.5	-104.3	0	0	0	109.9	Y503 L512 V525 K543 V544 P565 L570	Y503-F563 HydrophobicContact CD1-CE1 4.48Å; Y503-F563 HydrophobicContact CE1-CD1 4.3Å; Y503-F563 AromaticContact CE1-CE1 3.84Å; Y503-F563 HydrophobicContact CE1-CE1 3.84Å; L512-F563 HydrophobicContact CD2-CB 3.92Å; L512-F563 HydrophobicContact CD2-CD1 3.73Å; L512-F563 HydrophobicContact CD2-CD2 4.05Å; L512-F563 HydrophobicContact CD2-CE1 4.33Å; L512-F563 HydrophobicContact CD2-CG 3.58Å; V525-F563 HydrophobicContact CG1-CE1 3.8Å; V525-F563 HydrophobicContact CG1-CE2 3.68Å; V525-F563 HydrophobicContact CG1-CZ 3.19Å; K543-F563 WeakPolarHBondContact CA-O 3.19Å; K543-F563 WeakPolarHBondContact CB-O 2.97Å; V544-F563 HydrophobicContact CB-CB 4.35Å; V544-F563 PolarHBondContact N-O 2.92Å; V544-F563 PolarHBondContact O-N 3.17Å; F563-P565 HydrophobicContact CD1-CG 4.08Å; F563-P565 HydrophobicContact CE1-CB 3.97Å; F563-P565 HydrophobicContact CE1-CG 3.77Å; F563-P565 WeakPolarHBondContact O-CD 3.35Å; F563-L570 HydrophobicContact CB-CD1 3.71Å; F563-L570 HydrophobicContact CD2-CD1 4.11Å; F563-L570 HydrophobicContact CG-CD1 4.39Å
564	D	94.2	Very high	90.3	Very high	24 Å²	24	54.4 Å²	54.4	13%	0.128	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	107	177.8	-174.6	-25.8	0	0	0	110.5	K543 A566 T567 S568 V569	K543-D564 HydrophobicContact CD-CB 3.98Å; K543-D564 WeakPolarHBondContact CE-OD2 3.1Å; K543-D564 HydrophobicContact CG-CB 4.3Å; K543-D564 IonicContact NZ-OD2 3.74Å; K543-D564 PolarHBondContact NZ-OD2 2.82Å; D564-A566 PolarHBondContact O-N 3.02Å; D564-A566 WeakPolarHBondContact OD1-CB 3.31Å; D564-A566 PolarHBondContact OD1-N 3.17Å; D564-T567 WeakPolarHBondContact CB-OG1 3.47Å; D564-T567 PolarHBondContact O-N 3.27Å; D564-T567 PolarHBondContact OD1-N 3.02Å; D564-S568 VanDerWaalsContact O-CA 3.3Å; D564-S568 WeakPolarHBondContact O-CA 3.44Å; D564-S568 PolarHBondContact O-N 3.3Å; D564-V569 PolarHBondContact N-O 2.79Å
565	P	90.7	Very high	90.6	Very high	27 Å²	27	55 Å²	55	18%	0.175	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.9	-179.1	-19.9	31.2	0	0	0	114.9	L498 F563	L498-P565 HydrophobicContact CD2-CG 3.63Å; L498-P565 HydrophobicContact CG-CG 4.5Å; F563-P565 HydrophobicContact CD1-CG 4.08Å; F563-P565 HydrophobicContact CE1-CB 3.97Å; F563-P565 HydrophobicContact CE1-CG 3.77Å; F563-P565 WeakPolarHBondContact O-CD 3.35Å
566	A	89.6	Confident	90.8	Very high	96 Å²	96	49.1 Å²	49.1	79%	0.793	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.6	-178.2	0	0	0	0	0	112.1	D564	D564-A566 PolarHBondContact O-N 3.02Å; D564-A566 WeakPolarHBondContact OD1-CB 3.31Å; D564-A566 PolarHBondContact OD1-N 3.17Å
