A0A087YSP1_POEFO Loading...

Suppressor of cytokine signaling 2

Substrate-recognition component of a cullin-5-RING E3 ubiquitin-protein ligase complex (ECS complex, also named CRL5 complex), which mediates the ubiquitination and subsequent proteasomal degradation of target proteins, such as EPOR and GHR. Specifically recognizes and binds phosphorylated proteins via its SH2 domain, promoting their ubiquitination. The ECS(SOCS2) complex acts as a key regulator of growth hormone receptor (GHR) levels by mediating ubiquitination and degradation of GHR, following GHR phosphorylation by JAK2. The ECS(SOCS2) also catalyzes ubiquitination and degradation of JAK2-phosphorylated EPOR.

AlphaFold DB , UniProt , Accession A0A087YSP1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 227 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	33.2	Very low	247 Å²	247	145.6 Å²	145.6	100%	1.217	81%	0.81	S	S	*	*				0	93.3	0	-152.4	123.2	114.3	0	0	107
2	A	41.2	Very low	33.1	Very low	94 Å²	94	140 Å²	140	78%	0.777	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-86.2	137.2	-176.2	0	0	0	0	0	110.1
3	P	35.2	Very low	32.9	Very low	125 Å²	125	138.6 Å²	138.6	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.7	133.8	179.6	28.5	-32.2	0	0	0	111
4	K	34.7	Very low	33.2	Very low	199 Å²	199	138.5 Å²	138.5	87%	0.865	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.1	139.9	171.9	-77	176.6	175.5	172.5	0	110
5	P	35.2	Very low	33.2	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-72	152.8	173.3	30.4	-33.4	0	0	0	111.3
6	P	33	Very low	33.3	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-71.1	135.2	-178.2	28.3	-33.1	0	0	0	111.6	S8	P6-S8 PolarHBondContact O-N 2.84Å
7	V	32.3	Very low	33.8	Very low	132 Å²	132	131 Å²	131	80%	0.8	74%	0.739	S	S	*	*			trans	-76	100.2	171.6	-169.5	0	0	0	0	107.4	V9	V7-V9 PolarHBondContact O-N 3.34Å
8	S	29.8	Very low	34.6	Very low	89 Å²	89	129.3 Å²	129.3	62%	0.622	73%	0.732	S	S	*	*			trans	-74.1	105.3	173.5	-165.8	0	0	0	0	108.9	P6 F10	P6-S8 PolarHBondContact O-N 2.84Å; S8-F10 PolarHBondContact O-N 2.77Å; S8-F10 VanDerWaalsContact O-N 3.16Å
9	V	31	Very low	35.2	Very low	110 Å²	110	124.2 Å²	124.2	67%	0.667	70%	0.703	S	S	*	*			trans	-80.3	91.1	173.5	-172.3	0	0	0	0	107.3	V7 F11	V7-V9 PolarHBondContact O-N 3.34Å; V9-F11 HydrophobicContact CG1-CD2 4.29Å; V9-F11 HydrophobicContact CG1-CE2 4.47Å; V9-F11 PolarHBondContact O-N 3.33Å; V9-F11 VanDerWaalsContact O-N 3.08Å
10	F	29.6	Very low	35.8	Very low	178 Å²	178	120.5 Å²	120.5	78%	0.781	68%	0.68	S	S	*	*			trans	-69.7	103.4	170.7	-93.2	-90.7	0	0	0	109.4	S8 C12	S8-F10 PolarHBondContact O-N 2.77Å; S8-F10 VanDerWaalsContact O-N 3.16Å; F10-C12 VanDerWaalsContact C-N 3.35Å; F10-C12 PolarHBondContact O-N 3.23Å
11	F	25.6	Very low	36.3	Very low	192 Å²	192	118.7 Å²	118.7	84%	0.842	68%	0.675	S	S	*	*			trans	-69.8	94	162.8	-105.2	-96.8	0	0	0	108.4	V9	V9-F11 HydrophobicContact CG1-CD2 4.29Å; V9-F11 HydrophobicContact CG1-CE2 4.47Å; V9-F11 PolarHBondContact O-N 3.33Å; V9-F11 VanDerWaalsContact O-N 3.08Å
12	C	32.2	Very low	36.8	Very low	78 Å²	78	115.9 Å²	115.9	53%	0.527	65%	0.651	S	S	.	*			trans	-91.9	99	170.4	-161.6	0	0	0	0	107.9	F10 R14	F10-C12 VanDerWaalsContact C-N 3.35Å; F10-C12 PolarHBondContact O-N 3.23Å; C12-R14 HydrophobicContact CB-CG 4.01Å; C12-R14 PolarHBondContact O-N 3.32Å; C12-R14 WeakPolarHBondContact SG-CG 3.44Å; C12-R14 PolarHBondContact SG-NE 3.4Å
13	S	31.1	Very low	36.9	Very low	122 Å²	122	114.9 Å²	114.9	85%	0.853	63%	0.629	S	S	*	*			trans	-59.6	100.7	163	-74.1	0	0	0	0	108
14	R	36.4	Very low	37.4	Very low	137 Å²	137	111.9 Å²	111.9	52%	0.517	60%	0.604	S	S	.	*			trans	-102.2	110.7	-174.7	-77.7	-178.2	174	-142.1	1.2	111.5	C12 W77	C12-R14 HydrophobicContact CB-CG 4.01Å; C12-R14 PolarHBondContact O-N 3.32Å; C12-R14 WeakPolarHBondContact SG-CG 3.44Å; C12-R14 PolarHBondContact SG-NE 3.4Å; R14-W77 PolarHBondContact NH1-O 2.94Å
15	S	33.9	Very low	37.6	Very low	112 Å²	112	104.8 Å²	104.8	78%	0.783	59%	0.587	S	S	*	*			trans	-65.5	166.8	166.2	-162.1	0	0	0	0	111.6
16	L	34.1	Very low	38.3	Very low	143 Å²	143	103.2 Å²	103.2	75%	0.749	59%	0.591	S	S	*	*			trans	-50.3	152.3	179.4	-82.8	98.6	0	0	0	112.7	T18	L16-T18 PolarHBondContact O-N 3.39Å
17	P	42.1	Very low	38.3	Very low	33 Å²	33	106.2 Å²	106.2	21%	0.214	59%	0.591	C	S	.	*			trans	-58.4	114.5	171.1	27.3	-35.6	0	0	0	109.6	N19 L20 M67	P17-N19 PolarHBondContact O-N 3.21Å; P17-L20 PolarHBondContact O-N 3.41Å; P17-M67 HydrophobicContact CB-CE 4.29Å; P17-M67 HydrophobicContact CG-CE 3.77Å
18	T	48.9	Very low	38.3	Very low	100 Å²	100	107.2 Å²	107.2	61%	0.613	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-2.1	177.8	49.1	0	0	0	0	113.6	L16 S21	L16-T18 PolarHBondContact O-N 3.39Å; T18-S21 PolarHBondContact O-OG 3.18Å
19	N	45.6	Very low	38.5	Very low	33 Å²	33	110.2 Å²	110.2	18%	0.176	60%	0.599	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-19	-180	-86.4	-43	0	0	0	114.1	P17 S21 R22 F23 S102	P17-N19 PolarHBondContact O-N 3.21Å; N19-S21 VanDerWaalsContact C-N 3.35Å; N19-R22 PolarHBondContact O-N 3.41Å; N19-R22 VanDerWaalsContact O-N 3.17Å; N19-F23 PolarHBondContact O-N 2.61Å; N19-S102 PolarHBondContact ND2-O 3.5Å
20	L	46	Very low	38.3	Very low	50 Å²	50	109.3 Å²	109.3	26%	0.262	60%	0.597	S	S	.	*	H	α-helix	trans	-68.1	-38.6	179.8	-157.9	72.4	0	0	0	111.2	P17 R22 F23 F24 V63	P17-L20 PolarHBondContact O-N 3.41Å; L20-R22 PolarHBondContact O-N 2.81Å; L20-F23 PolarHBondContact O-N 3.28Å; L20-F24 HydrophobicContact CD1-CD2 4.26Å; L20-F24 HydrophobicContact CD1-CE2 4.29Å; L20-F24 HydrophobicContact CG-CD2 4.49Å; L20-F24 PolarHBondContact O-N 3.4Å; L20-V63 HydrophobicContact CD1-CB 4.35Å; L20-V63 HydrophobicContact CD1-CG1 3.43Å; L20-V63 VanDerWaalsContact CD1-CG1 3.43Å
21	S	47.8	Very low	38.5	Very low	82 Å²	82	106.7 Å²	106.7	57%	0.573	60%	0.597	S	S	*	*	H	α-helix	trans	-67.3	-19.2	173.6	45	0	0	0	0	114	T18 N19 G25	T18-S21 PolarHBondContact O-OG 3.18Å; N19-S21 VanDerWaalsContact C-N 3.35Å; S21-G25 PolarHBondContact O-N 3.32Å
22	R	48.3	Very low	38.7	Very low	188 Å²	188	105.7 Å²	105.7	71%	0.709	60%	0.597	S	S	*	*	H	α-helix	trans	-86.6	-23.3	177.1	-70.8	-179.1	172.9	179.3	-2.5	113.5	N19 L20	N19-R22 PolarHBondContact O-N 3.41Å; N19-R22 VanDerWaalsContact O-N 3.17Å; L20-R22 PolarHBondContact O-N 2.81Å
23	F	41.8	Very low	38.8	Very low	73 Å²	73	108.8 Å²	108.8	32%	0.32	61%	0.614	S	S	.	*	H	α-helix	trans	-92.6	-26	-177.4	-133.6	-90.2	0	0	0	112.5	N19 L20 R105 L108	N19-F23 PolarHBondContact O-N 2.61Å; L20-F23 PolarHBondContact O-N 3.28Å; F23-R105 WeakPolarHBondContact CE2-O 3.49Å; F23-L108 HydrophobicContact CB-CD2 3.92Å; F23-L108 HydrophobicContact CD1-CD2 4.06Å; F23-L108 HydrophobicContact CD2-CD2 3.44Å; F23-L108 VanDerWaalsContact CD2-CD2 3.44Å; F23-L108 HydrophobicContact CD2-CG 4.24Å; F23-L108 HydrophobicContact CE1-CD2 4.44Å; F23-L108 HydrophobicContact CE2-CD2 3.86Å; F23-L108 HydrophobicContact CE2-CG 4.16Å; F23-L108 HydrophobicContact CG-CD2 3.54Å; F23-L108 HydrophobicContact CG-CG 4.42Å; F23-L108 HydrophobicContact CZ-CD2 4.35Å; F23-L108 HydrophobicContact CZ-CG 4.31Å
24	F	46.7	Very low	38.8	Very low	62 Å²	62	108 Å²	108	27%	0.272	61%	0.607	S	S	.	*	S	Bend	trans	-122.8	13.4	-174.8	-67.8	-78.6	0	0	0	114.4	L20 D59 E60 V63	L20-F24 HydrophobicContact CD1-CD2 4.26Å; L20-F24 HydrophobicContact CD1-CE2 4.29Å; L20-F24 HydrophobicContact CG-CD2 4.49Å; L20-F24 PolarHBondContact O-N 3.4Å; F24-D59 HydrophobicContact CE1-CB 4.22Å; F24-D59 HydrophobicContact CZ-CB 4.4Å; F24-E60 HydrophobicContact CD1-CB 4.38Å; F24-E60 HydrophobicContact CE1-CB 4.33Å; F24-V63 HydrophobicContact CE2-CG2 4.22Å; F24-V63 HydrophobicContact CZ-CG2 4.24Å
25	G	38.3	Very low	38.6	Very low	50 Å²	50	110.4 Å²	110.4	52%	0.515	62%	0.624	S	S	.	*			trans	-141.3	82.6	-170.3	0	0	0	0	0	115.4	S21	S21-G25 PolarHBondContact O-N 3.32Å
26	G	49.1	Very low	38.4	Very low	76 Å²	76	110 Å²	110	78%	0.784	62%	0.621	S	S	*	*			trans	-89.1	94	141.7	0	0	0	0	0	108.6
27	F	34.2	Very low	38.4	Very low	190 Å²	190	108.2 Å²	108.2	83%	0.833	62%	0.621	S	S	*	*			trans	-165.2	95.2	148.8	-123.4	-89.2	0	0	0	108.2	I29	F27-I29 PolarHBondContact O-N 3.3Å
28	L	31.6	Very low	38	Very low	154 Å²	154	115.3 Å²	115.3	81%	0.806	65%	0.652	S	S	*	*			trans	-72.2	105.4	165.9	-163.2	77.3	0	0	0	106.4	C30	L28-C30 VanDerWaalsContact C-N 3.29Å; L28-C30 PolarHBondContact O-N 3.19Å
29	I	33.7	Very low	37.2	Very low	151 Å²	151	116.4 Å²	116.4	77%	0.774	66%	0.663	S	S	*	*			trans	-73.6	91.3	170.1	-54.3	174.8	0	0	0	106.8	F27	F27-I29 PolarHBondContact O-N 3.3Å
30	C	27.8	Very low	36.9	Very low	92 Å²	92	123.9 Å²	123.9	62%	0.622	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-73.2	124.1	159.4	-77.5	0	0	0	0	108.2	L28 M32	L28-C30 VanDerWaalsContact C-N 3.29Å; L28-C30 PolarHBondContact O-N 3.19Å; C30-M32 PolarHBondContact O-N 3Å
31	P	34	Very low	36.3	Very low	123 Å²	123	130.5 Å²	130.5	80%	0.799	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-70.8	118.3	167.4	26.7	-29.1	0	0	0	109.6
32	M	28.9	Very low	35.6	Very low	171 Å²	171	130.7 Å²	130.7	84%	0.842	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-64.7	134.5	169.3	-95.7	-83.8	-174	0	0	111.2	C30	C30-M32 PolarHBondContact O-N 3Å
33	T	35.6	Very low	35.1	Very low	143 Å²	143	128.8 Å²	128.8	88%	0.877	74%	0.735	S	S	*	*			trans	-111.8	122.9	148.2	2.1	0	0	0	0	108.1
34	C	29.9	Very low	35.1	Very low	105 Å²	105	134 Å²	134	71%	0.709	76%	0.761	S	S	*	*			trans	-68	148.8	-173.8	-48.4	0	0	0	0	113.3
35	Q	31.5	Very low	34.4	Very low	187 Å²	187	139 Å²	139	87%	0.874	79%	0.79	S	S	*	*				-175	126.8	122.5	-101.8	172	49.8	0	0	114
36	S	29.9	Very low	34.8	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	79%	0.792	S	S	*	*			trans	85.4	127	136.4	-52.8	0	0	0	0	123.4
37	S	34.5	Very low	34.8	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	80%	0.8	S	S	*	*			trans	98	113	140.5	-60.8	0	0	0	0	121.4
38	E	35.2	Very low	35.1	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	80%	0.802	S	S	*	*			trans	19.2	139.4	145.4	-62.2	166.2	118.4	0	0	119.5
39	S	30.8	Very low	35.8	Very low	123 Å²	123	140.7 Å²	140.7	86%	0.86	80%	0.804	S	S	*	*				-167.5	167.4	53.3	-53.5	0	0	0	0	112.4
40	Q	40.2	Very low	36.4	Very low	190 Å²	190	138.9 Å²	138.9	89%	0.888	80%	0.796	S	S	*	*			trans	-80.8	154.9	-176.5	-67.1	170.8	-58.2	0	0	116.4
41	E	31.9	Very low	37.3	Very low	189 Å²	189	141.1 Å²	141.1	88%	0.883	80%	0.801	S	S	*	*			trans	161	115.4	133.7	-89	-172.4	170.9	0	0	108.1
42	A	32.9	Very low	38	Very low	85 Å²	85	137.3 Å²	137.3	70%	0.702	78%	0.784	S	S	*	*				110.3	131	66.4	0	0	0	0	0	111.9
43	I	39.3	Very low	39.1	Very low	148 Å²	148	132.5 Å²	132.5	76%	0.759	77%	0.772	S	S	*	*			trans	94.8	112.9	155.9	-54.5	165.3	0	0	0	120.2
44	E	40.8	Very low	39.8	Very low	183 Å²	183	134.5 Å²	134.5	86%	0.855	76%	0.763	S	S	*	*			trans	31.3	124	140.4	-56.6	173.6	157	0	0	121.4
45	D	32.5	Very low	41.2	Very low	167 Å²	167	132.4 Å²	132.4	89%	0.893	75%	0.747	S	S	*	*				-161.8	147.8	113.8	-150.7	-5.8	0	0	0	111.5
46	A	47.3	Very low	42.6	Very low	67 Å²	67	129.5 Å²	129.5	55%	0.554	73%	0.734	S	S	*	*			trans	-101.3	160	-170.5	0	0	0	0	0	112.2
47	R	47.5	Very low	44.2	Very low	252 Å²	252	131.9 Å²	131.9	95%	0.951	73%	0.733	S	S	*	*			trans	81.2	104	154.4	-54.9	166.1	-171.8	-174.8	2.7	116.8
48	G	42.2	Very low	46.3	Very low	84 Å²	84	129.9 Å²	129.9	87%	0.866	72%	0.72	S	S	*	*			trans	153	51.7	153.2	0	0	0	0	0	116.2
49	A	45.3	Very low	48.7	Very low	103 Å²	103	122.5 Å²	122.5	85%	0.851	69%	0.686	S	S	*	*			trans	-154.6	66.8	174.1	0	0	0	0	0	111.8
50	D	45.8	Very low	51.4	Low	113 Å²	113	121.1 Å²	121.1	60%	0.604	67%	0.666	S	S	*	*	S	Bend	trans	-137.8	-2.3	172	-163.2	46.3	0	0	0	114.5
51	D	48.1	Very low	53.7	Low	139 Å²	139	115.2 Å²	115.2	74%	0.743	65%	0.646	S	S	*	*	S	Bend	trans	-97.7	-18	-177.6	-157.7	55.3	0	0	0	114	T55	D51-T55 PolarHBondContact O-OG1 2.93Å
52	G	48.5	Very low	56.4	Low	42 Å²	42	110.8 Å²	110.8	43%	0.433	62%	0.621	S	S	.	*	H	α-helix	trans	-78.6	-42.5	-178.9	0	0	0	0	0	114.1	R54 T55 E56	G52-R54 PolarHBondContact O-N 2.98Å; G52-T55 PolarHBondContact O-N 2.93Å; G52-E56 WeakPolarHBondContact O-CG 3.46Å; G52-E56 PolarHBondContact O-N 3.21Å
53	A	51.2	Low	59.1	Low	71 Å²	71	106.8 Å²	106.8	59%	0.587	59%	0.588	S	S	*	*	H	α-helix	trans	-68	-34.8	-171.7	0	0	0	0	0	113.6	E57	A53-E57 PolarHBondContact O-N 3.25Å
54	R	51.5	Low	61.6	Low	184 Å²	184	102 Å²	102	69%	0.694	57%	0.57	S	S	*	*	H	α-helix	trans	-72.7	-29.6	178.8	-75	-178	-179.8	153.7	7.8	113.3	G52	G52-R54 PolarHBondContact O-N 2.98Å
55	T	58.9	Low	63.9	Low	61 Å²	61	95.5 Å²	95.5	37%	0.374	55%	0.545	S	S	.	.	H	α-helix	trans	-79.1	-38.4	-179	-52	0	0	0	0	110.6	D51 G52 S58 D59	D51-T55 PolarHBondContact O-OG1 2.93Å; G52-T55 PolarHBondContact O-N 2.93Å; T55-S58 WeakPolarHBondContact O-CB 3.42Å; T55-S58 PolarHBondContact O-N 2.98Å; T55-D59 WeakPolarHBondContact O-CB 3.46Å; T55-D59 PolarHBondContact O-N 2.83Å
56	E	60.5	Low	66.7	Low	126 Å²	126	87.7 Å²	87.7	59%	0.589	50%	0.503	S	S	*	.	H	α-helix	trans	-68.8	-42.3	-179.5	-70.3	179.2	-177.2	0	0	113.5	G52 S58 D59 E60	G52-E56 WeakPolarHBondContact O-CG 3.46Å; G52-E56 PolarHBondContact O-N 3.21Å; E56-S58 VanDerWaalsContact C-N 3.27Å; E56-S58 PolarHBondContact O-N 3.22Å; E56-D59 PolarHBondContact O-N 3.44Å; E56-E60 PolarHBondContact O-N 3.32Å
57	E	63.1	Low	68.8	Low	153 Å²	153	85 Å²	85	72%	0.715	48%	0.479	S	S	*	.	H	α-helix	trans	-63.3	-36.4	175.9	-172.2	179.9	-176.7	0	0	111.6	A53 S61	A53-E57 PolarHBondContact O-N 3.25Å; E57-S61 WeakPolarHBondContact O-CB 3.36Å; E57-S61 PolarHBondContact O-N 3.31Å
58	S	79	Confident	70.8	Confident	66 Å²	66	79.2 Å²	79.2	46%	0.462	46%	0.461	S	S	.	.	H	α-helix	trans	-66.5	-44.7	174.8	-157.6	0	0	0	0	111.4	T55 E56 S61 R62	T55-S58 WeakPolarHBondContact O-CB 3.42Å; T55-S58 PolarHBondContact O-N 2.98Å; E56-S58 VanDerWaalsContact C-N 3.27Å; E56-S58 PolarHBondContact O-N 3.22Å; S58-S61 WeakPolarHBondContact O-CB 3.25Å; S58-S61 PolarHBondContact O-N 3.34Å; S58-R62 VanDerWaalsContact O-CG 3.3Å; S58-R62 WeakPolarHBondContact O-CG 3.1Å; S58-R62 PolarHBondContact O-N 2.9Å
59	D	86.4	Confident	73.1	Confident	26 Å²	26	77.6 Å²	77.6	14%	0.139	43%	0.431	C	S	.	.	H	α-helix	trans	-66.5	-42.7	-178.3	-87.5	4.7	0	0	0	112.3	F24 T55 E56 S61 R62 V63 F126 G129	F24-D59 HydrophobicContact CE1-CB 4.22Å; F24-D59 HydrophobicContact CZ-CB 4.4Å; T55-D59 WeakPolarHBondContact O-CB 3.46Å; T55-D59 PolarHBondContact O-N 2.83Å; E56-D59 PolarHBondContact O-N 3.44Å; D59-S61 VanDerWaalsContact C-N 3.34Å; D59-S61 PolarHBondContact O-N 3.22Å; D59-R62 WeakPolarHBondContact O-CB 3.41Å; D59-R62 PolarHBondContact O-N 3.23Å; D59-V63 WeakPolarHBondContact O-CG2 3.3Å; D59-V63 PolarHBondContact O-N 2.88Å; D59-F126 HydrophobicContact CB-CE1 3.8Å; D59-F126 HydrophobicContact CB-CZ 4.08Å; D59-G129 WeakPolarHBondContact OD1-CA 3.44Å; D59-G129 PolarHBondContact OD1-N 3.08Å
