A0A077YZ41_TRITR Loading...

Translation initiation factor 4E

AlphaFold DB , UniProt , Accession A0A077YZ41, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	44.6	Very low	236 Å²	236	147.3 Å²	147.3	100%	1.163	76%	0.755	S	S	*	*				0	100.1	0	-61.8	172.4	89.5	0	0	105.2
2	H	45.5	Very low	43.9	Very low	169 Å²	169	149.6 Å²	149.6	78%	0.782	76%	0.756	S	S	*	*			cis	-142.9	124.6	21.7	-90.9	-60.4	0	0	0	107.1
3	T	41.6	Very low	43.7	Very low	110 Å²	110	147.8 Å²	147.8	68%	0.675	77%	0.765	S	S	*	*				48.6	101.5	98	54.9	0	0	0	0	113.6
4	D	41.6	Very low	43.2	Very low	145 Å²	145	152 Å²	152	78%	0.775	78%	0.775	S	S	*	*				78.7	141.9	76	-83	-29.7	0	0	0	114.8
5	D	49.7	Very low	42.9	Very low	126 Å²	126	153.9 Å²	153.9	67%	0.674	78%	0.783	S	S	*	*			trans	77.8	141.8	151.6	-70.8	-28.6	0	0	0	119.2
6	Q	48	Very low	42.9	Very low	140 Å²	140	153.1 Å²	153.1	65%	0.654	79%	0.787	S	S	*	*			cis	-176.3	151.3	-7.4	-147.6	145.1	39.5	0	0	109.2
7	K	44.9	Very low	42.6	Very low	177 Å²	177	154.1 Å²	154.1	77%	0.77	79%	0.79	S	S	*	*			trans	50.8	118.8	142.8	-80.8	179	-174.9	173.2	0	121.5
8	S	43.4	Very low	42.4	Very low	99 Å²	99	151.6 Å²	151.6	69%	0.692	79%	0.786	S	S	*	*				87.8	142.4	98.4	101.3	0	0	0	0	112.9
9	L	44	Very low	41.8	Very low	135 Å²	135	149.2 Å²	149.2	71%	0.707	78%	0.784	S	S	*	*			cis	-164.2	157.5	25.2	-98.3	145.9	0	0	0	107.8
10	D	44.7	Very low	41.4	Very low	137 Å²	137	147.7 Å²	147.7	73%	0.733	78%	0.781	S	S	*	*			trans	55.4	140.5	147.8	-53.8	-24.7	0	0	0	119
11	E	44.8	Very low	41	Very low	146 Å²	146	145.2 Å²	145.2	68%	0.682	78%	0.776	S	S	*	*			cis	-173.2	140	38.5	-157.6	177.1	160	0	0	110.8
12	K	36.4	Very low	40.6	Very low	175 Å²	175	142.4 Å²	142.4	76%	0.761	76%	0.76	S	S	*	*			trans	45.8	110.7	151	-68	168.8	-169.6	154.7	0	121.1
13	S	41.5	Very low	40	Very low	126 Å²	126	139.1 Å²	139.1	88%	0.881	75%	0.752	S	S	*	*				-151	125.6	127.2	-99.2	0	0	0	0	112.5	M15	S13-M15 PolarHBondContact O-N 3.46Å
14	K	36.3	Very low	39.6	Very low	207 Å²	207	142.5 Å²	142.5	90%	0.9	77%	0.765	S	S	*	*			trans	-57.6	121.4	169.4	-85	173.2	166.3	-177.9	0	109.7
15	M	39.3	Very low	39.3	Very low	181 Å²	181	142.1 Å²	142.1	89%	0.892	76%	0.762	S	S	*	*			trans	-142.7	109	153.6	-119.8	175.1	-177.3	0	0	109	S13 M17	S13-M15 PolarHBondContact O-N 3.46Å; M15-M17 PolarHBondContact O-N 3.13Å
16	T	42.1	Very low	38.5	Very low	140 Å²	140	139.3 Å²	139.3	86%	0.859	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-65.8	116.6	174.4	-47.9	0	0	0	0	108.6
17	M	39	Very low	37.8	Very low	170 Å²	170	139.5 Å²	139.5	84%	0.837	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.5	137.5	175.2	-69.7	-74.9	-107.7	0	0	110.1	M15	M15-M17 PolarHBondContact O-N 3.13Å