567	T	91	Very high	90.8	Very high	84 Å²	84	52.2 Å²	52.2	52%	0.515	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-12.1	177	58.6	0	0	0	0	113.2	D564 V569	D564-T567 WeakPolarHBondContact CB-OG1 3.47Å; D564-T567 PolarHBondContact O-N 3.27Å; D564-T567 PolarHBondContact OD1-N 3.02Å; T567-V569 PolarHBondContact O-N 3.06Å; T567-V569 PolarHBondContact OG1-N 2.64Å
568	S	89.6	Confident	90.6	Very high	82 Å²	82	55.3 Å²	55.3	57%	0.573	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	24.3	-169.1	-61.3	0	0	0	0	113.9	D564	D564-S568 VanDerWaalsContact O-CA 3.3Å; D564-S568 WeakPolarHBondContact O-CA 3.44Å; D564-S568 PolarHBondContact O-N 3.3Å
569	V	91.5	Very high	90.5	Very high	72 Å²	72	54.3 Å²	54.3	44%	0.436	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.5	-179.9	-179.2	0	0	0	0	110.5	D564 T567 T571	D564-V569 PolarHBondContact N-O 2.79Å; T567-V569 PolarHBondContact O-N 3.06Å; T567-V569 PolarHBondContact OG1-N 2.64Å; V569-T571 HydrophobicContact CG1-CG2 3.88Å
570	L	92	Very high	90.5	Very high	46 Å²	46	53.5 Å²	53.5	24%	0.241	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.9	169.8	-162.9	74.8	0	0	0	109.3	Q527 I561 C562 F563	Q527-L570 WeakPolarHBondContact O-CD2 3.48Å; I561-L570 HydrophobicContact CG2-CD1 3.41Å; I561-L570 VanDerWaalsContact CG2-CD1 3.41Å; I561-L570 HydrophobicContact CG2-CD2 3.86Å; I561-L570 HydrophobicContact CG2-CG 3.55Å; C562-L570 WeakPolarHBondContact O-CA 3.44Å; F563-L570 HydrophobicContact CB-CD1 3.71Å; F563-L570 HydrophobicContact CD2-CD1 4.11Å; F563-L570 HydrophobicContact CG-CD1 4.39Å
571	T	92.5	Very high	90.3	Very high	66 Å²	66	53.4 Å²	53.4	41%	0.405	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.4	179.1	55.4	0	0	0	0	110.8	C562 V569	C562-T571 PolarHBondContact N-O 2.82Å; C562-T571 PolarHBondContact O-N 2.7Å; C562-T571 PolarHBondContact O-OG1 2.8Å; V569-T571 HydrophobicContact CG1-CG2 3.88Å
572	G	87.9	Confident	90.1	Very high	60 Å²	60	54.8 Å²	54.8	62%	0.619	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	141.9	165.8	0	0	0	0	0	111	I560	I560-G572 WeakPolarHBondContact O-CA 3.33Å
573	D	85.2	Confident	89.9	Confident	63 Å²	63	55.3 Å²	55.3	34%	0.337	33%	0.329	S	S	.	.			trans	-109	-178.2	173.2	-143.5	-59.9	0	0	0	110.9	Y333 I560 G575	Y333-D573 PolarHBondContact OH-OD1 3.27Å; Y333-D573 PolarHBondContact OH-OD2 3.34Å; Y333-D573 VanDerWaalsContact OH-OD2 3.09Å; I560-D573 HydrophobicContact CB-CB 4.04Å; I560-D573 HydrophobicContact CG2-CB 3.93Å; I560-D573 PolarHBondContact O-N 3.12Å; D573-G575 PolarHBondContact O-N 3.24Å
574	R	83.3	Confident	89.8	Confident	190 Å²	190	55.7 Å²	55.7	72%	0.717	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-60.3	136.1	171.4	-67.7	-174.3	176	-167.6	0	110	I560	I560-R574 WeakPolarHBondContact CD1-O 3.22Å; I560-R574 WeakPolarHBondContact CG1-O 3.28Å