60	E	85.6	Confident	75.3	Confident	94 Å²	94	72.7 Å²	72.7	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-62.6	-42.9	175	-173.2	168.3	-165.5	0	0	111.2	F24 E56 R62 V63 A64	F24-E60 HydrophobicContact CD1-CB 4.38Å; F24-E60 HydrophobicContact CE1-CB 4.33Å; E56-E60 PolarHBondContact O-N 3.32Å; E60-R62 VanDerWaalsContact C-N 3.34Å; E60-R62 PolarHBondContact O-N 2.96Å; E60-V63 PolarHBondContact O-N 3.2Å; E60-A64 WeakPolarHBondContact O-CB 3.36Å; E60-A64 PolarHBondContact O-N 3.15Å
61	S	88.7	Confident	77.4	Confident	67 Å²	67	74.3 Å²	74.3	47%	0.469	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-40.9	174.2	-179.7	0	0	0	0	112.5	E57 S58 D59 A64 S65	E57-S61 WeakPolarHBondContact O-CB 3.36Å; E57-S61 PolarHBondContact O-N 3.31Å; S58-S61 WeakPolarHBondContact O-CB 3.25Å; S58-S61 PolarHBondContact O-N 3.34Å; D59-S61 VanDerWaalsContact C-N 3.34Å; D59-S61 PolarHBondContact O-N 3.22Å; S61-A64 PolarHBondContact O-N 2.83Å; S61-S65 WeakPolarHBondContact O-CB 3.45Å; S61-S65 PolarHBondContact O-N 2.93Å
62	R	89.4	Confident	79.3	Confident	96 Å²	96	71.3 Å²	71.3	36%	0.362	37%	0.369	S	S	.	.	H	α-helix	trans	-61.7	-47.1	174.4	-71.6	-62.6	88.5	174.8	4.3	111.6	S58 D59 E60 S65 A66 F126	S58-R62 VanDerWaalsContact O-CG 3.3Å; S58-R62 WeakPolarHBondContact O-CG 3.1Å; S58-R62 PolarHBondContact O-N 2.9Å; D59-R62 WeakPolarHBondContact O-CB 3.41Å; D59-R62 PolarHBondContact O-N 3.23Å; E60-R62 VanDerWaalsContact C-N 3.34Å; E60-R62 PolarHBondContact O-N 2.96Å; R62-S65 PolarHBondContact O-N 3.14Å; R62-A66 WeakPolarHBondContact O-CB 3.41Å; R62-A66 PolarHBondContact O-N 2.88Å; R62-F126 HydrophobicContact CB-CE2 4.25Å; R62-F126 HydrophobicContact CB-CZ 3.99Å
63	V	89.7	Confident	81.2	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.006	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-41.7	179.1	178.2	0	0	0	0	111.1	L20 F24 D59 E60 S65 A66 M67 L108 F126 F131	L20-V63 HydrophobicContact CD1-CB 4.35Å; L20-V63 HydrophobicContact CD1-CG1 3.43Å; L20-V63 VanDerWaalsContact CD1-CG1 3.43Å; F24-V63 HydrophobicContact CE2-CG2 4.22Å; F24-V63 HydrophobicContact CZ-CG2 4.24Å; D59-V63 WeakPolarHBondContact O-CG2 3.3Å; D59-V63 PolarHBondContact O-N 2.88Å; E60-V63 PolarHBondContact O-N 3.2Å; V63-S65 PolarHBondContact O-N 2.93Å; V63-A66 PolarHBondContact O-N 2.84Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.47Å; V63-L108 HydrophobicContact CG1-CD1 4.05Å; V63-L108 HydrophobicContact CG2-CD1 3.74Å; V63-F126 HydrophobicContact CG2-CD1 3.94Å; V63-F126 HydrophobicContact CG2-CD2 4.49Å; V63-F126 HydrophobicContact CG2-CE1 3.61Å; V63-F126 HydrophobicContact CG2-CE2 4.2Å; V63-F126 HydrophobicContact CG2-CG 4.36Å; V63-F126 HydrophobicContact CG2-CZ 3.75Å; V63-F131 HydrophobicContact CG2-CZ 4.37Å
64	A	90.9	Very high	83	Confident	47 Å²	47	67 Å²	67	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-42.9	176.3	0	0	0	0	0	112.2	E60 S61 M67 K68	E60-A64 WeakPolarHBondContact O-CB 3.36Å; E60-A64 PolarHBondContact O-N 3.15Å; S61-A64 PolarHBondContact O-N 2.83Å; A64-M67 PolarHBondContact O-N 3.37Å; A64-K68 PolarHBondContact O-N 3.12Å
65	S	90.7	Very high	85	Confident	47 Å²	47	58.3 Å²	58.3	33%	0.329	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-48.5	174.9	-170.7	0	0	0	0	111.5	S61 R62 V63 M67 K68 E69	S61-S65 WeakPolarHBondContact O-CB 3.45Å; S61-S65 PolarHBondContact O-N 2.93Å; R62-S65 PolarHBondContact O-N 3.14Å; V63-S65 PolarHBondContact O-N 2.93Å; S65-M67 VanDerWaalsContact C-N 3.26Å; S65-M67 PolarHBondContact O-N 2.82Å; S65-K68 WeakPolarHBondContact O-CB 3.24Å; S65-K68 PolarHBondContact O-N 2.59Å; S65-E69 PolarHBondContact O-N 2.94Å
66	A	90.9	Very high	86.7	Confident	2 Å²	2	57 Å²	57	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-57.5	-40.7	176.7	0	0	0	0	0	111.6	R62 V63 K68 E69 L70 F131 V149	R62-A66 WeakPolarHBondContact O-CB 3.41Å; R62-A66 PolarHBondContact O-N 2.88Å; V63-A66 PolarHBondContact O-N 2.84Å; A66-K68 PolarHBondContact O-N 3.28Å; A66-E69 PolarHBondContact O-N 2.86Å; A66-L70 WeakPolarHBondContact O-CB 3.35Å; A66-L70 VanDerWaalsContact O-CG 3.32Å; A66-L70 WeakPolarHBondContact O-CG 3.34Å; A66-L70 PolarHBondContact O-N 3.11Å; A66-F131 HydrophobicContact CB-CE2 3.8Å; A66-F131 HydrophobicContact CB-CZ 3.71Å; A66-V149 HydrophobicContact CB-CG2 4.37Å
67	M	91.2	Very high	88.3	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.049	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-36.7	175.5	-80.8	-58.7	-83.8	0	0	113.5	P17 V63 A64 S65 E69 L70 R71 Y76 F109	P17-M67 HydrophobicContact CB-CE 4.29Å; P17-M67 HydrophobicContact CG-CE 3.77Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.47Å; A64-M67 PolarHBondContact O-N 3.37Å; S65-M67 VanDerWaalsContact C-N 3.26Å; S65-M67 PolarHBondContact O-N 2.82Å; M67-E69 VanDerWaalsContact C-N 3.32Å; M67-L70 PolarHBondContact O-N 3.24Å; M67-L70 HydrophobicContact SD-CD1 3.93Å; M67-R71 WeakPolarHBondContact O-CG 3.48Å; M67-R71 PolarHBondContact O-N 2.78Å; M67-R71 VanDerWaalsContact O-N 3.12Å; M67-Y76 HydrophobicContact CE-CE1 3.86Å; M67-Y76 WeakPolarHBondContact CE-OH 3.33Å; M67-F109 HydrophobicContact CE-CE1 4.44Å; M67-F109 HydrophobicContact CG-CE1 4.47Å; M67-F109 HydrophobicContact CG-CZ 3.91Å; M67-F109 HydrophobicContact SD-CE1 3.4Å; M67-F109 WeakPolarHBondContact SD-CE1 3.36Å; M67-F109 HydrophobicContact SD-CZ 3.38Å; M67-F109 WeakPolarHBondContact SD-CZ 3.45Å
68	K	90.3	Very high	89.8	Confident	131 Å²	131	46.5 Å²	46.5	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-62.9	-40.5	173.6	-175.8	-178.5	177.7	-177.4	0	111.1	A64 S65 A66	A64-K68 PolarHBondContact O-N 3.12Å; S65-K68 WeakPolarHBondContact O-CB 3.24Å; S65-K68 PolarHBondContact O-N 2.59Å; A66-K68 PolarHBondContact O-N 3.28Å
69	E	89.8	Confident	90.4	Very high	51 Å²	51	46 Å²	46	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-47.3	175.4	-67.3	-176.8	-174.5	0	0	111.8	S65 A66 M67 R71 K72 S148 V150 Y225	S65-E69 PolarHBondContact O-N 2.94Å; A66-E69 PolarHBondContact O-N 2.86Å; M67-E69 VanDerWaalsContact C-N 3.32Å; E69-R71 VanDerWaalsContact C-N 3.27Å; E69-R71 PolarHBondContact O-N 3.25Å; E69-K72 WeakPolarHBondContact O-CA 3.44Å; E69-K72 WeakPolarHBondContact O-CB 3.07Å; E69-K72 PolarHBondContact O-N 2.75Å; E69-S148 WeakPolarHBondContact OE2-CB 3.45Å; E69-S148 PolarHBondContact OE2-OG 2.91Å; E69-V150 HydrophobicContact CB-CG2 3.89Å; E69-Y225 WeakPolarHBondContact OE2-CE2 3.32Å; E69-Y225 PolarHBondContact OE2-OH 3.23Å
70	L	91.2	Very high	90.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.2	-40.1	179.9	-77.7	174.6	0	0	0	112.8	A66 M67 K72 T73 W75 Y76 L99 F109 V149 V150	A66-L70 WeakPolarHBondContact O-CB 3.35Å; A66-L70 VanDerWaalsContact O-CG 3.32Å; A66-L70 WeakPolarHBondContact O-CG 3.34Å; A66-L70 PolarHBondContact O-N 3.11Å; M67-L70 PolarHBondContact O-N 3.24Å; M67-L70 HydrophobicContact SD-CD1 3.93Å; L70-K72 PolarHBondContact O-N 2.81Å; L70-T73 HydrophobicContact CD2-CG2 4.49Å; L70-T73 WeakPolarHBondContact O-CB 3.44Å; L70-T73 WeakPolarHBondContact O-CG2 3.25Å; L70-T73 PolarHBondContact O-N 3.19Å; L70-T73 VanDerWaalsContact O-N 3.08Å; L70-T73 PolarHBondContact O-OG1 2.95Å; L70-W75 HydrophobicContact CD2-CH2 4.11Å; L70-W75 HydrophobicContact CD2-CZ3 4.07Å; L70-Y76 HydrophobicContact CB-CG 4.28Å; L70-L99 HydrophobicContact CD1-CD2 3.66Å; L70-L99 HydrophobicContact CD2-CD2 3.22Å; L70-L99 HydrophobicContact CG-CD2 4.07Å; L70-F109 HydrophobicContact CD1-CD1 4.33Å; L70-F109 HydrophobicContact CD1-CE1 4Å; L70-F109 HydrophobicContact CD1-CE2 4.3Å; L70-F109 HydrophobicContact CD1-CZ 3.98Å; L70-V149 HydrophobicContact CD1-CB 4.2Å; L70-V149 HydrophobicContact CD1-CG1 4.29Å; L70-V149 HydrophobicContact CD1-CG2 4.49Å; L70-V149 HydrophobicContact CD2-CB 4.28Å; L70-V149 HydrophobicContact CD2-CG1 4.09Å; L70-V149 HydrophobicContact CG-CB 4.43Å; L70-V150 HydrophobicContact CD2-CG2 3.77Å; L70-V150 HydrophobicContact CG-CG2 4.21Å
71	R	89.4	Confident	91.3	Very high	147 Å²	147	43.7 Å²	43.7	56%	0.555	24%	0.237	S	C	*	.	H	α-helix	trans	-61.5	-25.7	175.7	-76	-174.3	-73.9	-93.2	2.9	113.6	M67 E69 T73	M67-R71 WeakPolarHBondContact O-CG 3.48Å; M67-R71 PolarHBondContact O-N 2.78Å; M67-R71 VanDerWaalsContact O-N 3.12Å; E69-R71 VanDerWaalsContact C-N 3.27Å; E69-R71 PolarHBondContact O-N 3.25Å; R71-T73 VanDerWaalsContact C-N 3.33Å
72	K	87.5	Confident	91.5	Very high	76 Å²	76	41.8 Å²	41.8	33%	0.33	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.7	177.7	-62.2	176.9	178	-175.9	0	113.4	E69 L70 H194 D222 Y223	E69-K72 WeakPolarHBondContact O-CA 3.44Å; E69-K72 WeakPolarHBondContact O-CB 3.07Å; E69-K72 PolarHBondContact O-N 2.75Å; L70-K72 PolarHBondContact O-N 2.81Å; K72-H194 PolarHBondContact O-CE1 2.75Å; K72-H194 PolarHBondContact O-NE2 3.04Å; K72-D222 PolarHBondContact NZ-O 3.08Å; K72-Y223 HydrophobicContact CB-CD2 4.17Å; K72-Y223 HydrophobicContact CB-CE2 4.38Å
73	T	88.8	Confident	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-29	-172.4	68.5	0	0	0	0	113.9	L70 R71 W75 V150 Y186 Y223	L70-T73 HydrophobicContact CD2-CG2 4.49Å; L70-T73 WeakPolarHBondContact O-CB 3.44Å; L70-T73 WeakPolarHBondContact O-CG2 3.25Å; L70-T73 PolarHBondContact O-N 3.19Å; L70-T73 VanDerWaalsContact O-N 3.08Å; L70-T73 PolarHBondContact O-OG1 2.95Å; R71-T73 VanDerWaalsContact C-N 3.33Å; T73-W75 HydrophobicContact CG2-CD2 4.44Å; T73-W75 HydrophobicContact CG2-CH2 3.95Å; T73-W75 HydrophobicContact CG2-CZ2 3.48Å; T73-W75 VanDerWaalsContact CG2-CZ2 3.48Å; T73-W75 PolarHBondContact O-N 3.47Å; T73-W75 VanDerWaalsContact O-N 3.16Å; T73-W75 PolarHBondContact OG1-N 3.27Å; T73-V150 HydrophobicContact CG2-CG1 4.09Å; T73-V150 HydrophobicContact CG2-CG2 3.69Å; T73-Y186 WeakPolarHBondContact O-CE1 3.47Å; T73-Y223 HydrophobicContact CG2-CE2 3.99Å
74	G	89.4	Confident	92	Very high	23 Å²	23	47 Å²	47	24%	0.237	26%	0.257	C	S	.	.	S	Bend	trans	74.7	-13.1	-175.6	0	0	0	0	0	115.8	Y186 A187	G74-Y186 CarbonylContact O-C 3.53Å; G74-Y186 WeakPolarHBondContact O-CA 3.38Å; G74-A187 PolarHBondContact O-N 2.8Å
75	W	92.7	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.			trans	-104.5	10.6	176.5	48.9	-103.9	0	0	0	113.8	L70 T73 F97 L99 V150 V153 P184 Y186 V227	L70-W75 HydrophobicContact CD2-CH2 4.11Å; L70-W75 HydrophobicContact CD2-CZ3 4.07Å; T73-W75 HydrophobicContact CG2-CD2 4.44Å; T73-W75 HydrophobicContact CG2-CH2 3.95Å; T73-W75 HydrophobicContact CG2-CZ2 3.48Å; T73-W75 VanDerWaalsContact CG2-CZ2 3.48Å; T73-W75 PolarHBondContact O-N 3.47Å; T73-W75 VanDerWaalsContact O-N 3.16Å; T73-W75 PolarHBondContact OG1-N 3.27Å; W75-F97 HydrophobicContact CD2-CE2 4.34Å; W75-F97 HydrophobicContact CE3-CE2 4.26Å; W75-L99 HydrophobicContact CE3-CB 3.83Å; W75-L99 HydrophobicContact CZ3-CB 3.68Å; W75-L99 HydrophobicContact CZ3-CD2 4.1Å; W75-L99 HydrophobicContact CZ3-CG 4.43Å; W75-L99 PolarHBondContact O-N 2.96Å; W75-V150 HydrophobicContact CH2-CG1 4.44Å; W75-V150 HydrophobicContact CH2-CG2 4.5Å; W75-V150 HydrophobicContact CZ2-CG1 4.12Å; W75-V153 HydrophobicContact CH2-CB 4Å; W75-V153 HydrophobicContact CH2-CG1 3.94Å; W75-V153 HydrophobicContact CH2-CG2 4Å; W75-V153 HydrophobicContact CZ2-CG1 4.27Å; W75-V153 HydrophobicContact CZ3-CG1 4.39Å; W75-V153 HydrophobicContact CZ3-CG2 4.22Å; W75-P184 HydrophobicContact CB-CB 3.58Å; W75-P184 VanDerWaalsContact CD1-CB 3.41Å; W75-P184 HydrophobicContact CD2-CB 4.37Å; W75-P184 HydrophobicContact CG-CB 3.51Å; W75-Y186 HydrophobicContact CB-CD1 4.29Å; W75-Y186 AromaticContact CD1-CE1 3.9Å; W75-V227 HydrophobicContact CZ2-CG1 3.51Å; W75-V227 PolarHBondContact NE1-O 3.19Å; W75-V227 PolarHBondContact NE1-OXT 3.34Å
76	Y	95.3	Very high	92.4	Very high	34 Å²	34	48 Å²	48	13%	0.133	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-87.6	119.3	166.8	177.2	-115.7	0	0	0	111	M67 L70 G78 L99 D101 F109	M67-Y76 HydrophobicContact CE-CE1 3.86Å; M67-Y76 WeakPolarHBondContact CE-OH 3.33Å; L70-Y76 HydrophobicContact CB-CG 4.28Å; Y76-G78 VanDerWaalsContact CZ-CA 3.48Å; Y76-L99 CarbonylContact C-O 3.53Å; Y76-L99 WeakPolarHBondContact CA-O 3.44Å; Y76-L99 HydrophobicContact CD2-CB 4.31Å; Y76-L99 HydrophobicContact CD2-CD2 3.91Å; Y76-L99 HydrophobicContact CD2-CG 4.21Å; Y76-L99 HydrophobicContact CE2-CD2 4.44Å; Y76-D101 PolarHBondContact OH-OD1 3.01Å; Y76-D101 PolarHBondContact OH-OD2 3.37Å; Y76-F109 HydrophobicContact CE2-CD1 4.32Å; Y76-F109 HydrophobicContact CE2-CE1 4.37Å
77	W	94.9	Very high	92.6	Very high	48 Å²	48	54.1 Å²	54.1	18%	0.182	28%	0.276	C	S	.	.			trans	-98.7	5.7	-175.7	-73.4	72.4	0	0	0	113.9	R14 L80 I88 L98 L99 V185 Y186 A187	R14-W77 PolarHBondContact NH1-O 2.94Å; W77-L80 HydrophobicContact CB-CB 3.94Å; W77-L80 HydrophobicContact CB-CD2 3.78Å; W77-L80 HydrophobicContact CB-CG 4.4Å; W77-L80 HydrophobicContact CD2-CD2 4.1Å; W77-L80 HydrophobicContact CE3-CD1 4.13Å; W77-L80 HydrophobicContact CE3-CD2 4.1Å; W77-L80 HydrophobicContact CG-CD2 4Å; W77-I88 HydrophobicContact CD2-CD1 4.48Å; W77-I88 HydrophobicContact CE3-CD1 3.92Å; W77-I88 HydrophobicContact CH2-CD1 3.8Å; W77-I88 HydrophobicContact CH2-CG2 4.48Å; W77-I88 HydrophobicContact CZ2-CD1 4.37Å; W77-I88 HydrophobicContact CZ2-CG2 4.35Å; W77-I88 HydrophobicContact CZ3-CD1 3.55Å; W77-L98 HydrophobicContact CG-CB 4.43Å; W77-L98 HydrophobicContact CG-CD1 4.37Å; W77-L99 PolarHBondContact N-O 3.47Å; W77-V185 HydrophobicContact CZ2-CG1 3.99Å; W77-V185 PolarHBondContact NE1-O 3.38Å; W77-Y186 WeakPolarHBondContact CZ2-O 3.2Å; W77-A187 HydrophobicContact CD2-CB 3.65Å; W77-A187 HydrophobicContact CE3-CB 4.07Å; W77-A187 HydrophobicContact CG-CB 3.89Å; W77-A187 VanDerWaalsContact CZ2-CA 3.5Å; W77-A187 HydrophobicContact CZ2-CB 4.18Å
78	G	93.4	Very high	92.8	Very high	10 Å²	10	56.1 Å²	56.1	10%	0.103	29%	0.286	C	S	.	.	S	Bend	trans	57.8	-138.3	178.5	0	0	0	0	0	113.4	Y76 L80 R100 D101	Y76-G78 VanDerWaalsContact CZ-CA 3.48Å; G78-L80 PolarHBondContact O-N 3.33Å; G78-R100 WeakPolarHBondContact O-CA 3.34Å; G78-R100 WeakPolarHBondContact O-CB 3.41Å; G78-D101 PolarHBondContact O-N 2.93Å
79	G	93.1	Very high	93	Very high	56 Å²	56	49.9 Å²	49.9	58%	0.577	26%	0.259	S	S	*	.	S	Bend	trans	-68.9	39.1	-178.4	0	0	0	0	0	115.9	D101	G79-D101 WeakPolarHBondContact CA-OD2 3.36Å; G79-D101 PolarHBondContact N-OD2 3.37Å