18	P	37.7	Very low	37.1	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-75	135.7	176.6	30.4	-30.6	0	0	0	110.5	T20	P18-T20 PolarHBondContact O-N 2.89Å
19	S	32.2	Very low	36.8	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	76%	0.763	S	S	*	*			trans	-51	115.4	166.7	174.9	0	0	0	0	110.4	S21	S19-S21 PolarHBondContact O-N 2.99Å
20	T	32.8	Very low	36.5	Very low	119 Å²	119	136.2 Å²	136.2	73%	0.73	76%	0.757	S	S	*	*			trans	-88.9	81.7	168.4	-55.8	0	0	0	0	108.1	P18 Q22	P18-T20 PolarHBondContact O-N 2.89Å; T20-Q22 HydrophobicContact CG2-CG 4.15Å; T20-Q22 PolarHBondContact O-N 3.28Å
21	S	32.6	Very low	35.8	Very low	95 Å²	95	132.8 Å²	132.8	66%	0.664	74%	0.744	S	S	*	*			trans	-78.4	101.6	156	-77.7	0	0	0	0	107	S19 T23	S19-S21 PolarHBondContact O-N 2.99Å; S21-T23 VanDerWaalsContact C-N 3.29Å; S21-T23 PolarHBondContact O-N 3.4Å
22	Q	34.4	Very low	35.4	Very low	178 Å²	178	127.9 Å²	127.9	83%	0.832	73%	0.729	S	S	*	*			trans	-71.3	93.7	161.6	-80.7	-179.3	-7.8	0	0	107.7	T20 L24	T20-Q22 HydrophobicContact CG2-CG 4.15Å; T20-Q22 PolarHBondContact O-N 3.28Å; Q22-L24 PolarHBondContact O-N 3.02Å
23	T	32.5	Very low	35.8	Very low	100 Å²	100	123.5 Å²	123.5	61%	0.613	71%	0.714	S	S	*	*			trans	-65.8	115.7	159.7	-42.9	0	0	0	0	106.8	S21 D25	S21-T23 VanDerWaalsContact C-N 3.29Å; S21-T23 PolarHBondContact O-N 3.4Å; T23-D25 WeakPolarHBondContact CG2-OD1 3.4Å; T23-D25 PolarHBondContact O-N 3.47Å
24	L	34.5	Very low	35.3	Very low	180 Å²	180	123.8 Å²	123.8	94%	0.942	70%	0.702	S	S	*	*			trans	-69.9	81.2	166.4	-93.1	152.1	0	0	0	107.4	Q22	Q22-L24 PolarHBondContact O-N 3.02Å
25	D	35.1	Very low	35.9	Very low	137 Å²	137	116.5 Å²	116.5	73%	0.733	68%	0.678	S	S	*	*			trans	-73.9	120.3	174.7	-79	-36.7	0	0	0	110.6	T23	T23-D25 WeakPolarHBondContact CG2-OD1 3.4Å; T23-D25 PolarHBondContact O-N 3.47Å
26	G	31.9	Very low	36.3	Very low	68 Å²	68	109.9 Å²	109.9	70%	0.701	65%	0.646	S	S	*	*			trans	58.7	85.5	140.3	0	0	0	0	0	118.7
27	I	34.1	Very low	36.5	Very low	144 Å²	144	107.5 Å²	107.5	74%	0.738	63%	0.625	S	S	*	*			trans	-72.2	125.2	146.9	-60.3	177	0	0	0	106.8	Q29	I27-Q29 PolarHBondContact O-N 2.88Å; I27-Q29 VanDerWaalsContact O-N 3.16Å
28	P	29.7	Very low	37.1	Very low	85 Å²	85	104.2 Å²	104.2	55%	0.552	61%	0.611	S	S	*	*			trans	-61.5	119.2	177.7	-15.8	27.6	0	0	0	109.9	S30 S31	P28-S30 PolarHBondContact O-N 3.44Å; P28-S30 VanDerWaalsContact O-N 3.1Å; P28-S31 PolarHBondContact O-N 3.33Å; P28-S31 PolarHBondContact O-OG 3.41Å
29	Q	38.3	Very low	37.7	Very low	171 Å²	171	100.6 Å²	100.6	80%	0.799	59%	0.586	S	S	*	*	H	α-helix	trans	-53.9	-30	178.7	-73.6	-179.3	-70.4	0	0	112.3	I27 S31 A32 D33	I27-Q29 PolarHBondContact O-N 2.88Å; I27-Q29 VanDerWaalsContact O-N 3.16Å; Q29-S31 VanDerWaalsContact C-N 3.25Å; Q29-S31 PolarHBondContact O-N 3.08Å; Q29-A32 PolarHBondContact O-N 2.96Å; Q29-D33 PolarHBondContact O-N 3.16Å