575	G	86.9	Confident	89.7	Confident	34 Å²	34	55.3 Å²	55.3	35%	0.351	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-58.5	155.3	177.3	0	0	0	0	0	113.3	D558 D573	D558-G575 CarbonylContact O-C 3.11Å; D558-G575 VanDerWaalsContact O-CA 3.28Å; D558-G575 WeakPolarHBondContact O-CA 3.33Å; D573-G575 PolarHBondContact O-N 3.24Å
576	M	90.8	Very high	89.9	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.039	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-61.1	157.2	169.8	-59.4	-169.7	-68.8	0	0	110.7	V315 W340 L547 G548 S557 D558 I560 R578 I580	V315-M576 HydrophobicContact CG2-SD 4.44Å; W340-M576 HydrophobicContact CH2-CB 4.17Å; W340-M576 HydrophobicContact CH2-CG 3.77Å; W340-M576 HydrophobicContact CH2-SD 4.24Å; W340-M576 HydrophobicContact CZ2-CB 3.95Å; W340-M576 HydrophobicContact CZ2-CG 3.65Å; L547-M576 HydrophobicContact CB-SD 3.91Å; L547-M576 HydrophobicContact CD2-CG 4.44Å; L547-M576 HydrophobicContact CD2-SD 4.07Å; G548-M576 VanDerWaalsContact CA-CE 3.47Å; S557-M576 WeakPolarHBondContact O-CE 3.12Å; D558-M576 HydrophobicContact CB-CB 4.36Å; D558-M576 WeakPolarHBondContact O-CG 3.23Å; D558-M576 PolarHBondContact O-N 3.07Å; I560-M576 HydrophobicContact CD1-CG 3.98Å; I560-M576 HydrophobicContact CG1-CG 3.82Å; M576-R578 PolarHBondContact O-N 3.07Å; M576-I580 HydrophobicContact CE-CD1 4.2Å; M576-I580 HydrophobicContact CE-CG1 3.49Å; M576-I580 VanDerWaalsContact CE-CG1 3.49Å; M576-I580 HydrophobicContact SD-CD1 4.17Å; M576-I580 HydrophobicContact SD-CG1 4.12Å
577	P	88.8	Confident	90.1	Very high	82 Å²	82	50.8 Å²	50.8	53%	0.532	30%	0.295	S	S	.	.	S	Bend	trans	-61.6	-15.7	177.9	-23.7	34.4	0	0	0	114.3	W340	W340-P577 HydrophobicContact CB-CG 4.02Å; W340-P577 VanDerWaalsContact CD2-CD 3.47Å; W340-P577 HydrophobicContact CD2-CG 3.73Å; W340-P577 VanDerWaalsContact CE2-CD 3.49Å; W340-P577 HydrophobicContact CE3-CG 4.1Å; W340-P577 HydrophobicContact CG-CG 3.69Å
578	R	87.9	Confident	90.1	Very high	101 Å²	101	46.9 Å²	46.9	38%	0.381	27%	0.271	S	S	.	.	S	Bend	trans	-149.2	145.3	-178.9	-60	176.7	-174.2	-96.1	-8.3	110.2	E320 M576 I580	E320-R578 IonicContact OE1-NH1 3.56Å; M576-R578 PolarHBondContact O-N 3.07Å; R578-I580 HydrophobicContact CB-CG2 4.3Å
579	P	90.3	Very high	90.1	Very high	56 Å²	56	43.9 Å²	43.9	36%	0.364	25%	0.247	S	C	.	.			trans	-73.2	124	167.3	29.2	-32.2	0	0	0	110.8	A556 S557 D558	A556-P579 HydrophobicContact CB-CB 4.14Å; A556-P579 WeakPolarHBondContact O-CB 3.32Å; S557-P579 WeakPolarHBondContact O-CA 3.49Å; D558-P579 HydrophobicContact CB-CB 4.25Å