80	L	94.2	Very high	93.1	Very high	9 Å²	9	53 Å²	53	5%	0.047	27%	0.273	C	S	.	.			trans	-72.4	134.8	173.5	-168.8	75	0	0	0	109.9	W77 G78 E84 A85 I88 L98 R100	W77-L80 HydrophobicContact CB-CB 3.94Å; W77-L80 HydrophobicContact CB-CD2 3.78Å; W77-L80 HydrophobicContact CB-CG 4.4Å; W77-L80 HydrophobicContact CD2-CD2 4.1Å; W77-L80 HydrophobicContact CE3-CD1 4.13Å; W77-L80 HydrophobicContact CE3-CD2 4.1Å; W77-L80 HydrophobicContact CG-CD2 4Å; G78-L80 PolarHBondContact O-N 3.33Å; L80-E84 HydrophobicContact CD1-CB 3.56Å; L80-E84 HydrophobicContact CD1-CG 4.4Å; L80-E84 HydrophobicContact CG-CB 4.01Å; L80-A85 HydrophobicContact CD2-CB 3.76Å; L80-A85 HydrophobicContact CG-CB 4.39Å; L80-I88 HydrophobicContact CD1-CD1 4.06Å; L80-I88 HydrophobicContact CD2-CD1 3.94Å; L80-L98 HydrophobicContact CD2-CD1 3.79Å; L80-L98 HydrophobicContact CD2-CD2 4.19Å; L80-R100 HydrophobicContact CB-CB 3.91Å; L80-R100 WeakPolarHBondContact O-CD 3.39Å; L80-R100 PolarHBondContact O-NH1 2.99Å
81	T	94.8	Very high	92.9	Very high	63 Å²	63	60.2 Å²	60.2	39%	0.387	31%	0.312	S	S	.	.			trans	-77.5	162.6	176.7	66.4	0	0	0	0	111.7	N83 E84 A85	T81-N83 PolarHBondContact O-N 3.35Å; T81-E84 WeakPolarHBondContact CB-OE2 3.36Å; T81-E84 WeakPolarHBondContact CG2-OE2 3.49Å; T81-E84 PolarHBondContact N-OE2 3Å; T81-E84 VanDerWaalsContact OG1-CD 3.28Å; T81-E84 VanDerWaalsContact OG1-CG 3.22Å; T81-E84 WeakPolarHBondContact OG1-CG 3.44Å; T81-E84 PolarHBondContact OG1-N 3.03Å; T81-E84 PolarHBondContact OG1-OE2 3.28Å; T81-A85 WeakPolarHBondContact O-CB 2.79Å; T81-A85 PolarHBondContact O-N 3.13Å
82	A	93.1	Very high	93	Very high	27 Å²	27	55 Å²	55	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-33.5	175.6	0	0	0	0	0	112.6	K86	A82-K86 WeakPolarHBondContact O-CB 3.32Å; A82-K86 PolarHBondContact O-N 3.38Å
83	N	94.8	Very high	93.1	Very high	120 Å²	120	54.3 Å²	54.3	64%	0.642	30%	0.302	S	S	*	.	H	α-helix	trans	-72.8	-47.6	-179.4	-70.2	31.8	0	0	0	111	T81 A85 K86 E87	T81-N83 PolarHBondContact O-N 3.35Å; N83-A85 VanDerWaalsContact C-N 3.29Å; N83-A85 PolarHBondContact O-N 2.89Å; N83-K86 WeakPolarHBondContact O-CB 3.49Å; N83-K86 PolarHBondContact O-N 3.03Å; N83-K86 VanDerWaalsContact O-N 3.08Å; N83-E87 PolarHBondContact O-N 3.47Å
84	E	95.5	Very high	93.2	Very high	85 Å²	85	58.7 Å²	58.7	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-61	-41	175.6	-66.9	163.3	133.6	0	0	111.2	L80 T81 K86 E87 I88	L80-E84 HydrophobicContact CD1-CB 3.56Å; L80-E84 HydrophobicContact CD1-CG 4.4Å; L80-E84 HydrophobicContact CG-CB 4.01Å; T81-E84 WeakPolarHBondContact CB-OE2 3.36Å; T81-E84 WeakPolarHBondContact CG2-OE2 3.49Å; T81-E84 PolarHBondContact N-OE2 3Å; T81-E84 VanDerWaalsContact OG1-CD 3.28Å; T81-E84 VanDerWaalsContact OG1-CG 3.22Å; T81-E84 WeakPolarHBondContact OG1-CG 3.44Å; T81-E84 PolarHBondContact OG1-N 3.03Å; T81-E84 PolarHBondContact OG1-OE2 3.28Å; E84-K86 VanDerWaalsContact C-N 3.29Å; E84-K86 PolarHBondContact O-N 3.47Å; E84-E87 PolarHBondContact O-N 3.25Å; E84-I88 WeakPolarHBondContact O-CD1 3.37Å; E84-I88 WeakPolarHBondContact O-CG1 3.43Å; E84-I88 PolarHBondContact O-N 2.97Å
85	A	95.7	Very high	93.2	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-39.2	174.8	0	0	0	0	0	112.3	L80 T81 N83 L89 L98	L80-A85 HydrophobicContact CD2-CB 3.76Å; L80-A85 HydrophobicContact CG-CB 4.39Å; T81-A85 WeakPolarHBondContact O-CB 2.79Å; T81-A85 PolarHBondContact O-N 3.13Å; N83-A85 VanDerWaalsContact C-N 3.29Å; N83-A85 PolarHBondContact O-N 2.89Å; A85-L89 WeakPolarHBondContact O-CB 3.5Å; A85-L89 VanDerWaalsContact O-CG 3.3Å; A85-L89 WeakPolarHBondContact O-CG 3.34Å; A85-L89 PolarHBondContact O-N 2.96Å; A85-L89 VanDerWaalsContact O-N 3.08Å; A85-L98 HydrophobicContact CB-CD1 4.12Å
86	K	95	Very high	93.2	Very high	116 Å²	116	58 Å²	58	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-45.7	175.1	-179	-177.3	177.4	-176.3	0	111	A82 N83 E84 I88 L89 Q90 P119	A82-K86 WeakPolarHBondContact O-CB 3.32Å; A82-K86 PolarHBondContact O-N 3.38Å; N83-K86 WeakPolarHBondContact O-CB 3.49Å; N83-K86 PolarHBondContact O-N 3.03Å; N83-K86 VanDerWaalsContact O-N 3.08Å; E84-K86 VanDerWaalsContact C-N 3.29Å; E84-K86 PolarHBondContact O-N 3.47Å; K86-I88 PolarHBondContact O-N 3.3Å; K86-L89 PolarHBondContact O-N 3.09Å; K86-Q90 VanDerWaalsContact O-CB 3.29Å; K86-Q90 WeakPolarHBondContact O-CB 3.49Å; K86-Q90 PolarHBondContact O-N 3.48Å; K86-P119 HydrophobicContact CB-CB 4.4Å; K86-P119 HydrophobicContact CG-CB 4.01Å; K86-P119 HydrophobicContact CG-CG 3.98Å
87	E	95.2	Very high	93.3	Very high	131 Å²	131	56.4 Å²	56.4	61%	0.612	31%	0.308	S	S	*	.	H	α-helix	trans	-62.1	-42.9	179.3	-70.3	176.8	-178	0	0	112.3	N83 E84 L89	N83-E87 PolarHBondContact O-N 3.47Å; E84-E87 PolarHBondContact O-N 3.25Å; E87-L89 VanDerWaalsContact C-N 3.33Å; E87-L89 PolarHBondContact O-N 2.74Å
88	I	94.4	Very high	93.3	Very high	51 Å²	51	54.1 Å²	54.1	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-61.6	-42.4	175.9	-68.9	161.7	0	0	0	111.1	W77 L80 E84 K86 S92 L98 V185	W77-I88 HydrophobicContact CD2-CD1 4.48Å; W77-I88 HydrophobicContact CE3-CD1 3.92Å; W77-I88 HydrophobicContact CH2-CD1 3.8Å; W77-I88 HydrophobicContact CH2-CG2 4.48Å; W77-I88 HydrophobicContact CZ2-CD1 4.37Å; W77-I88 HydrophobicContact CZ2-CG2 4.35Å; W77-I88 HydrophobicContact CZ3-CD1 3.55Å; L80-I88 HydrophobicContact CD1-CD1 4.06Å; L80-I88 HydrophobicContact CD2-CD1 3.94Å; E84-I88 WeakPolarHBondContact O-CD1 3.37Å; E84-I88 WeakPolarHBondContact O-CG1 3.43Å; E84-I88 PolarHBondContact O-N 2.97Å; K86-I88 PolarHBondContact O-N 3.3Å; I88-S92 PolarHBondContact O-OG 2.97Å; I88-L98 HydrophobicContact CB-CD2 4.39Å; I88-L98 HydrophobicContact CG2-CD2 3.93Å; I88-V185 HydrophobicContact CG2-CG1 3.93Å
89	L	94.4	Very high	93.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-82.9	-22.5	-175.7	-69.9	170.8	0	0	0	114	A85 K86 E87 N91 S92 L98 S112 P119 V185	A85-L89 WeakPolarHBondContact O-CB 3.5Å; A85-L89 VanDerWaalsContact O-CG 3.3Å; A85-L89 WeakPolarHBondContact O-CG 3.34Å; A85-L89 PolarHBondContact O-N 2.96Å; A85-L89 VanDerWaalsContact O-N 3.08Å; K86-L89 PolarHBondContact O-N 3.09Å; E87-L89 VanDerWaalsContact C-N 3.33Å; E87-L89 PolarHBondContact O-N 2.74Å; L89-N91 PolarHBondContact O-N 3.31Å; L89-N91 VanDerWaalsContact O-N 3.16Å; L89-S92 VanDerWaalsContact O-CB 3.32Å; L89-S92 WeakPolarHBondContact O-CB 3.46Å; L89-S92 PolarHBondContact O-N 3.02Å; L89-L98 HydrophobicContact CD1-CD2 4.41Å; L89-L98 HydrophobicContact CD1-CG 4.44Å; L89-L98 HydrophobicContact CD2-CD2 4.39Å; L89-L98 HydrophobicContact CG-CD2 4.19Å; L89-S112 VanDerWaalsContact CD1-C 3.42Å; L89-S112 WeakPolarHBondContact CD1-O 3.34Å; L89-P119 HydrophobicContact CB-CB 4.21Å; L89-P119 HydrophobicContact CB-CG 4.2Å; L89-V185 HydrophobicContact CD2-CG2 4.01Å
90	Q	92.2	Very high	93.5	Very high	117 Å²	117	51.4 Å²	51.4	55%	0.547	27%	0.269	S	S	.	.	H	α-helix	trans	-60.1	-29.9	-175.1	-177.4	169.4	-11.2	0	0	113.1	K86	K86-Q90 VanDerWaalsContact O-CB 3.29Å; K86-Q90 WeakPolarHBondContact O-CB 3.49Å; K86-Q90 PolarHBondContact O-N 3.48Å
91	N	86.8	Confident	93.5	Very high	152 Å²	152	51.6 Å²	51.6	81%	0.813	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	8.7	177.6	-60.7	-49.8	0	0	0	113.3	L89	L89-N91 PolarHBondContact O-N 3.31Å; L89-N91 VanDerWaalsContact O-N 3.16Å
92	S	91.3	Very high	93.5	Very high	37 Å²	37	48.6 Å²	48.6	26%	0.259	25%	0.252	S	S	.	.	S	Bend	trans	-97.7	157.7	-177.6	-67.1	0	0	0	0	111.9	I88 L89	I88-S92 PolarHBondContact O-OG 2.97Å; L89-S92 VanDerWaalsContact O-CB 3.32Å; L89-S92 WeakPolarHBondContact O-CB 3.46Å; L89-S92 PolarHBondContact O-N 3.02Å
93	S	91.3	Very high	93.3	Very high	61 Å²	61	51.5 Å²	51.5	43%	0.427	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-65.6	153.9	172.1	57	0	0	0	0	112.3	G95 S96	S93-G95 PolarHBondContact O-N 3.4Å; S93-S96 VanDerWaalsContact O-CB 3.22Å; S93-S96 WeakPolarHBondContact O-CB 3.26Å; S93-S96 PolarHBondContact O-N 2.82Å; S93-S96 VanDerWaalsContact O-N 3.1Å; S93-S96 PolarHBondContact O-OG 3.18Å; S93-S96 VanDerWaalsContact O-OG 3.08Å; S93-S96 PolarHBondContact OG-OG 3.04Å
94	E	90.3	Very high	92.9	Very high	92 Å²	92	49.1 Å²	49.1	43%	0.43	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	138.6	168	-172.6	176.8	-169.2	0	0	111.4	S96 S116 L180	E94-S96 VanDerWaalsContact C-N 3.31Å; E94-S116 WeakPolarHBondContact OE1-CB 3.43Å; E94-S116 PolarHBondContact OE1-N 3.26Å; E94-S116 VanDerWaalsContact OE1-N 3.09Å; E94-L180 HydrophobicContact CG-CD2 4.19Å
95	G	88.8	Confident	92.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-3.1	-175.3	0	0	0	0	0	114.9	S93 M114 L180 T182 R183	S93-G95 PolarHBondContact O-N 3.4Å; G95-M114 PolarHBondContact N-O 2.88Å; G95-L180 WeakPolarHBondContact CA-O 3.44Å; G95-T182 PolarHBondContact O-N 3.39Å; G95-T182 PolarHBondContact O-OG1 3Å; G95-R183 PolarHBondContact O-N 2.81Å; G95-R183 VanDerWaalsContact O-N 3.09Å
96	S	93.8	Very high	91.8	Very high	8 Å²	8	61.2 Å²	61.2	6%	0.056	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.4	168.9	-70.7	0	0	0	0	110.5	S93 E94 A113 M114 R183	S93-S96 VanDerWaalsContact O-CB 3.22Å; S93-S96 WeakPolarHBondContact O-CB 3.26Å; S93-S96 PolarHBondContact O-N 2.82Å; S93-S96 VanDerWaalsContact O-N 3.1Å; S93-S96 PolarHBondContact O-OG 3.18Å; S93-S96 VanDerWaalsContact O-OG 3.08Å; S93-S96 PolarHBondContact OG-OG 3.04Å; E94-S96 VanDerWaalsContact C-N 3.31Å; S96-A113 CarbonylContact O-C 3.51Å; S96-A113 WeakPolarHBondContact O-CA 3.49Å; S96-M114 PolarHBondContact O-N 3.13Å; S96-R183 CarbonylContact C-O 3.6Å; S96-R183 VanDerWaalsContact CA-O 3.29Å; S96-R183 WeakPolarHBondContact CA-O 3.4Å
97	F	95.5	Very high	91.5	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	158.7	-177.8	73.6	-89.4	0	0	0	112.8	W75 I111 S112 A113 V153 V157 L181 R183 P184 V185 V227	W75-F97 HydrophobicContact CD2-CE2 4.34Å; W75-F97 HydrophobicContact CE3-CE2 4.26Å; F97-I111 HydrophobicContact CB-CG2 4.2Å; F97-I111 HydrophobicContact CD2-CG2 4.4Å; F97-S112 CarbonylContact C-O 3.53Å; F97-S112 VanDerWaalsContact CA-O 3.25Å; F97-S112 WeakPolarHBondContact CA-O 3.3Å; F97-A113 HydrophobicContact CB-CB 3.96Å; F97-V153 HydrophobicContact CD2-CG1 4.47Å; F97-V153 HydrophobicContact CE2-CG1 3.58Å; F97-V153 HydrophobicContact CZ-CG1 3.82Å; F97-V157 HydrophobicContact CE1-CG2 3.81Å; F97-V157 HydrophobicContact CZ-CG2 3.92Å; F97-L181 HydrophobicContact CB-CD2 3.64Å; F97-L181 HydrophobicContact CD1-CB 4.03Å; F97-L181 HydrophobicContact CD1-CD2 4.15Å; F97-L181 HydrophobicContact CE1-CB 4.32Å; F97-L181 HydrophobicContact CG-CD2 3.9Å; F97-R183 VanDerWaalsContact CD1-O 3.26Å; F97-R183 WeakPolarHBondContact CD1-O 3.34Å; F97-R183 VanDerWaalsContact CE1-C 3.45Å; F97-R183 PolarHBondContact N-O 3.25Å; F97-P184 HydrophobicContact CE1-CB 4.15Å; F97-P184 HydrophobicContact CE2-CB 4.1Å; F97-P184 HydrophobicContact CZ-CB 3.71Å; F97-P184 HydrophobicContact CZ-CG 4.36Å; F97-P184 CarbonylContact O-C 3.58Å; F97-P184 WeakPolarHBondContact O-CA 3.49Å; F97-V185 PolarHBondContact O-N 3.22Å; F97-V227 HydrophobicContact CZ-CG1 4.46Å; F97-V227 HydrophobicContact CZ-CG2 4.22Å
98	L	95.6	Very high	91.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.1	171	61.2	85	0	0	0	110.5	W77 L80 A85 I88 L89 R100 I111 S112 V185	W77-L98 HydrophobicContact CG-CB 4.43Å; W77-L98 HydrophobicContact CG-CD1 4.37Å; L80-L98 HydrophobicContact CD2-CD1 3.79Å; L80-L98 HydrophobicContact CD2-CD2 4.19Å; A85-L98 HydrophobicContact CB-CD1 4.12Å; I88-L98 HydrophobicContact CB-CD2 4.39Å; I88-L98 HydrophobicContact CG2-CD2 3.93Å; L89-L98 HydrophobicContact CD1-CD2 4.41Å; L89-L98 HydrophobicContact CD1-CG 4.44Å; L89-L98 HydrophobicContact CD2-CD2 4.39Å; L89-L98 HydrophobicContact CG-CD2 4.19Å; L98-R100 HydrophobicContact CD1-CB 4.32Å; L98-R100 HydrophobicContact CD1-CG 4.37Å; L98-I111 WeakPolarHBondContact O-CA 3.46Å; L98-S112 PolarHBondContact N-O 3.44Å; L98-S112 PolarHBondContact O-N 2.77Å; L98-V185 HydrophobicContact CB-CB 4.35Å
99	L	95.9	Very high	91.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.9	173.2	-168.6	81.6	0	0	0	110.2	L70 W75 Y76 W77 F109 I111 I124 V149	L70-L99 HydrophobicContact CD1-CD2 3.66Å; L70-L99 HydrophobicContact CD2-CD2 3.22Å; L70-L99 HydrophobicContact CG-CD2 4.07Å; W75-L99 HydrophobicContact CE3-CB 3.83Å; W75-L99 HydrophobicContact CZ3-CB 3.68Å; W75-L99 HydrophobicContact CZ3-CD2 4.1Å; W75-L99 HydrophobicContact CZ3-CG 4.43Å; W75-L99 PolarHBondContact O-N 2.96Å; Y76-L99 CarbonylContact C-O 3.53Å; Y76-L99 WeakPolarHBondContact CA-O 3.44Å; Y76-L99 HydrophobicContact CD2-CB 4.31Å; Y76-L99 HydrophobicContact CD2-CD2 3.91Å; Y76-L99 HydrophobicContact CD2-CG 4.21Å; Y76-L99 HydrophobicContact CE2-CD2 4.44Å; W77-L99 PolarHBondContact N-O 3.47Å; L99-F109 HydrophobicContact CD1-CB 4.24Å; L99-I111 HydrophobicContact CD1-CB 4.42Å; L99-I111 HydrophobicContact CD1-CG1 3.49Å; L99-I111 VanDerWaalsContact CD1-CG1 3.49Å; L99-I124 HydrophobicContact CD1-CD1 3.6Å; L99-V149 HydrophobicContact CD1-CG1 4.29Å; L99-V149 HydrophobicContact CD2-CG1 3.76Å
100	R	95.8	Very high	91.3	Very high	9 Å²	9	48.9 Å²	48.9	3%	0.034	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	167.4	177.4	61.4	-175.4	-174.4	80.6	-0.1	111.2	G78 L80 L98 F109 T110 S112 N121	G78-R100 WeakPolarHBondContact O-CA 3.34Å; G78-R100 WeakPolarHBondContact O-CB 3.41Å; L80-R100 HydrophobicContact CB-CB 3.91Å; L80-R100 WeakPolarHBondContact O-CD 3.39Å; L80-R100 PolarHBondContact O-NH1 2.99Å; L98-R100 HydrophobicContact CD1-CB 4.32Å; L98-R100 HydrophobicContact CD1-CG 4.37Å; R100-F109 WeakPolarHBondContact O-CA 3.25Å; R100-T110 WeakPolarHBondContact CG-O 3.32Å; R100-T110 PolarHBondContact N-O 3.47Å; R100-T110 PolarHBondContact O-N 3.38Å; R100-S112 PolarHBondContact NE-OG 3.36Å; R100-N121 PolarHBondContact NH2-OD1 3.48Å
101	D	94.3	Very high	91.4	Very high	13 Å²	13	43.3 Å²	43.3	7%	0.07	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	140.7	166.1	-69.4	-40.4	0	0	0	109.9	Y76 G78 G79	Y76-D101 PolarHBondContact OH-OD1 3.01Å; Y76-D101 PolarHBondContact OH-OD2 3.37Å; G78-D101 PolarHBondContact O-N 2.93Å; G79-D101 WeakPolarHBondContact CA-OD2 3.36Å; G79-D101 PolarHBondContact N-OD2 3.37Å
102	S	93.5	Very high	91.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	19%	0.185	C	C	.	.			trans	-70.8	140.9	170.6	176.1	0	0	0	0	110.2	N19 Q104 F107 L108	N19-S102 PolarHBondContact ND2-O 3.5Å; S102-Q104 VanDerWaalsContact C-N 3.32Å; S102-Q104 PolarHBondContact OG-N 2.97Å; S102-Q104 PolarHBondContact OG-O 3.27Å; S102-F107 WeakPolarHBondContact CB-O 3.38Å; S102-F107 PolarHBondContact OG-O 3.48Å; S102-L108 PolarHBondContact N-O 2.96Å
103	S	89.1	Confident	91.9	Very high	87 Å²	87	34.4 Å²	34.4	61%	0.608	17%	0.173	S	C	*	.	S	Bend	trans	-85.3	-9.1	170.9	-45.3	0	0	0	0	112.4
104	Q	86.3	Confident	92	Very high	71 Å²	71	33 Å²	33	33%	0.332	16%	0.16	S	C	.	.	S	Bend	trans	-97.3	145.5	179	-77.1	167.4	91.3	0	0	111.6	S102 D106 F107 R123	S102-Q104 VanDerWaalsContact C-N 3.32Å; S102-Q104 PolarHBondContact OG-N 2.97Å; S102-Q104 PolarHBondContact OG-O 3.27Å; Q104-D106 VanDerWaalsContact C-N 3.3Å; Q104-D106 PolarHBondContact O-N 3.45Å; Q104-F107 HydrophobicContact CB-CD2 4.15Å; Q104-F107 PolarHBondContact O-N 2.88Å; Q104-F107 VanDerWaalsContact O-O 3.04Å; Q104-R123 VanDerWaalsContact OE1-NH2 3.09Å
105	R	82.9	Confident	91.9	Very high	216 Å²	216	28.9 Å²	28.9	82%	0.815	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.8	-175.5	-66.7	-171.7	-69.1	-169.3	-1.8	114.1	F23	F23-R105 WeakPolarHBondContact CE2-O 3.49Å
106	D	85.3	Confident	91.7	Very high	122 Å²	122	33 Å²	33	65%	0.652	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.5	-171.8	-51.6	-38.4	0	0	0	113.9	Q104	Q104-D106 VanDerWaalsContact C-N 3.3Å; Q104-D106 PolarHBondContact O-N 3.45Å
107	F	88.9	Confident	91.2	Very high	23 Å²	23	36 Å²	36	10%	0.101	20%	0.196	C	C	.	.			trans	-133.4	142.5	-177	-56.6	-93.1	0	0	0	109.6	S102 Q104 R123 E125 D134	S102-F107 WeakPolarHBondContact CB-O 3.38Å; S102-F107 PolarHBondContact OG-O 3.48Å; Q104-F107 HydrophobicContact CB-CD2 4.15Å; Q104-F107 PolarHBondContact O-N 2.88Å; Q104-F107 VanDerWaalsContact O-O 3.04Å; F107-R123 HydrophobicContact CB-CB 4.45Å; F107-R123 HydrophobicContact CD1-CB 3.48Å; F107-R123 VanDerWaalsContact CD1-CB 3.48Å; F107-R123 HydrophobicContact CD1-CG 4.42Å; F107-R123 HydrophobicContact CD2-CB 4.38Å; F107-R123 HydrophobicContact CE1-CB 3.63Å; F107-R123 HydrophobicContact CE1-CG 4.48Å; F107-R123 HydrophobicContact CG-CB 3.87Å; F107-R123 HydrophobicContact CG-CG 4.41Å; F107-R123 HydrophobicContact CZ-CB 4.19Å; F107-E125 HydrophobicContact CD1-CG 3.83Å; F107-E125 HydrophobicContact CE1-CG 3.42Å; F107-E125 VanDerWaalsContact CE1-CG 3.42Å; F107-E125 HydrophobicContact CZ-CG 4.49Å; F107-D134 HydrophobicContact CE1-CB 4.26Å
108	L	91	Very high	90.8	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.042	20%	0.202	C	C	.	.	S	Bend	trans	-85.8	-45.7	178.1	-66.2	173.8	0	0	0	111.4	F23 V63 S102 F126	F23-L108 HydrophobicContact CB-CD2 3.92Å; F23-L108 HydrophobicContact CD1-CD2 4.06Å; F23-L108 HydrophobicContact CD2-CD2 3.44Å; F23-L108 VanDerWaalsContact CD2-CD2 3.44Å; F23-L108 HydrophobicContact CD2-CG 4.24Å; F23-L108 HydrophobicContact CE1-CD2 4.44Å; F23-L108 HydrophobicContact CE2-CD2 3.86Å; F23-L108 HydrophobicContact CE2-CG 4.16Å; F23-L108 HydrophobicContact CG-CD2 3.54Å; F23-L108 HydrophobicContact CG-CG 4.42Å; F23-L108 HydrophobicContact CZ-CD2 4.35Å; F23-L108 HydrophobicContact CZ-CG 4.31Å; V63-L108 HydrophobicContact CG1-CD1 4.05Å; V63-L108 HydrophobicContact CG2-CD1 3.74Å; S102-L108 PolarHBondContact N-O 2.96Å; L108-F126 HydrophobicContact CD1-CB 3.91Å; L108-F126 HydrophobicContact CD1-CD1 4.18Å; L108-F126 HydrophobicContact CD1-CG 4.16Å
109	F	94.8	Very high	90.6	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.022	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.6	-172.7	-54.6	-64.8	0	0	0	112	M67 L70 Y76 L99 R100 I124 F131 V149	M67-F109 HydrophobicContact CE-CE1 4.44Å; M67-F109 HydrophobicContact CG-CE1 4.47Å; M67-F109 HydrophobicContact CG-CZ 3.91Å; M67-F109 HydrophobicContact SD-CE1 3.4Å; M67-F109 WeakPolarHBondContact SD-CE1 3.36Å; M67-F109 HydrophobicContact SD-CZ 3.38Å; M67-F109 WeakPolarHBondContact SD-CZ 3.45Å; L70-F109 HydrophobicContact CD1-CD1 4.33Å; L70-F109 HydrophobicContact CD1-CE1 4Å; L70-F109 HydrophobicContact CD1-CE2 4.3Å; L70-F109 HydrophobicContact CD1-CZ 3.98Å; Y76-F109 HydrophobicContact CE2-CD1 4.32Å; Y76-F109 HydrophobicContact CE2-CE1 4.37Å; L99-F109 HydrophobicContact CD1-CB 4.24Å; R100-F109 WeakPolarHBondContact O-CA 3.25Å; F109-I124 HydrophobicContact CB-CB 4.25Å; F109-I124 HydrophobicContact CB-CD1 3.83Å; F109-I124 PolarHBondContact O-N 3.47Å; F109-F131 HydrophobicContact CD2-CE1 4.26Å; F109-F131 HydrophobicContact CE2-CE1 4.03Å; F109-V149 HydrophobicContact CD2-CG2 3.74Å; F109-V149 HydrophobicContact CE2-CG2 3.93Å
110	T	94.9	Very high	90.4	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	132.5	173.4	-62.2	0	0	0	0	109.6	R100 N121 L122	R100-T110 WeakPolarHBondContact CG-O 3.32Å; R100-T110 PolarHBondContact N-O 3.47Å; R100-T110 PolarHBondContact O-N 3.38Å; T110-N121 HydrophobicContact CG2-CB 3.9Å; T110-L122 CarbonylContact C-O 3.59Å; T110-L122 WeakPolarHBondContact CA-O 3.38Å; T110-L122 WeakPolarHBondContact CG2-O 3.19Å
111	I	94.4	Very high	90.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123	166.7	-55.4	170.1	0	0	0	107.1	F97 L98 L99 A113 N121 L122 I124 L133 L152 V153 L181	F97-I111 HydrophobicContact CB-CG2 4.2Å; F97-I111 HydrophobicContact CD2-CG2 4.4Å; L98-I111 WeakPolarHBondContact O-CA 3.46Å; L99-I111 HydrophobicContact CD1-CB 4.42Å; L99-I111 HydrophobicContact CD1-CG1 3.49Å; L99-I111 VanDerWaalsContact CD1-CG1 3.49Å; I111-A113 HydrophobicContact CG2-CB 4.48Å; I111-N121 CarbonylContact O-C 3.5Å; I111-N121 WeakPolarHBondContact O-CA 3.43Å; I111-L122 HydrophobicContact CB-CB 4.24Å; I111-L122 HydrophobicContact CB-CD1 4.32Å; I111-L122 HydrophobicContact CG2-CD1 4.32Å; I111-L122 PolarHBondContact N-O 2.95Å; I111-L122 PolarHBondContact O-N 3.44Å; I111-I124 HydrophobicContact CD1-CD1 4.15Å; I111-I124 HydrophobicContact CG1-CD1 3.84Å; I111-I124 HydrophobicContact CG1-CG1 4.46Å; I111-L133 HydrophobicContact CD1-CD2 3.95Å; I111-L152 HydrophobicContact CD1-CD2 4.22Å; I111-V153 HydrophobicContact CD1-CG2 3.92Å; I111-V153 HydrophobicContact CG1-CG2 4.46Å; I111-L181 HydrophobicContact CD1-CD1 4.43Å; I111-L181 HydrophobicContact CG2-CD2 4.12Å
112	S	94.7	Very high	89.9	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.014	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.7	167.2	-60.8	0	0	0	0	107.7	L89 F97 L98 R100 T120 N121	L89-S112 VanDerWaalsContact CD1-C 3.42Å; L89-S112 WeakPolarHBondContact CD1-O 3.34Å; F97-S112 CarbonylContact C-O 3.53Å; F97-S112 VanDerWaalsContact CA-O 3.25Å; F97-S112 WeakPolarHBondContact CA-O 3.3Å; L98-S112 PolarHBondContact N-O 3.44Å; L98-S112 PolarHBondContact O-N 2.77Å; R100-S112 PolarHBondContact NE-OG 3.36Å; S112-T120 WeakPolarHBondContact CA-O 3.06Å; S112-N121 PolarHBondContact OG-OD1 3.16Å
113	A	93.1	Very high	89.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.4	-176.1	0	0	0	0	0	111.7	S96 F97 I111 P119 T120 L122 L181	S96-A113 CarbonylContact O-C 3.51Å; S96-A113 WeakPolarHBondContact O-CA 3.49Å; F97-A113 HydrophobicContact CB-CB 3.96Å; I111-A113 HydrophobicContact CG2-CB 4.48Å; A113-P119 WeakPolarHBondContact O-CA 3.48Å; A113-T120 PolarHBondContact N-O 3.07Å; A113-T120 PolarHBondContact O-N 3.15Å; A113-L122 HydrophobicContact CB-CD1 4.44Å; A113-L181 HydrophobicContact CB-CD2 3.72Å
114	M	92.7	Very high	90	Very high	33 Å²	33	42.1 Å²	42.1	16%	0.163	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	115.1	172.7	-173	59.9	177.1	0	0	109.4	G95 S96 P119	G95-M114 PolarHBondContact N-O 2.88Å; S96-M114 PolarHBondContact O-N 3.13Å; M114-P119 HydrophobicContact SD-CG 3.74Å
115	T	88.1	Confident	90.2	Very high	4 Å²	4	40 Å²	40	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	172.8	176.5	70.6	0	0	0	0	110.2	A117 G118 T120 I177	T115-A117 PolarHBondContact O-N 3.49Å; T115-A117 PolarHBondContact OG1-N 2.87Å; T115-G118 PolarHBondContact N-O 3.23Å; T115-G118 WeakPolarHBondContact O-CA 3.39Å; T115-G118 PolarHBondContact O-N 3.25Å; T115-G118 PolarHBondContact OG1-O 3.47Å; T115-T120 PolarHBondContact OG1-OG1 2.9Å; T115-I177 HydrophobicContact CG2-CG2 3.99Å
116	S	84.3	Confident	90.6	Very high	88 Å²	88	30.5 Å²	30.5	62%	0.615	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.3	171.8	57	0	0	0	0	114.3	E94 G118	E94-S116 WeakPolarHBondContact OE1-CB 3.43Å; E94-S116 PolarHBondContact OE1-N 3.26Å; E94-S116 VanDerWaalsContact OE1-N 3.09Å; S116-G118 VanDerWaalsContact C-N 3.33Å
117	A	83.8	Confident	90.7	Very high	71 Å²	71	32.2 Å²	32.2	59%	0.587	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	0.9	174.4	0	0	0	0	0	113.7	T115 I177	T115-A117 PolarHBondContact O-N 3.49Å; T115-A117 PolarHBondContact OG1-N 2.87Å; A117-I177 HydrophobicContact CB-CD1 3.47Å; A117-I177 VanDerWaalsContact CB-CD1 3.47Å; A117-I177 HydrophobicContact CB-CG1 3.81Å
118	G	88.1	Confident	90.5	Very high	13 Å²	13	38.8 Å²	38.8	13%	0.134	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.1	-170	-177.3	0	0	0	0	0	114.1	T115 S116 T120	T115-G118 PolarHBondContact N-O 3.23Å; T115-G118 WeakPolarHBondContact O-CA 3.39Å; T115-G118 PolarHBondContact O-N 3.25Å; T115-G118 PolarHBondContact OG1-O 3.47Å; S116-G118 VanDerWaalsContact C-N 3.33Å; G118-T120 PolarHBondContact O-N 2.84Å; G118-T120 PolarHBondContact O-OG1 3.45Å
119	P	91.1	Very high	90.3	Very high	39 Å²	39	38.9 Å²	38.9	25%	0.253	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	120.3	-178.2	-22.7	34.3	0	0	0	111.8	K86 L89 A113 M114	K86-P119 HydrophobicContact CB-CB 4.4Å; K86-P119 HydrophobicContact CG-CB 4.01Å; K86-P119 HydrophobicContact CG-CG 3.98Å; L89-P119 HydrophobicContact CB-CB 4.21Å; L89-P119 HydrophobicContact CB-CG 4.2Å; A113-P119 WeakPolarHBondContact O-CA 3.48Å; M114-P119 HydrophobicContact SD-CG 3.74Å
120	T	90.6	Very high	90.1	Very high	38 Å²	38	41.9 Å²	41.9	23%	0.233	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.2	-178	-60.6	0	0	0	0	110.3	S112 A113 T115 G118	S112-T120 WeakPolarHBondContact CA-O 3.06Å; A113-T120 PolarHBondContact N-O 3.07Å; A113-T120 PolarHBondContact O-N 3.15Å; T115-T120 PolarHBondContact OG1-OG1 2.9Å; G118-T120 PolarHBondContact O-N 2.84Å; G118-T120 PolarHBondContact O-OG1 3.45Å
121	N	91.4	Very high	89.9	Confident	57 Å²	57	41.8 Å²	41.8	31%	0.305	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127	178.7	-70	-78.3	0	0	0	110.5	R100 T110 I111 S112	R100-N121 PolarHBondContact NH2-OD1 3.48Å; T110-N121 HydrophobicContact CG2-CB 3.9Å; I111-N121 CarbonylContact O-C 3.5Å; I111-N121 WeakPolarHBondContact O-CA 3.43Å; S112-N121 PolarHBondContact OG-OD1 3.16Å
122	L	90	Very high	89.7	Confident	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117.3	179.9	-57.3	148.6	0	0	0	108.1	T110 I111 A113 L133 V137 L179	T110-L122 CarbonylContact C-O 3.59Å; T110-L122 WeakPolarHBondContact CA-O 3.38Å; T110-L122 WeakPolarHBondContact CG2-O 3.19Å; I111-L122 HydrophobicContact CB-CB 4.24Å; I111-L122 HydrophobicContact CB-CD1 4.32Å; I111-L122 HydrophobicContact CG2-CD1 4.32Å; I111-L122 PolarHBondContact N-O 2.95Å; I111-L122 PolarHBondContact O-N 3.44Å; A113-L122 HydrophobicContact CB-CD1 4.44Å; L122-L133 HydrophobicContact CB-CD2 4.38Å; L122-V137 HydrophobicContact CD2-CB 3.85Å; L122-V137 HydrophobicContact CD2-CG1 3.34Å; L122-L179 HydrophobicContact CD1-CD1 3.28Å; L122-L179 HydrophobicContact CD1-CD2 3.75Å; L122-L179 HydrophobicContact CD1-CG 4.16Å; L122-L179 HydrophobicContact CD2-CD1 4.42Å; L122-L179 HydrophobicContact CD2-CD2 4.16Å; L122-L179 HydrophobicContact CG-CD1 4.42Å
123	R	91.9	Very high	89.4	Confident	85 Å²	85	43.9 Å²	43.9	32%	0.321	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	145.8	-176.9	-56	165.3	-169.1	-176.5	-8.8	109.4	Q104 F107 D134	Q104-R123 VanDerWaalsContact OE1-NH2 3.09Å; F107-R123 HydrophobicContact CB-CB 4.45Å; F107-R123 HydrophobicContact CD1-CB 3.48Å; F107-R123 VanDerWaalsContact CD1-CB 3.48Å; F107-R123 HydrophobicContact CD1-CG 4.42Å; F107-R123 HydrophobicContact CD2-CB 4.38Å; F107-R123 HydrophobicContact CE1-CB 3.63Å; F107-R123 HydrophobicContact CE1-CG 4.48Å; F107-R123 HydrophobicContact CG-CB 3.87Å; F107-R123 HydrophobicContact CG-CG 4.41Å; F107-R123 HydrophobicContact CZ-CB 4.19Å; R123-D134 HydrophobicContact CB-CB 4.03Å; R123-D134 WeakPolarHBondContact O-CB 3.4Å; R123-D134 PolarHBondContact O-N 3.17Å
124	I	91.9	Very high	88.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.3	174.7	-64.1	158.1	0	0	0	107.9	L99 F109 I111 F131 K132 L133 V149 L152	L99-I124 HydrophobicContact CD1-CD1 3.6Å; F109-I124 HydrophobicContact CB-CB 4.25Å; F109-I124 HydrophobicContact CB-CD1 3.83Å; F109-I124 PolarHBondContact O-N 3.47Å; I111-I124 HydrophobicContact CD1-CD1 4.15Å; I111-I124 HydrophobicContact CG1-CD1 3.84Å; I111-I124 HydrophobicContact CG1-CG1 4.46Å; I124-F131 HydrophobicContact CG2-CB 4.05Å; I124-F131 HydrophobicContact CG2-CD1 3.97Å; I124-F131 HydrophobicContact CG2-CG 4.48Å; I124-K132 CarbonylContact C-O 3.56Å; I124-K132 WeakPolarHBondContact CA-O 3.37Å; I124-L133 HydrophobicContact CG1-CD2 3.87Å; I124-V149 HydrophobicContact CD1-CG1 3.84Å; I124-L152 HydrophobicContact CG2-CD1 4.27Å
125	E	90.8	Very high	87.5	Confident	25 Å²	25	45.2 Å²	45.2	12%	0.117	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	143	171.3	-67.2	178.6	-133.3	0	0	109.8	F107 R127 F131 K132	F107-E125 HydrophobicContact CD1-CG 3.83Å; F107-E125 HydrophobicContact CE1-CG 3.42Å; F107-E125 VanDerWaalsContact CE1-CG 3.42Å; F107-E125 HydrophobicContact CZ-CG 4.49Å; E125-R127 IonicContact OE2-NE 2.74Å; E125-F131 CarbonylContact O-C 3.57Å; E125-F131 WeakPolarHBondContact O-CA 3.41Å; E125-K132 HydrophobicContact CB-CD 4.49Å; E125-K132 HydrophobicContact CB-CG 3.87Å; E125-K132 PolarHBondContact N-O 3.33Å; E125-K132 PolarHBondContact O-N 3.16Å; E125-K132 IonicContact OE1-NZ 2.61Å; E125-K132 WeakPolarHBondContact OE2-CE 3.34Å; E125-K132 IonicContact OE2-NZ 3.97Å; E125-K132 PolarHBondContact OE2-NZ 3.29Å
126	F	90.2	Very high	86	Confident	17 Å²	17	51.2 Å²	51.2	8%	0.075	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.8	169.5	-179.7	-105.9	0	0	0	108.8	D59 R62 V63 L108 K130 F131	D59-F126 HydrophobicContact CB-CE1 3.8Å; D59-F126 HydrophobicContact CB-CZ 4.08Å; R62-F126 HydrophobicContact CB-CE2 4.25Å; R62-F126 HydrophobicContact CB-CZ 3.99Å; V63-F126 HydrophobicContact CG2-CD1 3.94Å; V63-F126 HydrophobicContact CG2-CD2 4.49Å; V63-F126 HydrophobicContact CG2-CE1 3.61Å; V63-F126 HydrophobicContact CG2-CE2 4.2Å; V63-F126 HydrophobicContact CG2-CG 4.36Å; V63-F126 HydrophobicContact CG2-CZ 3.75Å; L108-F126 HydrophobicContact CD1-CB 3.91Å; L108-F126 HydrophobicContact CD1-CD1 4.18Å; L108-F126 HydrophobicContact CD1-CG 4.16Å; F126-K130 WeakPolarHBondContact CA-O 2.96Å; F126-F131 HydrophobicContact CB-CD1 4.05Å; F126-F131 HydrophobicContact CB-CE1 4.03Å; F126-F131 AromaticContact CD2-CD1 3.56Å; F126-F131 HydrophobicContact CD2-CD1 3.56Å; F126-F131 HydrophobicContact CD2-CD2 4.11Å; F126-F131 AromaticContact CD2-CE1 3.31Å; F126-F131 HydrophobicContact CD2-CE1 3.31Å; F126-F131 AromaticContact CD2-CE2 3.89Å; F126-F131 HydrophobicContact CD2-CE2 3.89Å; F126-F131 AromaticContact CD2-CG 3.96Å; F126-F131 HydrophobicContact CD2-CG 3.96Å; F126-F131 AromaticContact CD2-CZ 3.49Å; F126-F131 HydrophobicContact CD2-CZ 3.49Å; F126-F131 VanDerWaalsContact CD2-CZ 3.49Å; F126-F131 HydrophobicContact CE2-CD1 4.46Å; F126-F131 HydrophobicContact CE2-CD2 4.33Å; F126-F131 AromaticContact CE2-CE1 4Å; F126-F131 HydrophobicContact CE2-CE1 4Å; F126-F131 AromaticContact CE2-CE2 3.84Å; F126-F131 HydrophobicContact CE2-CE2 3.84Å; F126-F131 AromaticContact CE2-CZ 3.66Å; F126-F131 HydrophobicContact CE2-CZ 3.66Å; F126-F131 HydrophobicContact CG-CD1 4.21Å; F126-F131 AromaticContact CG-CE1 3.89Å; F126-F131 HydrophobicContact CG-CE1 3.89Å; F126-F131 HydrophobicContact CG-CZ 4.37Å