580	I	90.9	Very high	89.8	Confident	16 Å²	16	43.2 Å²	43.2	8%	0.082	24%	0.237	C	C	.	.			trans	-146.2	140	-175.2	49.7	174.3	0	0	0	113.9	V315 E320 L327 G549 S557 M576 R578 H583	V315-I580 HydrophobicContact CG1-CD1 3.48Å; V315-I580 VanDerWaalsContact CG1-CD1 3.48Å; E320-I580 HydrophobicContact CG-CG2 4.49Å; L327-I580 HydrophobicContact CD1-CG2 3.83Å; G549-I580 PolarHBondContact N-O 3.22Å; S557-I580 PolarHBondContact O-N 2.93Å; M576-I580 HydrophobicContact CE-CD1 4.2Å; M576-I580 HydrophobicContact CE-CG1 3.49Å; M576-I580 VanDerWaalsContact CE-CG1 3.49Å; M576-I580 HydrophobicContact SD-CD1 4.17Å; M576-I580 HydrophobicContact SD-CG1 4.12Å; R578-I580 HydrophobicContact CB-CG2 4.3Å; I580-H583 HydrophobicContact CD1-CB 4.27Å; I580-H583 PolarHBondContact O-CE1 3.12Å; I580-H583 PolarHBondContact O-ND1 3.3Å
581	C	90.2	Very high	89.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-123	165.8	172.2	61	0	0	0	0	111.6	G318 C319 Q550 A556 H583	G318-C581 CarbonylContact C-O 3.55Å; G318-C581 VanDerWaalsContact CA-O 3.28Å; G318-C581 WeakPolarHBondContact CA-O 3.42Å; C319-C581 PolarHBondContact N-O 2.72Å; C319-C581 PolarHBondContact O-N 2.96Å; C319-C581 PolarHBondContact O-SG 3.3Å; C319-C581 VanDerWaalsContact O-SG 3.32Å; Q550-C581 HydrophobicContact CB-CB 4.03Å; Q550-C581 HydrophobicContact CG-CB 4.49Å; Q550-C581 PolarHBondContact OE1-SG 3.3Å; A556-C581 HydrophobicContact CB-CB 4.33Å; C581-H583 PolarHBondContact O-N 3.02Å; C581-H583 VanDerWaalsContact O-N 3.12Å
582	Y	89	Confident	88.3	Confident	39 Å²	39	43.9 Å²	43.9	15%	0.153	23%	0.231	C	C	.	.	S	Bend	trans	57.3	22	-177.2	-55.5	-87.1	0	0	0	115.1	E353 S534 Q550	E353-Y582 HydrophobicContact CG-CD1 3.89Å; E353-Y582 HydrophobicContact CG-CE1 4.31Å; S534-Y582 PolarHBondContact O-N 3.12Å; S534-Y582 WeakPolarHBondContact OG-CE1 3.37Å; Q550-Y582 PolarHBondContact NE2-OH 2.72Å
583	H	91.5	Very high	86.9	Confident	14 Å²	14	47.2 Å²	47.2	7%	0.065	24%	0.235	C	C	.	.			trans	-80.5	156.1	174.9	60.2	-101.7	0	0	0	111.5	V315 V316 G317 G536 L547 I580 C581	V315-H583 HydrophobicContact CG1-CB 3.86Å; V316-H583 WeakPolarHBondContact O-CA 3.26Å; V316-H583 WeakPolarHBondContact O-CB 3.34Å; G317-H583 VanDerWaalsContact O-CB 3.31Å; G317-H583 WeakPolarHBondContact O-CB 3.38Å; G536-H583 VanDerWaalsContact CA-NE2 3.31Å; G536-H583 WeakPolarHBondContact CA-NE2 3.26Å; G536-H583 PolarHBondContact N-NE2 3.3Å; G536-H583 VanDerWaalsContact N-NE2 3.13Å; L547-H583 PolarHBondContact O-CE1 2.87Å; L547-H583 PolarHBondContact O-NE2 3.05Å; I580-H583 HydrophobicContact CD1-CB 4.27Å; I580-H583 PolarHBondContact O-CE1 3.12Å; I580-H583 PolarHBondContact O-ND1 3.3Å; C581-H583 PolarHBondContact O-N 3.02Å; C581-H583 VanDerWaalsContact O-N 3.12Å
584	G	91.1	Very high	85.4	Confident	9 Å²	9	49.6 Å²	49.6	9%	0.093	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	146.3	164	0	0	0	0	0	111.1	V315 V316	V315-G584 WeakPolarHBondContact CA-O 3.32Å; V316-G584 PolarHBondContact N-O 2.77Å; V316-G584 PolarHBondContact O-N 3.46Å
585	C	93.1	Very high	83.2	Confident	17 Å²	17	46.8 Å²	46.8	12%	0.115	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	123.3	177.6	-171.9	0	0	0	0	109.9	I313 V314	I313-C585 WeakPolarHBondContact CG2-SG 3.2Å; V314-C585 WeakPolarHBondContact O-CA 3.33Å