127	R	87.3	Confident	84.7	Confident	159 Å²	159	49.8 Å²	49.8	60%	0.6	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.5	136.8	177.8	-66.4	-167.1	-179.1	-157.4	-1.7	110	E125 G129 K130	E125-R127 IonicContact OE2-NE 2.74Å; R127-G129 VanDerWaalsContact C-N 3.32Å; R127-G129 PolarHBondContact O-N 3.21Å; R127-K130 PolarHBondContact N-O 3.23Å; R127-K130 PolarHBondContact O-N 3.3Å; R127-K130 VanDerWaalsContact O-N 3.11Å
128	H	85.6	Confident	83.5	Confident	161 Å²	161	48.1 Å²	48.1	75%	0.745	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	49	178.4	-47.4	107.4	0	0	0	112.4	K130	H128-K130 PolarHBondContact O-N 3.12Å
129	G	86.6	Confident	81.9	Confident	10 Å²	10	53.2 Å²	53.2	10%	0.103	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	4.8	179.2	0	0	0	0	0	116.3	D59 R127	D59-G129 WeakPolarHBondContact OD1-CA 3.44Å; D59-G129 PolarHBondContact OD1-N 3.08Å; R127-G129 VanDerWaalsContact C-N 3.32Å; R127-G129 PolarHBondContact O-N 3.21Å
130	K	90.6	Very high	80	Confident	68 Å²	68	58.7 Å²	58.7	30%	0.296	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.9	-175	-58.9	-63.5	-170.9	-174.8	0	113.4	F126 R127 H128 Q145 F146 D147	F126-K130 WeakPolarHBondContact CA-O 2.96Å; R127-K130 PolarHBondContact N-O 3.23Å; R127-K130 PolarHBondContact O-N 3.3Å; R127-K130 VanDerWaalsContact O-N 3.11Å; H128-K130 PolarHBondContact O-N 3.12Å; K130-Q145 HydrophobicContact CB-CB 4.01Å; K130-Q145 HydrophobicContact CG-CB 4.33Å; K130-F146 CarbonylContact C-O 3.55Å; K130-F146 WeakPolarHBondContact CA-O 3.41Å; K130-D147 IonicContact NZ-OD1 2.81Å; K130-D147 PolarHBondContact NZ-OD1 2.96Å; K130-D147 IonicContact NZ-OD2 3.95Å; K130-D147 PolarHBondContact NZ-OD2 2.82Å
131	F	91.7	Very high	78	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	137.7	172.9	-60	-80.4	0	0	0	111.6	V63 A66 F109 I124 E125 F126 Q145 F146 V149 L152	V63-F131 HydrophobicContact CG2-CZ 4.37Å; A66-F131 HydrophobicContact CB-CE2 3.8Å; A66-F131 HydrophobicContact CB-CZ 3.71Å; F109-F131 HydrophobicContact CD2-CE1 4.26Å; F109-F131 HydrophobicContact CE2-CE1 4.03Å; I124-F131 HydrophobicContact CG2-CB 4.05Å; I124-F131 HydrophobicContact CG2-CD1 3.97Å; I124-F131 HydrophobicContact CG2-CG 4.48Å; E125-F131 CarbonylContact O-C 3.57Å; E125-F131 WeakPolarHBondContact O-CA 3.41Å; F126-F131 HydrophobicContact CB-CD1 4.05Å; F126-F131 HydrophobicContact CB-CE1 4.03Å; F126-F131 AromaticContact CD2-CD1 3.56Å; F126-F131 HydrophobicContact CD2-CD1 3.56Å; F126-F131 HydrophobicContact CD2-CD2 4.11Å; F126-F131 AromaticContact CD2-CE1 3.31Å; F126-F131 HydrophobicContact CD2-CE1 3.31Å; F126-F131 AromaticContact CD2-CE2 3.89Å; F126-F131 HydrophobicContact CD2-CE2 3.89Å; F126-F131 AromaticContact CD2-CG 3.96Å; F126-F131 HydrophobicContact CD2-CG 3.96Å; F126-F131 AromaticContact CD2-CZ 3.49Å; F126-F131 HydrophobicContact CD2-CZ 3.49Å; F126-F131 VanDerWaalsContact CD2-CZ 3.49Å; F126-F131 HydrophobicContact CE2-CD1 4.46Å; F126-F131 HydrophobicContact CE2-CD2 4.33Å; F126-F131 AromaticContact CE2-CE1 4Å; F126-F131 HydrophobicContact CE2-CE1 4Å; F126-F131 AromaticContact CE2-CE2 3.84Å; F126-F131 HydrophobicContact CE2-CE2 3.84Å; F126-F131 AromaticContact CE2-CZ 3.66Å; F126-F131 HydrophobicContact CE2-CZ 3.66Å; F126-F131 HydrophobicContact CG-CD1 4.21Å; F126-F131 AromaticContact CG-CE1 3.89Å; F126-F131 HydrophobicContact CG-CE1 3.89Å; F126-F131 HydrophobicContact CG-CZ 4.37Å; F131-Q145 CarbonylContact O-C 3.58Å; F131-Q145 WeakPolarHBondContact O-CA 3.27Å; F131-F146 PolarHBondContact N-O 3.38Å; F131-F146 PolarHBondContact O-N 3.07Å; F131-V149 HydrophobicContact CB-CG2 4.37Å; F131-V149 HydrophobicContact CD1-CG2 3.41Å; F131-V149 VanDerWaalsContact CD1-CG2 3.41Å; F131-V149 HydrophobicContact CD2-CG2 3.94Å; F131-V149 HydrophobicContact CE1-CG2 3.53Å; F131-V149 HydrophobicContact CE2-CG2 4.05Å; F131-V149 HydrophobicContact CG-CG2 3.62Å; F131-V149 HydrophobicContact CZ-CG2 3.86Å; F131-L152 HydrophobicContact CB-CD1 4.06Å
132	K	90.1	Very high	76.3	Confident	45 Å²	45	68.3 Å²	68.3	20%	0.196	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156.4	173.4	65.2	179.6	-178.6	164.4	0	111	I124 E125 Q145	I124-K132 CarbonylContact C-O 3.56Å; I124-K132 WeakPolarHBondContact CA-O 3.37Å; E125-K132 HydrophobicContact CB-CD 4.49Å; E125-K132 HydrophobicContact CB-CG 3.87Å; E125-K132 PolarHBondContact N-O 3.33Å; E125-K132 PolarHBondContact O-N 3.16Å; E125-K132 IonicContact OE1-NZ 2.61Å; E125-K132 WeakPolarHBondContact OE2-CE 3.34Å; E125-K132 IonicContact OE2-NZ 3.97Å; E125-K132 PolarHBondContact OE2-NZ 3.29Å; K132-Q145 HydrophobicContact CB-CG 4.27Å
133	L	88.2	Confident	75.3	Confident	1 Å²	1	70 Å²	70	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.4	170.5	-69.9	-179.6	0	0	0	110.7	I111 L122 I124 S135 L138 L143 L152 Y156 L179	I111-L133 HydrophobicContact CD1-CD2 3.95Å; L122-L133 HydrophobicContact CB-CD2 4.38Å; I124-L133 HydrophobicContact CG1-CD2 3.87Å; L133-S135 PolarHBondContact O-N 3.31Å; L133-L138 HydrophobicContact CB-CD1 4.12Å; L133-L138 HydrophobicContact CD1-CD1 3.61Å; L133-L143 HydrophobicContact CB-CD2 4.22Å; L133-L152 HydrophobicContact CD2-CD2 3.96Å; L133-L152 HydrophobicContact CG-CD2 4.07Å; L133-Y156 HydrophobicContact CD1-CD1 4.19Å; L133-Y156 HydrophobicContact CD1-CD2 3.7Å; L133-Y156 HydrophobicContact CD1-CE1 3.87Å; L133-Y156 HydrophobicContact CD1-CE2 3.35Å; L133-Y156 HydrophobicContact CD1-CG 4.12Å; L133-Y156 VanDerWaalsContact CD1-CZ 3.45Å; L133-Y156 HydrophobicContact CG-CD2 4.34Å; L133-Y156 HydrophobicContact CG-CE2 3.75Å; L133-L179 HydrophobicContact CD1-CD2 4.06Å
134	D	82.6	Confident	74.8	Confident	13 Å²	13	70.9 Å²	70.9	7%	0.07	36%	0.356	C	S	.	.			trans	-56.7	125.6	173.7	-177.3	-5.9	0	0	0	110.2	F107 R123 V136 V137	F107-D134 HydrophobicContact CE1-CB 4.26Å; R123-D134 HydrophobicContact CB-CB 4.03Å; R123-D134 WeakPolarHBondContact O-CB 3.4Å; R123-D134 PolarHBondContact O-N 3.17Å; D134-V136 PolarHBondContact O-N 3.07Å; D134-V136 WeakPolarHBondContact OD1-CB 3.46Å; D134-V136 WeakPolarHBondContact OD1-CG2 3.5Å; D134-V136 PolarHBondContact OD1-N 3.24Å; D134-V137 PolarHBondContact O-N 3.05Å
135	S	62.5	Low	74.6	Confident	49 Å²	49	76.9 Å²	76.9	34%	0.343	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.7	-175.8	-55.4	0	0	0	0	113.1	L133 V137 L143	L133-S135 PolarHBondContact O-N 3.31Å; S135-V137 PolarHBondContact O-N 3.43Å; S135-L143 WeakPolarHBondContact OG-CD1 3.18Å
136	V	57.4	Low	74.6	Confident	130 Å²	130	76.1 Å²	76.1	79%	0.788	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.8	-178.1	178.9	0	0	0	0	111.7	D134	D134-V136 PolarHBondContact O-N 3.07Å; D134-V136 WeakPolarHBondContact OD1-CB 3.46Å; D134-V136 WeakPolarHBondContact OD1-CG2 3.5Å; D134-V136 PolarHBondContact OD1-N 3.24Å
137	V	56.7	Low	74.5	Confident	58 Å²	58	79 Å²	79	35%	0.352	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-15	-171.3	-165.2	0	0	0	0	113.4	L122 D134 S135	L122-V137 HydrophobicContact CD2-CB 3.85Å; L122-V137 HydrophobicContact CD2-CG1 3.34Å; D134-V137 PolarHBondContact O-N 3.05Å; S135-V137 PolarHBondContact O-N 3.43Å
138	L	59	Low	74.7	Confident	35 Å²	35	71.9 Å²	71.9	18%	0.183	37%	0.371	C	S	.	.	S	Bend	trans	-114.5	115.8	-178.8	-67.5	177.5	0	0	0	111.3	L133 K140 L143 Y156 L179	L133-L138 HydrophobicContact CB-CD1 4.12Å; L133-L138 HydrophobicContact CD1-CD1 3.61Å; L138-K140 PolarHBondContact O-N 3.13Å; L138-L143 HydrophobicContact CB-CD2 4.25Å; L138-L143 HydrophobicContact CD1-CD2 3.67Å; L138-Y156 HydrophobicContact CD1-CE1 4.19Å; L138-L179 HydrophobicContact CD1-CD2 4.35Å; L138-L179 HydrophobicContact CD2-CB 3.76Å; L138-L179 HydrophobicContact CD2-CD2 3.8Å; L138-L179 HydrophobicContact CD2-CG 4.43Å
139	V	54	Low	75	Confident	121 Å²	121	64.2 Å²	64.2	73%	0.733	34%	0.336	S	S	*	.			trans	-63.3	101.5	165.1	-176.1	0	0	0	0	106.6	T176	V139-T176 HydrophobicContact CB-CG2 4.35Å; V139-T176 HydrophobicContact CG2-CG2 3.92Å
140	K	50.4	Low	75.3	Confident	154 Å²	154	63.7 Å²	63.7	67%	0.67	33%	0.331	S	S	*	.			trans	-41.9	136.8	-170.5	-82	176	178	168.7	0	112.5	L138	L138-K140 PolarHBondContact O-N 3.13Å
141	P	48.6	Very low	75.4	Confident	115 Å²	115	64.4 Å²	64.4	75%	0.747	34%	0.335	S	S	*	.	S	Bend		-133.6	127.5	91.2	29.1	-13.3	0	0	0	112.3
142	K	55.4	Low	75.4	Confident	182 Å²	182	64.4 Å²	64.4	79%	0.791	34%	0.335	S	S	*	.			trans	65.4	70.7	164.4	-54.9	175.7	176.7	175.6	0	115.7	K144	K142-K144 PolarHBondContact O-N 2.87Å; K142-K144 VanDerWaalsContact O-N 3.09Å
143	L	69.8	Low	75.4	Confident	42 Å²	42	62.2 Å²	62.2	22%	0.22	33%	0.325	C	S	.	.			trans	-57.3	115.9	162.8	-64.3	167.8	0	0	0	109	L133 S135 L138	L133-L143 HydrophobicContact CB-CD2 4.22Å; S135-L143 WeakPolarHBondContact OG-CD1 3.18Å; L138-L143 HydrophobicContact CB-CD2 4.25Å; L138-L143 HydrophobicContact CD1-CD2 3.67Å
144	K	81.5	Confident	75.5	Confident	103 Å²	103	63 Å²	63	45%	0.448	33%	0.329	S	S	.	.			trans	-87.8	150.9	174.7	-70.4	-170.6	-174.7	170.5	0	110.3	K142 F146 H155	K142-K144 PolarHBondContact O-N 2.87Å; K142-K144 VanDerWaalsContact O-N 3.09Å; K144-F146 HydrophobicContact CB-CD2 4.4Å; K144-F146 HydrophobicContact CB-CE1 4.3Å; K144-F146 HydrophobicContact CB-CE2 3.52Å; K144-F146 HydrophobicContact CB-CZ 3.46Å; K144-F146 VanDerWaalsContact CB-CZ 3.46Å; K144-F146 HydrophobicContact CD-CZ 4.23Å; K144-F146 HydrophobicContact CG-CZ 4.47Å; K144-F146 WeakPolarHBondContact O-CD2 3.36Å; K144-F146 WeakPolarHBondContact O-CE2 3.49Å; K144-H155 WeakPolarHBondContact CD-NE2 3.28Å; K144-H155 PolarHBondContact NZ-NE2 3.38Å
145	Q	88.1	Confident	75.8	Confident	126 Å²	126	64.1 Å²	64.1	59%	0.589	33%	0.334	S	S	*	.			trans	-102.8	143.6	173.1	-68.1	-179.4	28	0	0	108.9	K130 F131 K132	K130-Q145 HydrophobicContact CB-CB 4.01Å; K130-Q145 HydrophobicContact CG-CB 4.33Å; F131-Q145 CarbonylContact O-C 3.58Å; F131-Q145 WeakPolarHBondContact O-CA 3.27Å; K132-Q145 HydrophobicContact CB-CG 4.27Å
146	F	90.7	Very high	76.9	Confident	10 Å²	10	62.7 Å²	62.7	4%	0.044	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-136.4	148.7	-173.7	-58.4	-90.3	0	0	0	111.1	K130 F131 K144 S148 H151 L152 H155 Y156	K130-F146 CarbonylContact C-O 3.55Å; K130-F146 WeakPolarHBondContact CA-O 3.41Å; F131-F146 PolarHBondContact N-O 3.38Å; F131-F146 PolarHBondContact O-N 3.07Å; K144-F146 HydrophobicContact CB-CD2 4.4Å; K144-F146 HydrophobicContact CB-CE1 4.3Å; K144-F146 HydrophobicContact CB-CE2 3.52Å; K144-F146 HydrophobicContact CB-CZ 3.46Å; K144-F146 VanDerWaalsContact CB-CZ 3.46Å; K144-F146 HydrophobicContact CD-CZ 4.23Å; K144-F146 HydrophobicContact CG-CZ 4.47Å; K144-F146 WeakPolarHBondContact O-CD2 3.36Å; K144-F146 WeakPolarHBondContact O-CE2 3.49Å; F146-S148 VanDerWaalsContact C-N 3.33Å; F146-S148 WeakPolarHBondContact CB-O 3.48Å; F146-H151 HydrophobicContact CD1-CB 4.41Å; F146-H151 AromaticContact CD1-CE1 3.92Å; F146-H151 AromaticContact CD1-CG 3.86Å; F146-H151 AromaticContact CD1-ND1 3.7Å; F146-L152 HydrophobicContact CB-CB 4.04Å; F146-L152 HydrophobicContact CD2-CB 3.52Å; F146-L152 HydrophobicContact CD2-CD1 3.86Å; F146-L152 HydrophobicContact CD2-CG 3.64Å; F146-L152 HydrophobicContact CE2-CB 4.05Å; F146-L152 HydrophobicContact CE2-CD1 4.4Å; F146-L152 HydrophobicContact CE2-CG 3.89Å; F146-L152 HydrophobicContact CG-CB 3.79Å; F146-L152 HydrophobicContact CG-CG 4.42Å; F146-H155 HydrophobicContact CE1-CB 3.66Å; F146-H155 AromaticContact CE1-CG 3.89Å; F146-H155 HydrophobicContact CZ-CB 3.61Å; F146-H155 AromaticContact CZ-CG 3.54Å; F146-H155 AromaticContact CZ-ND1 3.69Å; F146-Y156 HydrophobicContact CE2-CE2 4.22Å
147	D	88.7	Confident	78.4	Confident	78 Å²	78	56.6 Å²	56.6	42%	0.417	28%	0.284	S	S	.	.	S	Bend	trans	-78.4	-17.7	173.9	-67.7	-73.7	0	0	0	113.5	K130	K130-D147 IonicContact NZ-OD1 2.81Å; K130-D147 PolarHBondContact NZ-OD1 2.96Å; K130-D147 IonicContact NZ-OD2 3.95Å; K130-D147 PolarHBondContact NZ-OD2 2.82Å
148	S	90.4	Very high	79.8	Confident	8 Å²	8	57.9 Å²	57.9	6%	0.056	29%	0.286	C	S	.	.			trans	-133.6	140.8	178.6	171.6	0	0	0	0	110.9	E69 F146 V150 H151 L152 Y225	E69-S148 WeakPolarHBondContact OE2-CB 3.45Å; E69-S148 PolarHBondContact OE2-OG 2.91Å; F146-S148 VanDerWaalsContact C-N 3.33Å; F146-S148 WeakPolarHBondContact CB-O 3.48Å; S148-V150 VanDerWaalsContact C-N 3.28Å; S148-V150 PolarHBondContact O-N 3.2Å; S148-V150 PolarHBondContact OG-N 3.31Å; S148-V150 VanDerWaalsContact OG-N 3.12Å; S148-H151 PolarHBondContact O-N 3.48Å; S148-L152 PolarHBondContact O-N 3.37Å; S148-Y225 WeakPolarHBondContact CB-OH 3.48Å; S148-Y225 PolarHBondContact OG-OH 3.23Å
149	V	92.4	Very high	80.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-35.4	172.6	-179.7	0	0	0	0	111.1	A66 L70 L99 F109 I124 F131 H151 L152 V153	A66-V149 HydrophobicContact CB-CG2 4.37Å; L70-V149 HydrophobicContact CD1-CB 4.2Å; L70-V149 HydrophobicContact CD1-CG1 4.29Å; L70-V149 HydrophobicContact CD1-CG2 4.49Å; L70-V149 HydrophobicContact CD2-CB 4.28Å; L70-V149 HydrophobicContact CD2-CG1 4.09Å; L70-V149 HydrophobicContact CG-CB 4.43Å; L99-V149 HydrophobicContact CD1-CG1 4.29Å; L99-V149 HydrophobicContact CD2-CG1 3.76Å; F109-V149 HydrophobicContact CD2-CG2 3.74Å; F109-V149 HydrophobicContact CE2-CG2 3.93Å; I124-V149 HydrophobicContact CD1-CG1 3.84Å; F131-V149 HydrophobicContact CB-CG2 4.37Å; F131-V149 HydrophobicContact CD1-CG2 3.41Å; F131-V149 VanDerWaalsContact CD1-CG2 3.41Å; F131-V149 HydrophobicContact CD2-CG2 3.94Å; F131-V149 HydrophobicContact CE1-CG2 3.53Å; F131-V149 HydrophobicContact CE2-CG2 4.05Å; F131-V149 HydrophobicContact CG-CG2 3.62Å; F131-V149 HydrophobicContact CZ-CG2 3.86Å; V149-H151 VanDerWaalsContact C-N 3.34Å; V149-L152 WeakPolarHBondContact O-CB 3.34Å; V149-L152 PolarHBondContact O-N 2.87Å; V149-V153 WeakPolarHBondContact O-CG2 3.36Å; V149-V153 PolarHBondContact O-N 3.39Å
150	V	92.6	Very high	82.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-42.4	178.3	-173	0	0	0	0	110.1	E69 L70 T73 W75 S148 L152 V153 E154 Y223 Y225	E69-V150 HydrophobicContact CB-CG2 3.89Å; L70-V150 HydrophobicContact CD2-CG2 3.77Å; L70-V150 HydrophobicContact CG-CG2 4.21Å; T73-V150 HydrophobicContact CG2-CG1 4.09Å; T73-V150 HydrophobicContact CG2-CG2 3.69Å; W75-V150 HydrophobicContact CH2-CG1 4.44Å; W75-V150 HydrophobicContact CH2-CG2 4.5Å; W75-V150 HydrophobicContact CZ2-CG1 4.12Å; S148-V150 VanDerWaalsContact C-N 3.28Å; S148-V150 PolarHBondContact O-N 3.2Å; S148-V150 PolarHBondContact OG-N 3.31Å; S148-V150 VanDerWaalsContact OG-N 3.12Å; V150-L152 VanDerWaalsContact C-N 3.35Å; V150-L152 PolarHBondContact O-N 2.75Å; V150-V153 PolarHBondContact O-N 3.32Å; V150-E154 WeakPolarHBondContact O-CB 3.04Å; V150-E154 PolarHBondContact O-N 3.4Å; V150-Y223 HydrophobicContact CG1-CE2 4.35Å; V150-Y225 HydrophobicContact CB-CD1 4.5Å; V150-Y225 HydrophobicContact CB-CD2 4.01Å; V150-Y225 HydrophobicContact CB-CE1 4.29Å; V150-Y225 HydrophobicContact CB-CE2 3.72Å; V150-Y225 HydrophobicContact CB-CG 4.36Å; V150-Y225 HydrophobicContact CG1-CD1 3.89Å; V150-Y225 HydrophobicContact CG1-CD2 3.31Å; V150-Y225 HydrophobicContact CG1-CE1 4.17Å; V150-Y225 HydrophobicContact CG1-CE2 3.59Å; V150-Y225 HydrophobicContact CG1-CG 3.45Å; V150-Y225 VanDerWaalsContact CG1-CG 3.45Å; V150-Y225 HydrophobicContact CG2-CE2 4.47Å
151	H	91.6	Very high	83.6	Confident	82 Å²	82	53.4 Å²	53.4	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-41.5	174.7	-172.7	-163.2	0	0	0	112	F146 S148 V149 E154 H155 Y225	F146-H151 HydrophobicContact CD1-CB 4.41Å; F146-H151 AromaticContact CD1-CE1 3.92Å; F146-H151 AromaticContact CD1-CG 3.86Å; F146-H151 AromaticContact CD1-ND1 3.7Å; S148-H151 PolarHBondContact O-N 3.48Å; V149-H151 VanDerWaalsContact C-N 3.34Å; H151-E154 PolarHBondContact O-N 3.18Å; H151-H155 WeakPolarHBondContact O-CB 3.46Å; H151-H155 PolarHBondContact O-N 2.91Å; H151-Y225 HydrophobicContact CB-CE1 3.75Å
152	L	91.8	Very high	84.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-55.8	-52.7	173.1	179.7	158.4	0	0	0	110.7	I111 I124 F131 L133 F146 S148 V149 V150 E154 H155 Y156	I111-L152 HydrophobicContact CD1-CD2 4.22Å; I124-L152 HydrophobicContact CG2-CD1 4.27Å; F131-L152 HydrophobicContact CB-CD1 4.06Å; L133-L152 HydrophobicContact CD2-CD2 3.96Å; L133-L152 HydrophobicContact CG-CD2 4.07Å; F146-L152 HydrophobicContact CB-CB 4.04Å; F146-L152 HydrophobicContact CD2-CB 3.52Å; F146-L152 HydrophobicContact CD2-CD1 3.86Å; F146-L152 HydrophobicContact CD2-CG 3.64Å; F146-L152 HydrophobicContact CE2-CB 4.05Å; F146-L152 HydrophobicContact CE2-CD1 4.4Å; F146-L152 HydrophobicContact CE2-CG 3.89Å; F146-L152 HydrophobicContact CG-CB 3.79Å; F146-L152 HydrophobicContact CG-CG 4.42Å; S148-L152 PolarHBondContact O-N 3.37Å; V149-L152 WeakPolarHBondContact O-CB 3.34Å; V149-L152 PolarHBondContact O-N 2.87Å; V150-L152 VanDerWaalsContact C-N 3.35Å; V150-L152 PolarHBondContact O-N 2.75Å; L152-E154 PolarHBondContact O-N 2.82Å; L152-H155 PolarHBondContact O-N 2.98Å; L152-Y156 HydrophobicContact CD2-CD2 3.86Å; L152-Y156 HydrophobicContact CD2-CE2 4Å; L152-Y156 HydrophobicContact CG-CD2 4.21Å; L152-Y156 HydrophobicContact CG-CE2 4.02Å; L152-Y156 WeakPolarHBondContact O-CD2 3.46Å; L152-Y156 PolarHBondContact O-N 2.98Å
153	V	91.4	Very high	84.8	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-46.3	-179.5	172.3	0	0	0	0	110.8	W75 F97 I111 V149 V150 H155 Y156 V157 V227	W75-V153 HydrophobicContact CH2-CB 4Å; W75-V153 HydrophobicContact CH2-CG1 3.94Å; W75-V153 HydrophobicContact CH2-CG2 4Å; W75-V153 HydrophobicContact CZ2-CG1 4.27Å; W75-V153 HydrophobicContact CZ3-CG1 4.39Å; W75-V153 HydrophobicContact CZ3-CG2 4.22Å; F97-V153 HydrophobicContact CD2-CG1 4.47Å; F97-V153 HydrophobicContact CE2-CG1 3.58Å; F97-V153 HydrophobicContact CZ-CG1 3.82Å; I111-V153 HydrophobicContact CD1-CG2 3.92Å; I111-V153 HydrophobicContact CG1-CG2 4.46Å; V149-V153 WeakPolarHBondContact O-CG2 3.36Å; V149-V153 PolarHBondContact O-N 3.39Å; V150-V153 PolarHBondContact O-N 3.32Å; V153-H155 VanDerWaalsContact C-N 3.32Å; V153-H155 PolarHBondContact O-N 2.6Å; V153-Y156 PolarHBondContact O-N 3.47Å; V153-V157 HydrophobicContact CG1-CG2 4.15Å; V153-V157 VanDerWaalsContact O-CG2 3.28Å; V153-V157 WeakPolarHBondContact O-CG2 3.41Å; V153-V157 PolarHBondContact O-N 3.42Å; V153-V227 HydrophobicContact CG1-CG1 4.24Å
154	E	89.8	Confident	83.8	Confident	18 Å²	18	46.1 Å²	46.1	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-57	-45.7	178.2	-179.4	175.8	-133.2	0	0	111.8	V150 H151 L152 Y156 V157 Q158 Y225 N226	V150-E154 WeakPolarHBondContact O-CB 3.04Å; V150-E154 PolarHBondContact O-N 3.4Å; H151-E154 PolarHBondContact O-N 3.18Å; L152-E154 PolarHBondContact O-N 2.82Å; E154-Y156 VanDerWaalsContact C-N 3.34Å; E154-Y156 PolarHBondContact O-N 3.32Å; E154-V157 PolarHBondContact O-N 3.16Å; E154-Q158 HydrophobicContact CG-CG 4.26Å; E154-Q158 WeakPolarHBondContact O-CB 3.35Å; E154-Q158 WeakPolarHBondContact O-CG 3.46Å; E154-Q158 PolarHBondContact O-N 3.06Å; E154-Y225 HydrophobicContact CB-CD1 4.46Å; E154-Y225 WeakPolarHBondContact OE2-CD1 3.46Å; E154-N226 VanDerWaalsContact OE1-CB 3.26Å; E154-N226 WeakPolarHBondContact OE1-CB 3.34Å; E154-N226 PolarHBondContact OE1-N 3.35Å; E154-N226 PolarHBondContact OE1-ND2 3.39Å
155	H	88.9	Confident	82	Confident	36 Å²	36	52.3 Å²	52.3	17%	0.167	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-45.3	178.2	173.6	-89.4	0	0	0	111.9	K144 F146 H151 L152 V153 V157 Q158 L159	K144-H155 WeakPolarHBondContact CD-NE2 3.28Å; K144-H155 PolarHBondContact NZ-NE2 3.38Å; F146-H155 HydrophobicContact CE1-CB 3.66Å; F146-H155 AromaticContact CE1-CG 3.89Å; F146-H155 HydrophobicContact CZ-CB 3.61Å; F146-H155 AromaticContact CZ-CG 3.54Å; F146-H155 AromaticContact CZ-ND1 3.69Å; H151-H155 WeakPolarHBondContact O-CB 3.46Å; H151-H155 PolarHBondContact O-N 2.91Å; L152-H155 PolarHBondContact O-N 2.98Å; V153-H155 VanDerWaalsContact C-N 3.32Å; V153-H155 PolarHBondContact O-N 2.6Å; H155-V157 VanDerWaalsContact C-N 3.35Å; H155-Q158 PolarHBondContact O-N 3.45Å; H155-L159 WeakPolarHBondContact O-CB 3.32Å; H155-L159 PolarHBondContact O-N 2.82Å
156	Y	86.5	Confident	79.8	Confident	19 Å²	19	49.8 Å²	49.8	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-72.2	-28.4	178.7	-73.8	-74.4	0	0	0	113	L133 L138 F146 L152 V153 E154 L159 S160	L133-Y156 HydrophobicContact CD1-CD1 4.19Å; L133-Y156 HydrophobicContact CD1-CD2 3.7Å; L133-Y156 HydrophobicContact CD1-CE1 3.87Å; L133-Y156 HydrophobicContact CD1-CE2 3.35Å; L133-Y156 HydrophobicContact CD1-CG 4.12Å; L133-Y156 VanDerWaalsContact CD1-CZ 3.45Å; L133-Y156 HydrophobicContact CG-CD2 4.34Å; L133-Y156 HydrophobicContact CG-CE2 3.75Å; L138-Y156 HydrophobicContact CD1-CE1 4.19Å; F146-Y156 HydrophobicContact CE2-CE2 4.22Å; L152-Y156 HydrophobicContact CD2-CD2 3.86Å; L152-Y156 HydrophobicContact CD2-CE2 4Å; L152-Y156 HydrophobicContact CG-CD2 4.21Å; L152-Y156 HydrophobicContact CG-CE2 4.02Å; L152-Y156 WeakPolarHBondContact O-CD2 3.46Å; L152-Y156 PolarHBondContact O-N 2.98Å; V153-Y156 PolarHBondContact O-N 3.47Å; E154-Y156 VanDerWaalsContact C-N 3.34Å; E154-Y156 PolarHBondContact O-N 3.32Å; Y156-L159 HydrophobicContact CD1-CD2 4.29Å; Y156-S160 WeakPolarHBondContact O-CB 3.37Å; Y156-S160 PolarHBondContact O-N 3.44Å; Y156-S160 PolarHBondContact O-OG 2.63Å
157	V	88.3	Confident	77.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-42.6	171	171	0	0	0	0	111.2	F97 V153 E154 H155 S160 R161 L181 V227	F97-V157 HydrophobicContact CE1-CG2 3.81Å; F97-V157 HydrophobicContact CZ-CG2 3.92Å; V153-V157 HydrophobicContact CG1-CG2 4.15Å; V153-V157 VanDerWaalsContact O-CG2 3.28Å; V153-V157 WeakPolarHBondContact O-CG2 3.41Å; V153-V157 PolarHBondContact O-N 3.42Å; E154-V157 PolarHBondContact O-N 3.16Å; H155-V157 VanDerWaalsContact C-N 3.35Å; V157-S160 WeakPolarHBondContact O-CB 3.49Å; V157-S160 PolarHBondContact O-N 2.87Å; V157-R161 WeakPolarHBondContact O-CG 3.26Å; V157-R161 PolarHBondContact O-N 2.93Å; V157-L181 WeakPolarHBondContact CA-O 3.26Å; V157-L181 HydrophobicContact CG2-CB 3.66Å; V157-V227 HydrophobicContact CB-CG2 4.42Å; V157-V227 HydrophobicContact CG1-CG2 3.93Å; V157-V227 HydrophobicContact CG2-CG2 4.12Å
158	Q	85.1	Confident	75.4	Confident	85 Å²	85	55.7 Å²	55.7	40%	0.397	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-43.8	174.3	-71.3	176.8	6.8	0	0	111.2	E154 H155 S160 R161 S162	E154-Q158 HydrophobicContact CG-CG 4.26Å; E154-Q158 WeakPolarHBondContact O-CB 3.35Å; E154-Q158 WeakPolarHBondContact O-CG 3.46Å; E154-Q158 PolarHBondContact O-N 3.06Å; H155-Q158 PolarHBondContact O-N 3.45Å; Q158-S160 VanDerWaalsContact C-N 3.28Å; Q158-S160 PolarHBondContact O-N 3.24Å; Q158-R161 WeakPolarHBondContact O-CB 3.33Å; Q158-R161 PolarHBondContact O-N 3.32Å; Q158-R161 VanDerWaalsContact O-N 3.07Å; Q158-S162 PolarHBondContact O-N 2.75Å; Q158-S162 PolarHBondContact O-OG 3.04Å; Q158-S162 VanDerWaalsContact O-OG 3.13Å
159	L	82.9	Confident	73.3	Confident	94 Å²	94	58.6 Å²	58.6	49%	0.492	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-41.4	176.8	-173.9	62.2	0	0	0	111.6	H155 Y156 R161 S162 G163	H155-L159 WeakPolarHBondContact O-CB 3.32Å; H155-L159 PolarHBondContact O-N 2.82Å; Y156-L159 HydrophobicContact CD1-CD2 4.29Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 3.29Å; L159-S162 WeakPolarHBondContact CA-OG 3.49Å; L159-S162 PolarHBondContact O-N 3.44Å; L159-S162 PolarHBondContact O-OG 2.97Å; L159-S162 VanDerWaalsContact O-OG 3.05Å; L159-G163 PolarHBondContact O-N 2.92Å
160	S	81.9	Confident	71.1	Confident	15 Å²	15	63.7 Å²	63.7	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-61.8	-39.3	174.7	-63.9	0	0	0	0	112.3	Y156 V157 Q158 G164 L181	Y156-S160 WeakPolarHBondContact O-CB 3.37Å; Y156-S160 PolarHBondContact O-N 3.44Å; Y156-S160 PolarHBondContact O-OG 2.63Å; V157-S160 WeakPolarHBondContact O-CB 3.49Å; V157-S160 PolarHBondContact O-N 2.87Å; Q158-S160 VanDerWaalsContact C-N 3.28Å; Q158-S160 PolarHBondContact O-N 3.24Å; S160-G164 PolarHBondContact O-N 3.31Å; S160-L181 VanDerWaalsContact CB-O 3.26Å; S160-L181 WeakPolarHBondContact CB-O 3.34Å; S160-L181 PolarHBondContact OG-N 3.39Å; S160-L181 PolarHBondContact OG-O 3.17Å
161	R	79.8	Confident	68.9	Low	108 Å²	108	69.4 Å²	69.4	41%	0.408	42%	0.421	S	S	.	.	H	α-helix	trans	-71.1	-39.5	176.9	-70.2	171.5	-179.9	164.9	4.1	112.8	V157 Q158 L159	V157-R161 WeakPolarHBondContact O-CG 3.26Å; V157-R161 PolarHBondContact O-N 2.93Å; Q158-R161 WeakPolarHBondContact O-CB 3.33Å; Q158-R161 PolarHBondContact O-N 3.32Å; Q158-R161 VanDerWaalsContact O-N 3.07Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 3.29Å
162	S	69.4	Low	66.8	Low	71 Å²	71	67.5 Å²	67.5	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-76	-34.2	178.1	55.2	0	0	0	0	112.5	Q158 L159 G164 R165	Q158-S162 PolarHBondContact O-N 2.75Å; Q158-S162 PolarHBondContact O-OG 3.04Å; Q158-S162 VanDerWaalsContact O-OG 3.13Å; L159-S162 WeakPolarHBondContact CA-OG 3.49Å; L159-S162 PolarHBondContact O-N 3.44Å; L159-S162 PolarHBondContact O-OG 2.97Å; L159-S162 VanDerWaalsContact O-OG 3.05Å; S162-G164 VanDerWaalsContact C-N 3.33Å; S162-R165 PolarHBondContact O-N 3.05Å
163	G	59.9	Low	64.7	Low	49 Å²	49	73.9 Å²	73.9	51%	0.505	47%	0.465	S	S	.	.	H	α-helix	trans	-68	-30.9	178	0	0	0	0	0	113	L159 R165 A166	L159-G163 PolarHBondContact O-N 2.92Å; G163-R165 PolarHBondContact O-N 2.8Å; G163-A166 PolarHBondContact O-N 3.4Å
164	G	49.2	Very low	62.5	Low	65 Å²	65	80.5 Å²	80.5	67%	0.67	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	0.5	174.7	0	0	0	0	0	115.8	S160 S162	S160-G164 PolarHBondContact O-N 3.31Å; S162-G164 VanDerWaalsContact C-N 3.33Å
165	R	42.9	Very low	60.7	Low	234 Å²	234	82.8 Å²	82.8	88%	0.883	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-13.8	171.8	-81.7	-175.1	156.9	-176	-5.5	113.7	S162 G163	S162-R165 PolarHBondContact O-N 3.05Å; G163-R165 PolarHBondContact O-N 2.8Å
166	A	42.4	Very low	59	Low	72 Å²	72	84.8 Å²	84.8	60%	0.595	54%	0.543	S	S	*	.	S	Bend	trans	-73.3	133.4	160.8	0	0	0	0	0	106.9	G163	G163-A166 PolarHBondContact O-N 3.4Å
167	A	41.7	Very low	57.7	Low	81 Å²	81	88.1 Å²	88.1	67%	0.669	56%	0.561	S	S	*	*			trans	-39.6	147.9	174.5	0	0	0	0	0	111.1	A169	A167-A169 VanDerWaalsContact C-N 3.33Å; A167-A169 PolarHBondContact O-N 2.88Å
168	P	43.8	Very low	56.7	Low	131 Å²	131	94.7 Å²	94.7	85%	0.851	59%	0.592	S	S	*	*			trans	-49.9	102.2	178.7	20.7	-32	0	0	0	108.3
169	A	46.1	Very low	56.2	Low	69 Å²	69	92.4 Å²	92.4	57%	0.57	58%	0.582	S	S	*	*			trans	-61.6	131.1	177.6	0	0	0	0	0	104.7	A167	A167-A169 VanDerWaalsContact C-N 3.33Å; A167-A169 PolarHBondContact O-N 2.88Å
170	P	46.7	Very low	56.2	Low	108 Å²	108	90.4 Å²	90.4	70%	0.701	57%	0.572	S	S	*	*			trans	-50.3	144.6	173.4	21.9	-31.5	0	0	0	107.8	G172	P170-G172 PolarHBondContact O-N 3.39Å
171	P	46.9	Very low	56.4	Low	120 Å²	120	89.7 Å²	89.7	78%	0.779	57%	0.567	S	S	*	*			trans	-49.4	113	174.7	20.7	-30.7	0	0	0	106.6
172	G	47.8	Very low	56.7	Low	42 Å²	42	86.2 Å²	86.2	43%	0.433	56%	0.557	S	S	.	*			trans	-51.8	146.4	175.4	0	0	0	0	0	107.2	P170 N174 G175	P170-G172 PolarHBondContact O-N 3.39Å; G172-N174 PolarHBondContact O-N 2.78Å; G172-G175 PolarHBondContact O-N 2.98Å
173	P	46.8	Very low	57.7	Low	134 Å²	134	89.8 Å²	89.8	87%	0.87	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-0.8	-163.7	18.2	-30.9	0	0	0	116.1
174	N	46	Very low	59.3	Low	138 Å²	138	88.4 Å²	88.4	74%	0.738	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	18.4	-169.1	-58.3	-15.4	0	0	0	115.1	G172 T176	G172-N174 PolarHBondContact O-N 2.78Å; N174-T176 PolarHBondContact O-N 3.48Å; N174-T176 VanDerWaalsContact O-N 3.11Å
175	G	51.7	Low	61.5	Low	66 Å²	66	86.6 Å²	86.6	68%	0.68	52%	0.518	S	S	*	.			trans	60.7	28.8	172.8	0	0	0	0	0	114.7	G172 I177	G172-G175 PolarHBondContact O-N 2.98Å; G175-I177 PolarHBondContact O-N 3.07Å; G175-I177 VanDerWaalsContact O-N 3.1Å
176	T	53.8	Low	63.8	Low	79 Å²	79	78.7 Å²	78.7	49%	0.485	49%	0.489	S	S	.	.			trans	-65	112.9	-177.6	-48.4	0	0	0	0	110	V139 N174 Q178	V139-T176 HydrophobicContact CB-CG2 4.35Å; V139-T176 HydrophobicContact CG2-CG2 3.92Å; N174-T176 PolarHBondContact O-N 3.48Å; N174-T176 VanDerWaalsContact O-N 3.11Å; T176-Q178 PolarHBondContact O-N 2.97Å; T176-Q178 VanDerWaalsContact O-N 3.14Å
177	I	58.8	Low	66	Low	88 Å²	88	77.5 Å²	77.5	45%	0.451	48%	0.479	S	S	.	.			trans	-62.9	114.1	175.6	-59	165.8	0	0	0	107.7	T115 A117 G175	T115-I177 HydrophobicContact CG2-CG2 3.99Å; A117-I177 HydrophobicContact CB-CD1 3.47Å; A117-I177 VanDerWaalsContact CB-CD1 3.47Å; A117-I177 HydrophobicContact CB-CG1 3.81Å; G175-I177 PolarHBondContact O-N 3.07Å; G175-I177 VanDerWaalsContact O-N 3.1Å
178	Q	66.2	Low	68	Low	140 Å²	140	76.9 Å²	76.9	65%	0.654	47%	0.474	S	S	*	.			trans	-79.8	124.8	174.9	-63.6	-171.9	36.3	0	0	108.8	T176 L180	T176-Q178 PolarHBondContact O-N 2.97Å; T176-Q178 VanDerWaalsContact O-N 3.14Å; Q178-L180 PolarHBondContact O-N 3.42Å; Q178-L180 VanDerWaalsContact O-N 3.11Å