586	V	94.8	Very high	80.5	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.055	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	153.6	-175.7	-64.3	0	0	0	0	110.6	I313 V314 V356 A358 I363 S538	I313-V586 CarbonylContact C-O 3.58Å; V314-V586 HydrophobicContact CB-CG2 4.19Å; V314-V586 PolarHBondContact N-O 3.17Å; V314-V586 PolarHBondContact O-N 2.79Å; V314-V586 VanDerWaalsContact O-N 3.11Å; V356-V586 HydrophobicContact CG1-CG1 3.86Å; V356-V586 HydrophobicContact CG1-CG2 4.42Å; A358-V586 HydrophobicContact CB-CB 4.03Å; A358-V586 HydrophobicContact CB-CG1 4.43Å; A358-V586 HydrophobicContact CB-CG2 4.48Å; I363-V586 HydrophobicContact CB-CG2 4.46Å; I363-V586 HydrophobicContact CD1-CG2 3.6Å; I363-V586 HydrophobicContact CG1-CG2 3.77Å; I363-V586 HydrophobicContact CG2-CG2 3.91Å; S538-V586 WeakPolarHBondContact OG-CA 3.32Å
587	T	93.6	Very high	77.9	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.117	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.6	173.5	-58.3	0	0	0	0	110.8	E311 V312 S538 V539 A540	E311-T587 HydrophobicContact CB-CG2 4.13Å; E311-T587 HydrophobicContact CG-CG2 4.42Å; V312-T587 WeakPolarHBondContact O-CA 3.25Å; S538-T587 PolarHBondContact OG-N 2.92Å; S538-T587 PolarHBondContact OG-OG1 3.18Å; V539-T587 VanDerWaalsContact O-CB 3.26Å; V539-T587 WeakPolarHBondContact O-CB 3.2Å; V539-T587 WeakPolarHBondContact O-CG2 3.14Å; V539-T587 PolarHBondContact O-OG1 2.71Å; A540-T587 HydrophobicContact CB-CG2 4.17Å
588	I	91.9	Very high	77.3	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	158.8	168.4	66.5	175.5	0	0	0	109.8	V312 V314 A358 N361 I363 Y378	V312-I588 HydrophobicContact CG2-CD1 4.47Å; V312-I588 HydrophobicContact CG2-CG1 3.76Å; V312-I588 PolarHBondContact N-O 2.75Å; V312-I588 PolarHBondContact O-N 2.71Å; V314-I588 HydrophobicContact CG2-CD1 3.73Å; V314-I588 HydrophobicContact CG2-CG1 3.79Å; A358-I588 HydrophobicContact CB-CG2 4.36Å; N361-I588 WeakPolarHBondContact O-CG2 3.32Å; I363-I588 HydrophobicContact CD1-CD1 4.37Å; I363-I588 HydrophobicContact CD1-CG2 4.07Å; I363-I588 HydrophobicContact CG1-CG2 3.82Å; Y378-I588 HydrophobicContact CE1-CD1 4.4Å
589	H	88.9	Confident	76.8	Confident	18 Å²	18	59.2 Å²	59.2	8%	0.083	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123	165.5	-58.8	106.6	0	0	0	109.2	N294 Y309 S310 E311 N361	N294-H589 PolarHBondContact ND2-CE1 3.29Å; N294-H589 PolarHBondContact ND2-ND1 3.32Å; N294-H589 VanDerWaalsContact ND2-ND1 3.16Å; N294-H589 PolarHBondContact OD1-CE1 3.29Å; N294-H589 VanDerWaalsContact OD1-CE1 3.31Å; N294-H589 PolarHBondContact OD1-ND1 2.85Å; Y309-H589 HydrophobicContact CD1-CB 4.45Å; S310-H589 WeakPolarHBondContact O-CA 3.49Å; E311-H589 