179	L	75.5	Confident	69.9	Low	37 Å²	37	77.2 Å²	77.2	19%	0.194	47%	0.473	C	S	.	.			trans	-69	110.5	172.7	173.8	56.5	0	0	0	109.3	L122 L133 L138 L181	L122-L179 HydrophobicContact CD1-CD1 3.28Å; L122-L179 HydrophobicContact CD1-CD2 3.75Å; L122-L179 HydrophobicContact CD1-CG 4.16Å; L122-L179 HydrophobicContact CD2-CD1 4.42Å; L122-L179 HydrophobicContact CD2-CD2 4.16Å; L122-L179 HydrophobicContact CG-CD1 4.42Å; L133-L179 HydrophobicContact CD1-CD2 4.06Å; L138-L179 HydrophobicContact CD1-CD2 4.35Å; L138-L179 HydrophobicContact CD2-CB 3.76Å; L138-L179 HydrophobicContact CD2-CD2 3.8Å; L138-L179 HydrophobicContact CD2-CG 4.43Å; L179-L181 HydrophobicContact CD1-CD2 3.93Å; L179-L181 HydrophobicContact CD1-CG 4.12Å; L179-L181 HydrophobicContact CG-CG 4.34Å
180	L	82.5	Confident	71.8	Confident	52 Å²	52	75 Å²	75	27%	0.272	45%	0.453	S	S	.	.			trans	-110.2	121.8	174.3	-168.9	72.6	0	0	0	110.1	E94 G95 Q178 T182	E94-L180 HydrophobicContact CG-CD2 4.19Å; G95-L180 WeakPolarHBondContact CA-O 3.44Å; Q178-L180 PolarHBondContact O-N 3.42Å; Q178-L180 VanDerWaalsContact O-N 3.11Å; L180-T182 HydrophobicContact CD1-CG2 3.94Å; L180-T182 HydrophobicContact CD2-CG2 3.98Å; L180-T182 HydrophobicContact CG-CG2 3.76Å
181	L	86.7	Confident	73.9	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	44%	0.44	C	S	.	.			trans	-119.3	107.6	170.5	-58.6	-178.3	0	0	0	108.3	F97 I111 A113 V157 S160 L179	F97-L181 HydrophobicContact CB-CD2 3.64Å; F97-L181 HydrophobicContact CD1-CB 4.03Å; F97-L181 HydrophobicContact CD1-CD2 4.15Å; F97-L181 HydrophobicContact CE1-CB 4.32Å; F97-L181 HydrophobicContact CG-CD2 3.9Å; I111-L181 HydrophobicContact CD1-CD1 4.43Å; I111-L181 HydrophobicContact CG2-CD2 4.12Å; A113-L181 HydrophobicContact CB-CD2 3.72Å; V157-L181 WeakPolarHBondContact CA-O 3.26Å; V157-L181 HydrophobicContact CG2-CB 3.66Å; S160-L181 VanDerWaalsContact CB-O 3.26Å; S160-L181 WeakPolarHBondContact CB-O 3.34Å; S160-L181 PolarHBondContact OG-N 3.39Å; S160-L181 PolarHBondContact OG-O 3.17Å; L179-L181 HydrophobicContact CD1-CD2 3.93Å; L179-L181 HydrophobicContact CD1-CG 4.12Å; L179-L181 HydrophobicContact CG-CG 4.34Å
182	T	86.8	Confident	76.1	Confident	34 Å²	34	73.4 Å²	73.4	21%	0.209	44%	0.436	C	S	.	.			trans	-121.7	-44.2	-179	60	0	0	0	0	113.3	G95 L180	G95-T182 PolarHBondContact O-N 3.39Å; G95-T182 PolarHBondContact O-OG1 3Å; L180-T182 HydrophobicContact CD1-CG2 3.94Å; L180-T182 HydrophobicContact CD2-CG2 3.98Å; L180-T182 HydrophobicContact CG-CG2 3.76Å
183	R	90.4	Very high	78.2	Confident	146 Å²	146	76.4 Å²	76.4	55%	0.551	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.5	-170.2	-64.5	-174.3	-174.1	89.2	0.6	111.1	G95 S96 F97	G95-R183 PolarHBondContact O-N 2.81Å; G95-R183 VanDerWaalsContact O-N 3.09Å; S96-R183 CarbonylContact C-O 3.6Å; S96-R183 VanDerWaalsContact CA-O 3.29Å; S96-R183 WeakPolarHBondContact CA-O 3.4Å; F97-R183 VanDerWaalsContact CD1-O 3.26Å; F97-R183 WeakPolarHBondContact CD1-O 3.34Å; F97-R183 VanDerWaalsContact CE1-C 3.45Å; F97-R183 PolarHBondContact N-O 3.25Å
184	P	93.5	Very high	80.3	Confident	20 Å²	20	70.6 Å²	70.6	13%	0.13	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	137.2	171.2	26.5	-31	0	0	0	110.4	W75 F97 Y186 V227	W75-P184 HydrophobicContact CB-CB 3.58Å; W75-P184 VanDerWaalsContact CD1-CB 3.41Å; W75-P184 HydrophobicContact CD2-CB 4.37Å; W75-P184 HydrophobicContact CG-CB 3.51Å; F97-P184 HydrophobicContact CE1-CB 4.15Å; F97-P184 HydrophobicContact CE2-CB 4.1Å; F97-P184 HydrophobicContact CZ-CB 3.71Å; F97-P184 HydrophobicContact CZ-CG 4.36Å; F97-P184 CarbonylContact O-C 3.58Å; F97-P184 WeakPolarHBondContact O-CA 3.49Å; P184-Y186 HydrophobicContact CB-CE2 4.39Å; P184-Y186 HydrophobicContact CG-CE2 3.84Å; P184-V227 HydrophobicContact CG-CG2 4.35Å
185	V	94.3	Very high	82.4	Confident	27 Å²	27	67.5 Å²	67.5	16%	0.164	38%	0.383	C	S	.	.			trans	-93.4	111.2	170.1	-175.8	0	0	0	0	107.3	W77 I88 L89 F97 L98	W77-V185 HydrophobicContact CZ2-CG1 3.99Å; W77-V185 PolarHBondContact NE1-O 3.38Å; I88-V185 HydrophobicContact CG2-CG1 3.93Å; L89-V185 HydrophobicContact CD2-CG2 4.01Å; F97-V185 PolarHBondContact O-N 3.22Å; L98-V185 HydrophobicContact CB-CB 4.35Å
186	Y	91.4	Very high	84.4	Confident	69 Å²	69	67.2 Å²	67.2	27%	0.271	37%	0.37	S	S	.	.			trans	-78.4	132.7	-174.8	-68.5	-84.8	0	0	0	111.7	T73 G74 W75 W77 P184 A188 P190 V227	T73-Y186 WeakPolarHBondContact O-CE1 3.47Å; G74-Y186 CarbonylContact O-C 3.53Å; G74-Y186 WeakPolarHBondContact O-CA 3.38Å; W75-Y186 HydrophobicContact CB-CD1 4.29Å; W75-Y186 AromaticContact CD1-CE1 3.9Å; W77-Y186 WeakPolarHBondContact CZ2-O 3.2Å; P184-Y186 HydrophobicContact CB-CE2 4.39Å; P184-Y186 HydrophobicContact CG-CE2 3.84Å; Y186-A188 WeakPolarHBondContact CB-O 3.47Å; Y186-P190 HydrophobicContact CD1-CG 3.31Å; Y186-P190 HydrophobicContact CE1-CG 3.41Å; Y186-P190 VanDerWaalsContact CE1-CG 3.41Å; Y186-P190 HydrophobicContact CG-CG 3.94Å; Y186-V227 PolarHBondContact OH-OXT 2.65Å
187	A	88.8	Confident	86.2	Confident	47 Å²	47	64 Å²	64	39%	0.388	35%	0.349	S	S	.	.	S	Bend	trans	-72.8	-32.4	174.7	0	0	0	0	0	112	G74 W77	G74-A187 PolarHBondContact O-N 2.8Å; W77-A187 HydrophobicContact CD2-CB 3.65Å; W77-A187 HydrophobicContact CE3-CB 4.07Å; W77-A187 HydrophobicContact CG-CB 3.89Å; W77-A187 VanDerWaalsContact CZ2-CA 3.5Å; W77-A187 HydrophobicContact CZ2-CB 4.18Å
188	A	83	Confident	87.7	Confident	67 Å²	67	60 Å²	60	55%	0.554	33%	0.329	S	S	*	.	S	Bend	trans	-139.5	150.9	174.1	0	0	0	0	0	108.8	Y186 P190	Y186-A188 WeakPolarHBondContact CB-O 3.47Å; A188-P190 WeakPolarHBondContact O-CD 3.45Å; A188-P190 VanDerWaalsContact O-N 3.15Å
189	V	84.4	Confident	88.8	Confident	138 Å²	138	56.7 Å²	56.7	84%	0.836	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-61.5	118.2	176.5	-177.8	0	0	0	0	108.5
190	P	86.1	Confident	89.6	Confident	22 Å²	22	58 Å²	58	14%	0.143	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-64.3	153.6	177.9	-19	31.7	0	0	0	110.9	Y186 A188 H194 L195	Y186-P190 HydrophobicContact CD1-CG 3.31Å; Y186-P190 HydrophobicContact CE1-CG 3.41Å; Y186-P190 VanDerWaalsContact CE1-CG 3.41Å; Y186-P190 HydrophobicContact CG-CG 3.94Å; A188-P190 WeakPolarHBondContact O-CD 3.45Å; A188-P190 VanDerWaalsContact O-N 3.15Å; P190-H194 HydrophobicContact CB-CB 4.4Å; P190-L195 HydrophobicContact CB-CD2 3.99Å; P190-L195 HydrophobicContact CB-CG 4.18Å; P190-L195 HydrophobicContact CG-CD2 4.05Å
191	S	90.8	Very high	90	Very high	64 Å²	64	56.4 Å²	56.4	45%	0.448	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-61.1	147.7	173.4	71.4	0	0	0	0	110.5	Q193 H194 L195	S191-Q193 PolarHBondContact O-N 2.94Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-H194 WeakPolarHBondContact O-CB 3.5Å; S191-H194 PolarHBondContact O-N 3.17Å; S191-H194 PolarHBondContact OG-N 2.89Å; S191-L195 PolarHBondContact O-N 3.18Å
192	L	92.5	Very high	90	Very high	132 Å²	132	62.3 Å²	62.3	69%	0.691	34%	0.341	S	S	*	.	H	α-helix	trans	-54	-37.7	175.3	-178.6	62.6	0	0	0	111.3	H194 L195 C196	L192-H194 VanDerWaalsContact C-N 3.32Å; L192-H194 PolarHBondContact O-N 2.78Å; L192-L195 PolarHBondContact O-N 2.83Å; L192-C196 WeakPolarHBondContact O-CB 3.44Å; L192-C196 PolarHBondContact O-N 2.77Å; L192-C196 PolarHBondContact O-SG 2.88Å
193	Q	92.6	Very high	89.9	Confident	105 Å²	105	65.3 Å²	65.3	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-58.6	-42.2	176.3	-162.2	-168.6	14.4	0	0	112.3	S191 C196 R197 Y219	S191-Q193 PolarHBondContact O-N 2.94Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; Q193-C196 PolarHBondContact O-N 2.88Å; Q193-R197 PolarHBondContact O-N 2.62Å; Q193-Y219 VanDerWaalsContact CD-CZ 3.49Å; Q193-Y219 HydrophobicContact CG-CD1 4.37Å; Q193-Y219 HydrophobicContact CG-CE1 3.58Å; Q193-Y219 HydrophobicContact CG-CE2 4.46Å
194	H	90.6	Very high	89.7	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.056	35%	0.349	C	S	.	.	H	α-helix	trans	-69.3	-40.6	177.5	-177.4	72.9	0	0	0	112	K72 P190 S191 L192 C196 R197 I198 Y219 Y223	K72-H194 PolarHBondContact O-CE1 2.75Å; K72-H194 PolarHBondContact O-NE2 3.04Å; P190-H194 HydrophobicContact CB-CB 4.4Å; S191-H194 WeakPolarHBondContact O-CB 3.5Å; S191-H194 PolarHBondContact O-N 3.17Å; S191-H194 PolarHBondContact OG-N 2.89Å; L192-H194 VanDerWaalsContact C-N 3.32Å; L192-H194 PolarHBondContact O-N 2.78Å; H194-C196 VanDerWaalsContact C-N 3.34Å; H194-C196 PolarHBondContact O-N 2.85Å; H194-R197 PolarHBondContact CE1-NH2 3.28Å; H194-R197 PolarHBondContact ND1-NE 3.39Å; H194-R197 PolarHBondContact ND1-NH2 3.31Å; H194-R197 WeakPolarHBondContact O-CB 3.38Å; H194-R197 PolarHBondContact O-N 2.85Å; H194-R197 VanDerWaalsContact O-N 3.16Å; H194-I198 VanDerWaalsContact NE2-CD1 3.34Å; H194-I198 WeakPolarHBondContact NE2-CD1 3.21Å; H194-I198 PolarHBondContact O-N 3.11Å; H194-Y219 WeakPolarHBondContact CA-OH 3.39Å; H194-Y219 PolarHBondContact N-OH 2.84Å; H194-Y223 AromaticContact CE1-CE1 3.98Å
195	L	90.3	Very high	89.1	Confident	72 Å²	72	71.1 Å²	71.1	38%	0.377	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-43.1	174.7	-63.3	176	0	0	0	111.4	P190 S191 L192 R197 I198 S199	P190-L195 HydrophobicContact CB-CD2 3.99Å; P190-L195 HydrophobicContact CB-CG 4.18Å; P190-L195 HydrophobicContact CG-CD2 4.05Å; S191-L195 PolarHBondContact O-N 3.18Å; L192-L195 PolarHBondContact O-N 2.83Å; L195-R197 VanDerWaalsContact C-N 3.34Å; L195-I198 PolarHBondContact O-N 3.19Å; L195-S199 WeakPolarHBondContact O-CB 3.39Å; L195-S199 PolarHBondContact O-N 2.9Å
196	C	92.3	Very high	88.7	Confident	60 Å²	60	74.8 Å²	74.8	41%	0.405	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-43.9	172.5	-71.9	0	0	0	0	111.4	L192 Q193 H194 I198 S199 I200	L192-C196 WeakPolarHBondContact O-CB 3.44Å; L192-C196 PolarHBondContact O-N 2.77Å; L192-C196 PolarHBondContact O-SG 2.88Å; Q193-C196 PolarHBondContact O-N 2.88Å; H194-C196 VanDerWaalsContact C-N 3.34Å; H194-C196 PolarHBondContact O-N 2.85Å; C196-I198 PolarHBondContact O-N 2.84Å; C196-S199 PolarHBondContact O-N 2.77Å; C196-I200 WeakPolarHBondContact O-CB 3.37Å; C196-I200 VanDerWaalsContact O-CG1 3.25Å; C196-I200 WeakPolarHBondContact O-CG1 3.29Å; C196-I200 PolarHBondContact O-N 3.1Å
197	R	93.1	Very high	88.5	Confident	12 Å²	12	72.6 Å²	72.6	5%	0.045	40%	0.399	C	S	.	.	H	α-helix	trans	-57	-49.3	175.7	170.6	170.1	75.8	-179.9	11.2	112.4	Q193 H194 L195 S199 I200 N201 Y219 L220	Q193-R197 PolarHBondContact O-N 2.62Å; H194-R197 PolarHBondContact CE1-NH2 3.28Å; H194-R197 PolarHBondContact ND1-NE 3.39Å; H194-R197 PolarHBondContact ND1-NH2 3.31Å; H194-R197 WeakPolarHBondContact O-CB 3.38Å; H194-R197 PolarHBondContact O-N 2.85Å; H194-R197 VanDerWaalsContact O-N 3.16Å; L195-R197 VanDerWaalsContact C-N 3.34Å; R197-S199 VanDerWaalsContact C-N 3.32Å; R197-S199 PolarHBondContact O-N 3.28Å; R197-I200 PolarHBondContact O-N 3.04Å; R197-N201 WeakPolarHBondContact O-CB 3.25Å; R197-N201 PolarHBondContact O-N 3.09Å; R197-Y219 HydrophobicContact CB-CD1 4.43Å; R197-Y219 HydrophobicContact CB-CE1 3.76Å; R197-Y219 WeakPolarHBondContact CD-O 3.46Å; R197-Y219 HydrophobicContact CG-CE1 4.36Å; R197-Y219 PolarHBondContact NH1-O 3.26Å; R197-Y219 VanDerWaalsContact NH1-O 3.13Å; R197-L220 HydrophobicContact CB-CD2 3.72Å; R197-L220 HydrophobicContact CG-CD2 3.66Å
198	I	90	Very high	88.4	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.026	40%	0.403	C	S	.	.	H	α-helix	trans	-60.3	-44.8	177.7	-67.3	169.8	0	0	0	110.5	H194 L195 C196 I200 N201 R202 Y223	H194-I198 VanDerWaalsContact NE2-CD1 3.34Å; H194-I198 WeakPolarHBondContact NE2-CD1 3.21Å; H194-I198 PolarHBondContact O-N 3.11Å; L195-I198 PolarHBondContact O-N 3.19Å; C196-I198 PolarHBondContact O-N 2.84Å; I198-I200 PolarHBondContact O-N 2.89Å; I198-N201 PolarHBondContact O-N 2.7Å; I198-R202 HydrophobicContact CG2-CG 4.49Å; I198-R202 WeakPolarHBondContact O-CB 3.22Å; I198-R202 VanDerWaalsContact O-CG 3.27Å; I198-R202 WeakPolarHBondContact O-CG 3.42Å; I198-R202 PolarHBondContact O-N 2.97Å; I198-Y223 HydrophobicContact CG1-CE1 4.42Å
199	S	90.2	Very high	88.8	Confident	69 Å²	69	77.5 Å²	77.5	48%	0.483	41%	0.405	S	S	.	.	H	α-helix	trans	-61.9	-42.7	-179.7	-168	0	0	0	0	112.4	L195 C196 R197 S203	L195-S199 WeakPolarHBondContact O-CB 3.39Å; L195-S199 PolarHBondContact O-N 2.9Å; C196-S199 PolarHBondContact O-N 2.77Å; R197-S199 VanDerWaalsContact C-N 3.32Å; R197-S199 PolarHBondContact O-N 3.28Å; S199-S203 PolarHBondContact O-N 3.03Å; S199-S203 PolarHBondContact O-OG 2.8Å
200	I	91.5	Very high	89.1	Confident	65 Å²	65	72.9 Å²	72.9	33%	0.333	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-50.4	177	-67.6	164.6	0	0	0	110.2	C196 R197 I198 R202 S203 A204 L210 L220	C196-I200 WeakPolarHBondContact O-CB 3.37Å; C196-I200 VanDerWaalsContact O-CG1 3.25Å; C196-I200 WeakPolarHBondContact O-CG1 3.29Å; C196-I200 PolarHBondContact O-N 3.1Å; R197-I200 PolarHBondContact O-N 3.04Å; I198-I200 PolarHBondContact O-N 2.89Å; I200-R202 PolarHBondContact O-N 3.44Å; I200-S203 PolarHBondContact O-N 2.75Å; I200-A204 HydrophobicContact CG2-CB 4.21Å; I200-A204 VanDerWaalsContact O-CB 3.24Å; I200-A204 WeakPolarHBondContact O-CB 3.38Å; I200-A204 PolarHBondContact O-N 2.8Å; I200-L210 HydrophobicContact CG2-CD1 3.62Å; I200-L220 HydrophobicContact CB-CD2 4.24Å; I200-L220 HydrophobicContact CD1-CD2 4.25Å; I200-L220 HydrophobicContact CG2-CD1 3.79Å; I200-L220 HydrophobicContact CG2-CD2 4.25Å
201	N	90	Very high	89.4	Confident	19 Å²	19	78.2 Å²	78.2	10%	0.102	41%	0.41	C	S	.	.	H	α-helix	trans	-61.1	-31.6	-178.2	-73.2	-5.2	0	0	0	112.6	R197 I198 S203 L220 Y223 N226	R197-N201 WeakPolarHBondContact O-CB 3.25Å; R197-N201 PolarHBondContact O-N 3.09Å; I198-N201 PolarHBondContact O-N 2.7Å; N201-S203 VanDerWaalsContact C-N 3.31Å; N201-S203 PolarHBondContact O-N 2.85Å; N201-L220 PolarHBondContact ND2-O 3.26Å; N201-Y223 PolarHBondContact ND2-O 3.04Å; N201-N226 PolarHBondContact O-OD1 3Å
202	R	86.5	Confident	89.5	Confident	123 Å²	123	77.6 Å²	77.6	46%	0.464	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-30.2	173.5	-78	173.7	-175.2	170.4	7.5	114.1	I198 I200 N226	I198-R202 HydrophobicContact CG2-CG 4.49Å; I198-R202 WeakPolarHBondContact O-CB 3.22Å; I198-R202 VanDerWaalsContact O-CG 3.27Å; I198-R202 WeakPolarHBondContact O-CG 3.42Å; I198-R202 PolarHBondContact O-N 2.97Å; I200-R202 PolarHBondContact O-N 3.44Å; R202-N226 VanDerWaalsContact CA-OD1 3.3Å; R202-N226 WeakPolarHBondContact CA-OD1 3.41Å; R202-N226 HydrophobicContact CG-CB 3.78Å; R202-N226 PolarHBondContact N-OD1 3.22Å; R202-N226 VanDerWaalsContact N-OD1 3.13Å; R202-N226 PolarHBondContact NE-O 3.35Å; R202-N226 PolarHBondContact NH2-O 3Å
203	S	85.7	Confident	89.7	Confident	98 Å²	98	75.5 Å²	75.5	69%	0.685	40%	0.396	S	S	*	.	H	α-helix	trans	-107.4	-29.3	-168.8	-49.9	0	0	0	0	112.5	S199 I200 N201	S199-S203 PolarHBondContact O-N 3.03Å; S199-S203 PolarHBondContact O-OG 2.8Å; I200-S203 PolarHBondContact O-N 2.75Å; N201-S203 VanDerWaalsContact C-N 3.31Å; N201-S203 PolarHBondContact O-N 2.85Å
204	A	85.9	Confident	89.8	Confident	29 Å²	29	75.9 Å²	75.9	24%	0.24	40%	0.402	C	S	.	.			trans	-76.4	131	-179.2	0	0	0	0	0	110.4	I200 L210	I200-A204 HydrophobicContact CG2-CB 4.21Å; I200-A204 VanDerWaalsContact O-CB 3.24Å; I200-A204 WeakPolarHBondContact O-CB 3.38Å; I200-A204 PolarHBondContact O-N 2.8Å; A204-L210 HydrophobicContact CB-CD1 4.35Å; A204-L210 HydrophobicContact CB-CD2 4.41Å
205	R	80.4	Confident	90	Very high	258 Å²	258	85.7 Å²	85.7	97%	0.974	44%	0.438	S	S	*	.	S	Bend	trans	-73.5	-37.7	171.5	-65	-177.6	-179.9	-173.6	0	111.5
206	Q	85.6	Confident	90.1	Very high	104 Å²	104	85.9 Å²	85.9	49%	0.486	44%	0.439	S	S	.	.			trans	-149.4	122.1	179.9	179	164.7	-59.6	0	0	109.4	Q208 D209	Q206-Q208 HydrophobicContact CG-CB 4.02Å; Q206-Q208 HydrophobicContact CG-CG 4.43Å; Q206-Q208 PolarHBondContact O-N 2.8Å; Q206-D209 WeakPolarHBondContact CB-OD2 3.5Å; Q206-D209 PolarHBondContact NE2-OD1 3.1Å; Q206-D209 PolarHBondContact NE2-OD2 3.16Å; Q206-D209 PolarHBondContact O-N 3.11Å
207	V	87.9	Confident	90.1	Very high	24 Å²	24	84.4 Å²	84.4	15%	0.145	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-63.9	-30	-179.4	173.5	0	0	0	0	111.9	D209 L210 K217 L220 T221	V207-D209 PolarHBondContact O-N 3.14Å; V207-L210 HydrophobicContact CG1-CD1 4.4Å; V207-L210 WeakPolarHBondContact O-CB 3.35Å; V207-L210 PolarHBondContact O-N 3.08Å; V207-K217 HydrophobicContact CG1-CB 4.18Å; V207-K217 HydrophobicContact CG1-CG 4.48Å; V207-L220 HydrophobicContact CG1-CB 3.69Å; V207-L220 HydrophobicContact CG1-CD1 3.82Å; V207-L220 HydrophobicContact CG1-CG 4.41Å; V207-L220 HydrophobicContact CG2-CB 4.32Å; V207-T221 HydrophobicContact CB-CG2 4.29Å; V207-T221 HydrophobicContact CG1-CG2 4.07Å
208	Q	87.4	Confident	90.1	Very high	102 Å²	102	88.1 Å²	88.1	48%	0.477	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-66.2	-25.1	-176.7	-58.6	-58	-14.9	0	0	113.6	Q206 L210 K217	Q206-Q208 HydrophobicContact CG-CB 4.02Å; Q206-Q208 HydrophobicContact CG-CG 4.43Å; Q206-Q208 PolarHBondContact O-N 2.8Å; Q208-L210 VanDerWaalsContact C-N 3.33Å; Q208-K217 PolarHBondContact O-NZ 2.69Å
209	D	90.6	Very high	90.2	Very high	114 Å²	114	90.2 Å²	90.2	61%	0.61	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-89.7	-4.4	-175.4	-53.6	-18.4	0	0	0	112.1	Q206 V207	Q206-D209 WeakPolarHBondContact CB-OD2 3.5Å; Q206-D209 PolarHBondContact NE2-OD1 3.1Å; Q206-D209 PolarHBondContact NE2-OD2 3.16Å; Q206-D209 PolarHBondContact O-N 3.11Å; V207-D209 PolarHBondContact O-N 3.14Å
210	L	90.8	Very high	90.2	Very high	42 Å²	42	87.2 Å²	87.2	22%	0.22	43%	0.433	C	S	.	.	S	Bend	trans	-69.4	137.9	-179.5	-65.3	174.4	0	0	0	110.9	I200 A204 V207 Q208 I212 K217 L220	I200-L210 HydrophobicContact CG2-CD1 3.62Å; A204-L210 HydrophobicContact CB-CD1 4.35Å; A204-L210 HydrophobicContact CB-CD2 4.41Å; V207-L210 HydrophobicContact CG1-CD1 4.4Å; V207-L210 WeakPolarHBondContact O-CB 3.35Å; V207-L210 PolarHBondContact O-N 3.08Å; Q208-L210 VanDerWaalsContact C-N 3.33Å; L210-I212 HydrophobicContact CB-CD1 3.95Å; L210-I212 HydrophobicContact CB-CG1 3.85Å; L210-I212 HydrophobicContact CD1-CD1 4Å; L210-I212 PolarHBondContact O-N 3.34Å; L210-K217 WeakPolarHBondContact O-CE 3.22Å; L210-K217 PolarHBondContact O-NZ 3.46Å; L210-L220 HydrophobicContact CD1-CD1 3.79Å
211	P	93.3	Very high	90.1	Very high	133 Å²	133	87.3 Å²	87.3	86%	0.864	44%	0.436	S	S	*	.	S	Bend	trans	-78.4	57.2	177.8	34.6	-36.9	0	0	0	111
212	I	92.9	Very high	89.9	Confident	51 Å²	51	91.3 Å²	91.3	26%	0.262	46%	0.458	S	S	.	.	S	Bend	trans	-128.2	155.9	-179.2	64	-179.3	0	0	0	110.6	L210 L216 K217 L220	L210-I212 HydrophobicContact CB-CD1 3.95Å; L210-I212 HydrophobicContact CB-CG1 3.85Å; L210-I212 HydrophobicContact CD1-CD1 4Å; L210-I212 PolarHBondContact O-N 3.34Å; I212-L216 HydrophobicContact CB-CB 4.43Å; I212-L216 HydrophobicContact CB-CD1 4.49Å; I212-L216 HydrophobicContact CD1-CB 3.92Å; I212-L216 HydrophobicContact CG1-CB 4.3Å; I212-K217 HydrophobicContact CD1-CG 4.06Å; I212-K217 HydrophobicContact CG1-CG 3.74Å; I212-K217 VanDerWaalsContact O-CE 3.25Å; I212-K217 WeakPolarHBondContact O-CE 3.45Å; I212-L220 HydrophobicContact CD1-CD1 3.57Å
213	P	96.4	Very high	89.9	Confident	88 Å²	88	85.6 Å²	85.6	57%	0.571	44%	0.437	S	S	*	.			trans	-57.4	147.9	175.5	-25.4	34.3	0	0	0	113.2	R215 L216 K217	P213-R215 VanDerWaalsContact C-N 3.25Å; P213-R215 PolarHBondContact O-N 3.41Å; P213-L216 WeakPolarHBondContact O-CB 3.38Å; P213-L216 PolarHBondContact O-N 2.79Å; P213-K217 PolarHBondContact O-N 2.87Å
214	N	94.1	Very high	89.7	Confident	114 Å²	114	84.3 Å²	84.3	61%	0.61	43%	0.432	S	S	*	.	H	α-helix	trans	-55.1	-38.4	-178.7	-68.3	-19.2	0	0	0	113	L216 K217 D218	N214-L216 PolarHBondContact O-N 3.09Å; N214-L216 VanDerWaalsContact O-N 3.14Å; N214-K217 CarbonylContact O-C 3.59Å; N214-K217 WeakPolarHBondContact O-CA 3.4Å; N214-K217 WeakPolarHBondContact O-CB 3.37Å; N214-K217 PolarHBondContact O-N 3.02Å; N214-D218 PolarHBondContact O-N 3.35Å
215	R	94.4	Very high	89.6	Confident	217 Å²	217	84.5 Å²	84.5	82%	0.819	43%	0.426	S	S	*	.	H	α-helix	trans	-54.2	-35.7	174.1	-75.9	-175	155.9	-166.6	-5.8	113.6	P213 Y219	P213-R215 VanDerWaalsContact C-N 3.25Å; P213-R215 PolarHBondContact O-N 3.41Å; R215-Y219 PolarHBondContact O-N 2.81Å; R215-Y219 VanDerWaalsContact O-N 3.15Å
216	L	92.1	Very high	89.6	Confident	76 Å²	76	73.7 Å²	73.7	40%	0.398	39%	0.388	S	S	.	.	H	α-helix	trans	-78.9	-33.5	176.3	-64.4	-175.4	0	0	0	111.5	I212 P213 N214 D218 Y219 L220	I212-L216 HydrophobicContact CB-CB 4.43Å; I212-L216 HydrophobicContact CB-CD1 4.49Å; I212-L216 HydrophobicContact CD1-CB 3.92Å; I212-L216 HydrophobicContact CG1-CB 4.3Å; P213-L216 WeakPolarHBondContact O-CB 3.38Å; P213-L216 PolarHBondContact O-N 2.79Å; N214-L216 PolarHBondContact O-N 3.09Å; N214-L216 VanDerWaalsContact O-N 3.14Å; L216-D218 VanDerWaalsContact C-N 3.33Å; L216-Y219 PolarHBondContact O-N 3.08Å; L216-L220 VanDerWaalsContact O-CG 3.25Å; L216-L220 WeakPolarHBondContact O-CG 3.33Å; L216-L220 PolarHBondContact O-N 3.18Å
217	K	92.9	Very high	89.2	Confident	29 Å²	29	68.8 Å²	68.8	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-43.1	171.3	-59.4	-176.3	179.3	-178.9	0	111.2	V207 Q208 L210 I212 P213 N214 L220 T221	V207-K217 HydrophobicContact CG1-CB 4.18Å; V207-K217 HydrophobicContact CG1-CG 4.48Å; Q208-K217 PolarHBondContact O-NZ 2.69Å; L210-K217 WeakPolarHBondContact O-CE 3.22Å; L210-K217 PolarHBondContact O-NZ 3.46Å; I212-K217 HydrophobicContact CD1-CG 4.06Å; I212-K217 HydrophobicContact CG1-CG 3.74Å; I212-K217 VanDerWaalsContact O-CE 3.25Å; I212-K217 WeakPolarHBondContact O-CE 3.45Å; P213-K217 PolarHBondContact O-N 2.87Å; N214-K217 CarbonylContact O-C 3.59Å; N214-K217 WeakPolarHBondContact O-CA 3.4Å; N214-K217 WeakPolarHBondContact O-CB 3.37Å; N214-K217 PolarHBondContact O-N 3.02Å; K217-L220 PolarHBondContact O-N 2.83Å; K217-T221 WeakPolarHBondContact O-CG2 3.46Å; K217-T221 PolarHBondContact O-N 3.08Å; K217-T221 PolarHBondContact O-OG1 3.31Å
218	D	92.6	Very high	89.3	Confident	90 Å²	90	71 Å²	71	48%	0.481	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-46.7	174.9	-58.4	-25.3	0	0	0	110.3	N214 L216 L220 T221 D222	N214-D218 PolarHBondContact O-N 3.35Å; L216-D218 VanDerWaalsContact C-N 3.33Å; D218-L220 VanDerWaalsContact C-N 3.31Å; D218-L220 PolarHBondContact O-N 3.26Å; D218-T221 WeakPolarHBondContact CA-OG1 3.3Å; D218-T221 PolarHBondContact O-N 3.46Å; D218-T221 PolarHBondContact O-OG1 2.94Å; D218-D222 WeakPolarHBondContact O-CB 3.4Å; D218-D222 PolarHBondContact O-N 3.16Å
219	Y	92.1	Very high	89.4	Confident	49 Å²	49	69.4 Å²	69.4	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-36.5	176.3	176.9	-100.8	0	0	0	114.3	Q193 H194 R197 R215 L216	Q193-Y219 VanDerWaalsContact CD-CZ 3.49Å; Q193-Y219 HydrophobicContact CG-CD1 4.37Å; Q193-Y219 HydrophobicContact CG-CE1 3.58Å; Q193-Y219 HydrophobicContact CG-CE2 4.46Å; H194-Y219 WeakPolarHBondContact CA-OH 3.39Å; H194-Y219 PolarHBondContact N-OH 2.84Å; R197-Y219 HydrophobicContact CB-CD1 4.43Å; R197-Y219 HydrophobicContact CB-CE1 3.76Å; R197-Y219 WeakPolarHBondContact CD-O 3.46Å; R197-Y219 HydrophobicContact CG-CE1 4.36Å; R197-Y219 PolarHBondContact NH1-O 3.26Å; R197-Y219 VanDerWaalsContact NH1-O 3.13Å; R215-Y219 PolarHBondContact O-N 2.81Å; R215-Y219 VanDerWaalsContact O-N 3.15Å; L216-Y219 PolarHBondContact O-N 3.08Å
220	L	90.8	Very high	89.3	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.037	36%	0.357	C	S	.	.	H	α-helix	trans	-72.4	-38.5	176.9	-70.1	177.8	0	0	0	111.8	R197 I200 N201 V207 L210 I212 L216 K217 D218 Y223	R197-L220 HydrophobicContact CB-CD2 3.72Å; R197-L220 HydrophobicContact CG-CD2 3.66Å; I200-L220 HydrophobicContact CB-CD2 4.24Å; I200-L220 HydrophobicContact CD1-CD2 4.25Å; I200-L220 HydrophobicContact CG2-CD1 3.79Å; I200-L220 HydrophobicContact CG2-CD2 4.25Å; N201-L220 PolarHBondContact ND2-O 3.26Å; V207-L220 HydrophobicContact CG1-CB 3.69Å; V207-L220 HydrophobicContact CG1-CD1 3.82Å; V207-L220 HydrophobicContact CG1-CG 4.41Å; V207-L220 HydrophobicContact CG2-CB 4.32Å; L210-L220 HydrophobicContact CD1-CD1 3.79Å; I212-L220 HydrophobicContact CD1-CD1 3.57Å; L216-L220 VanDerWaalsContact O-CG 3.25Å; L216-L220 WeakPolarHBondContact O-CG 3.33Å; L216-L220 PolarHBondContact O-N 3.18Å; K217-L220 PolarHBondContact O-N 2.83Å; D218-L220 VanDerWaalsContact C-N 3.31Å; D218-L220 PolarHBondContact O-N 3.26Å; L220-Y223 CarbonylContact O-C 3.55Å; L220-Y223 VanDerWaalsContact O-O 3.08Å
221	T	88.8	Confident	89.2	Confident	66 Å²	66	68.4 Å²	68.4	41%	0.405	37%	0.366	S	S	.	.	H	α-helix	trans	-76.1	-27.4	179	50.4	0	0	0	0	113.1	V207 K217 D218 Y223	V207-T221 HydrophobicContact CB-CG2 4.29Å; V207-T221 HydrophobicContact CG1-CG2 4.07Å; K217-T221 WeakPolarHBondContact O-CG2 3.46Å; K217-T221 PolarHBondContact O-N 3.08Å; K217-T221 PolarHBondContact O-OG1 3.31Å; D218-T221 WeakPolarHBondContact CA-OG1 3.3Å; D218-T221 PolarHBondContact O-N 3.46Å; D218-T221 PolarHBondContact O-OG1 2.94Å; T221-Y223 PolarHBondContact O-N 3.5Å
222	D	87.6	Confident	88.9	Confident	103 Å²	103	64.3 Å²	64.3	55%	0.551	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-13.4	173.2	-96.8	9.1	0	0	0	115	K72 D218	K72-D222 PolarHBondContact NZ-O 3.08Å; D218-D222 WeakPolarHBondContact O-CB 3.4Å; D218-D222 PolarHBondContact O-N 3.16Å
223	Y	85.4	Confident	88.7	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.016	34%	0.339	C	S	.	.			trans	-151.5	90.9	172.6	-175.4	-91.9	0	0	0	108.7	K72 T73 V150 H194 I198 N201 L220 T221 Y225 V227	K72-Y223 HydrophobicContact CB-CD2 4.17Å; K72-Y223 HydrophobicContact CB-CE2 4.38Å; T73-Y223 HydrophobicContact CG2-CE2 3.99Å; V150-Y223 HydrophobicContact CG1-CE2 4.35Å; H194-Y223 AromaticContact CE1-CE1 3.98Å; I198-Y223 HydrophobicContact CG1-CE1 4.42Å; N201-Y223 PolarHBondContact ND2-O 3.04Å; L220-Y223 CarbonylContact O-C 3.55Å; L220-Y223 VanDerWaalsContact O-O 3.08Å; T221-Y223 PolarHBondContact O-N 3.5Å; Y223-Y225 HydrophobicContact CD1-CD2 4.43Å; Y223-Y225 AromaticContact CD2-CD2 3.84Å; Y223-Y225 HydrophobicContact CD2-CD2 3.84Å; Y223-Y225 HydrophobicContact CE1-CD2 4.3Å; Y223-Y225 HydrophobicContact CE1-CG 4.49Å; Y223-Y225 WeakPolarHBondContact CE1-O 3.29Å; Y223-Y225 AromaticContact CE2-CD2 3.68Å; Y223-Y225 HydrophobicContact CE2-CD2 3.68Å; Y223-Y225 HydrophobicContact CG-CD2 4.21Å; Y223-Y225 AromaticContact CZ-CD2 3.92Å; Y223-Y225 PolarHBondContact O-N 3.39Å; Y223-V227 PolarHBondContact OH-O 3.17Å
224	A	81.9	Confident	88.1	Confident	71 Å²	71	63.6 Å²	63.6	59%	0.587	32%	0.323	S	S	*	.			trans	-75.6	-2.6	-175.9	0	0	0	0	0	114.4
225	Y	82.7	Confident	87.7	Confident	32 Å²	32	59.7 Å²	59.7	13%	0.125	30%	0.301	C	S	.	.			trans	-83.7	152.4	-172	-49.7	-73.3	0	0	0	113	E69 S148 V150 H151 E154 Y223	E69-Y225 WeakPolarHBondContact OE2-CE2 3.32Å; E69-Y225 PolarHBondContact OE2-OH 3.23Å; S148-Y225 WeakPolarHBondContact CB-OH 3.48Å; S148-Y225 PolarHBondContact OG-OH 3.23Å; V150-Y225 HydrophobicContact CB-CD1 4.5Å; V150-Y225 HydrophobicContact CB-CD2 4.01Å; V150-Y225 HydrophobicContact CB-CE1 4.29Å; V150-Y225 HydrophobicContact CB-CE2 3.72Å; V150-Y225 HydrophobicContact CB-CG 4.36Å; V150-Y225 HydrophobicContact CG1-CD1 3.89Å; V150-Y225 HydrophobicContact CG1-CD2 3.31Å; V150-Y225 HydrophobicContact CG1-CE1 4.17Å; V150-Y225 HydrophobicContact CG1-CE2 3.59Å; V150-Y225 HydrophobicContact CG1-CG 3.45Å; V150-Y225 VanDerWaalsContact CG1-CG 3.45Å; V150-Y225 HydrophobicContact CG2-CE2 4.47Å; H151-Y225 HydrophobicContact CB-CE1 3.75Å; E154-Y225 HydrophobicContact CB-CD1 4.46Å; E154-Y225 WeakPolarHBondContact OE2-CD1 3.46Å; Y223-Y225 HydrophobicContact CD1-CD2 4.43Å; Y223-Y225 AromaticContact CD2-CD2 3.84Å; Y223-Y225 HydrophobicContact CD2-CD2 3.84Å; Y223-Y225 HydrophobicContact CE1-CD2 4.3Å; Y223-Y225 HydrophobicContact CE1-CG 4.49Å; Y223-Y225 WeakPolarHBondContact CE1-O 3.29Å; Y223-Y225 AromaticContact CE2-CD2 3.68Å; Y223-Y225 HydrophobicContact CE2-CD2 3.68Å; Y223-Y225 HydrophobicContact CG-CD2 4.21Å; Y223-Y225 AromaticContact CZ-CD2 3.92Å; Y223-Y225 PolarHBondContact O-N 3.39Å
226	N	81.4	Confident	87.1	Confident	31 Å²	31	46.6 Å²	46.6	17%	0.166	26%	0.257	C	S	.	.			trans	-99.7	7.6	-176.4	-63.6	-61.8	0	0	0	114.2	E154 N201 R202	E154-N226 VanDerWaalsContact OE1-CB 3.26Å; E154-N226 WeakPolarHBondContact OE1-CB 3.34Å; E154-N226 PolarHBondContact OE1-N 3.35Å; E154-N226 PolarHBondContact OE1-ND2 3.39Å; N201-N226 PolarHBondContact O-OD1 3Å; R202-N226 VanDerWaalsContact CA-OD1 3.3Å; R202-N226 WeakPolarHBondContact CA-OD1 3.41Å; R202-N226 HydrophobicContact CG-CB 3.78Å; R202-N226 PolarHBondContact N-OD1 3.22Å; R202-N226 VanDerWaalsContact N-OD1 3.13Å; R202-N226 PolarHBondContact NE-O 3.35Å; R202-N226 PolarHBondContact NH2-O 3Å
227	V	76.8	Confident	86.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	25%	0.245	C	C	.	.			trans	-122.8	0	-175.5	108.3	0	0	0	0	112.2	W75 F97 V153 V157 P184 Y186 Y223	W75-V227 HydrophobicContact CZ2-CG1 3.51Å; W75-V227 PolarHBondContact NE1-O 3.19Å; W75-V227 PolarHBondContact NE1-OXT 3.34Å; F97-V227 HydrophobicContact CZ-CG1 4.46Å; F97-V227 HydrophobicContact CZ-CG2 4.22Å; V153-V227 HydrophobicContact CG1-CG1 4.24Å; V157-V227 HydrophobicContact CB-CG2 4.42Å; V157-V227 HydrophobicContact CG1-CG2 3.93Å; V157-V227 HydrophobicContact CG2-CG2 4.12Å; P184-V227 HydrophobicContact CG-CG2 4.35Å; Y186-V227 PolarHBondContact OH-OXT 2.65Å; Y223-V227 PolarHBondContact OH-O 3.17Å

Retrieved 227 of 227 residues in 207.2 ms (Link to these results)

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