WeakPolarHBondContact CG-CD2 3.41Å; E311-H589 VanDerWaalsContact CG-NE2 3.31Å; E311-H589 WeakPolarHBondContact CG-NE2 3.27Å; E311-H589 IonicContact OE1-CD2 3.85Å; E311-H589 IonicContact OE1-CE1 2.71Å; E311-H589 IonicContact OE1-NE2 2.68Å; E311-H589 PolarHBondContact OE1-NE2 3.4Å; N361-H589 PolarHBondContact ND2-O 3.15Å; N361-H589 WeakPolarHBondContact OD1-CA 3.46Å; N361-H589 PolarHBondContact OD1-N 2.96Å; N361-H589 PolarHBondContact OD1-O 3Å
590	R	85.1	Confident	76	Confident	58 Å²	58	59.4 Å²	59.4	22%	0.219	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.9	177.1	-176.1	178.8	179.2	89.5	-2.7	109.9	Y309 S310 V312 L343 C592	Y309-R590 WeakPolarHBondContact CA-O 3.34Å; S310-R590 PolarHBondContact N-O 3.3Å; S310-R590 PolarHBondContact O-N 2.96Å; V312-R590 HydrophobicContact CG1-CB 4.19Å; V312-R590 HydrophobicContact CG2-CB 3.58Å; L343-R590 VanDerWaalsContact CD2-NH1 3.26Å; R590-C592 PolarHBondContact O-N 3.48Å
591	Y	82.6	Confident	75.1	Confident	114 Å²	114	61.9 Å²	61.9	45%	0.447	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	115	166.7	-178.2	-101.1	0	0	0	109.3	Y309 D593	Y309-Y591 HydrophobicContact CD2-CD2 4.12Å; Y309-Y591 AromaticContact CE2-CD2 3.92Å; Y309-Y591 HydrophobicContact CE2-CD2 3.92Å; Y591-D593 WeakPolarHBondContact CE1-OD1 3.46Å; Y591-D593 PolarHBondContact OH-OD1 3.39Å
592	C	69.8	Low	74.2	Confident	12 Å²	12	65.8 Å²	65.8	8%	0.081	34%	0.339	C	S	.	.			trans	-99.8	112.8	172.4	-75	0	0	0	0	107.8	G308 R590 K594	G308-C592 PolarHBondContact O-N 2.98Å; R590-C592 PolarHBondContact O-N 3.48Å; C592-K594 VanDerWaalsContact C-N 3.3Å; C592-K594 PolarHBondContact O-N 3.13Å
593	D	58.2	Low	73.2	Confident	130 Å²	130	67.6 Å²	67.6	70%	0.695	35%	0.352	S	S	*	.			trans	-58.6	95.1	167.4	-83.8	-56.3	0	0	0	109.8	Y591	Y591-D593 WeakPolarHBondContact CE1-OD1 3.46Å; Y591-D593 PolarHBondContact OH-OD1 3.39Å
594	K	53.8	Low	71.9	Confident	114 Å²	114	71.4 Å²	71.4	50%	0.496	37%	0.372	S	S	.	.			trans	-85.7	108.2	159.7	-67.7	179	-174.3	168.7	0	105.7	R305 C592 K596	R305-K594 PolarHBondContact O-NZ 2.77Å; R305-K594 VanDerWaalsContact O-NZ 3.17Å; C592-K594 VanDerWaalsContact C-N 3.3Å; C592-K594 PolarHBondContact O-N 3.13Å; K594-K596 PolarHBondContact O-N 3.23Å
595	T	37.5	Very low	70.4	Confident	131 Å²	131	76.2 Å²	76.2	80%	0.804	39%	0.394	S	S	*	.			trans	-45.5	131.2	156.3	46	0	0	0	0	107.8
596	K	31.3	Very low	68.5	Low	179 Å²	179	81.2 Å²	81.2	78%	0.778	42%	0.417	S	S	*	.			trans	-48.3	136.9	177.1	-72.6	-174.3	174.5	-171.9	0	109.4	K594	K594-K596 PolarHBondContact O-N 3.23Å
597	P	34.8	Very low	66.1	Low	188 Å²	188	87.7 Å²	87.7	100%	1.221	45%	0.45	S	S	*	.			trans	-61.5	0	173.7	29.5	-35.6	0	0	0	111.5

Retrieved 597 of 597 residues in 834.7 ms (Link to these results)

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