30	S	35.8	Very low	38.6	Very low	85 Å²	85	97.6 Å²	97.6	59%	0.594	56%	0.561	S	S	*	*	H	α-helix	trans	-64.8	-22	178.8	65.5	0	0	0	0	115.2	P28	P28-S30 PolarHBondContact O-N 3.44Å; P28-S30 VanDerWaalsContact O-N 3.1Å
31	S	30.5	Very low	39.4	Very low	66 Å²	66	97.6 Å²	97.6	46%	0.462	55%	0.552	S	S	.	*	H	α-helix	trans	-80.6	-32	179	66.4	0	0	0	0	112.7	P28 Q29	P28-S31 PolarHBondContact O-N 3.33Å; P28-S31 PolarHBondContact O-OG 3.41Å; Q29-S31 VanDerWaalsContact C-N 3.25Å; Q29-S31 PolarHBondContact O-N 3.08Å
32	A	36.8	Very low	40.5	Very low	43 Å²	43	94.9 Å²	94.9	36%	0.355	53%	0.534	S	S	.	.	H	α-helix	trans	-71.3	-37.2	174.7	0	0	0	0	0	111.1	Q29 M34 S35 D36	Q29-A32 PolarHBondContact O-N 2.96Å; A32-M34 PolarHBondContact O-N 3.22Å; A32-S35 WeakPolarHBondContact CA-OG 3.37Å; A32-S35 PolarHBondContact O-N 3.23Å; A32-S35 PolarHBondContact O-OG 2.82Å; A32-D36 PolarHBondContact O-N 3.28Å
33	D	44.6	Very low	41.7	Very low	83 Å²	83	86.5 Å²	86.5	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-62.8	-40	-178.8	-69.7	-24.3	0	0	0	113	Q29 D36 Q37	Q29-D33 PolarHBondContact O-N 3.16Å; D33-D36 PolarHBondContact O-N 3.45Å; D33-Q37 PolarHBondContact O-N 3.11Å
34	M	31.7	Very low	43.1	Very low	131 Å²	131	81.7 Å²	81.7	65%	0.645	47%	0.465	S	S	*	.	H	α-helix	trans	-72.9	-31.6	177.2	-75.9	-158.3	142.3	0	0	113	A32 N38	A32-M34 PolarHBondContact O-N 3.22Å; M34-N38 WeakPolarHBondContact O-CB 3.4Å; M34-N38 PolarHBondContact O-N 3.31Å; M34-N38 VanDerWaalsContact O-N 3.11Å; M34-N38 PolarHBondContact O-ND2 2.75Å
35	S	48.4	Very low	44.3	Very low	55 Å²	55	73.2 Å²	73.2	39%	0.385	42%	0.421	S	S	.	.	H	α-helix	trans	-68.9	-41.4	173.3	53.2	0	0	0	0	111.2	A32 N38 L39	A32-S35 WeakPolarHBondContact CA-OG 3.37Å; A32-S35 PolarHBondContact O-N 3.23Å; A32-S35 PolarHBondContact O-OG 2.82Å; S35-N38 PolarHBondContact O-N 3.21Å; S35-L39 VanDerWaalsContact O-CB 3.27Å; S35-L39 WeakPolarHBondContact O-CB 3.44Å; S35-L39 WeakPolarHBondContact O-CD1 3.43Å; S35-L39 WeakPolarHBondContact O-CG 3.44Å; S35-L39 PolarHBondContact O-N 3.36Å
36	D	47.1	Very low	45.5	Very low	41 Å²	41	66.8 Å²	66.8	22%	0.219	39%	0.386	C	S	.	.	H	α-helix	trans	-69.5	-38	-179.4	-77.3	-8.4	0	0	0	111.8	A32 D33 L39 L40 Q51	A32-D36 PolarHBondContact O-N 3.28Å; D33-D36 PolarHBondContact O-N 3.45Å; D36-L39 PolarHBondContact O-N 3.46Å; D36-L40 WeakPolarHBondContact O-CB 2.85Å; D36-L40 WeakPolarHBondContact O-CG 3.37Å; D36-L40 PolarHBondContact O-N 2.71Å; D36-Q51 PolarHBondContact OD1-NE2 3.08Å; D36-Q51 PolarHBondContact OD1-OE1 3.43Å
37	Q	47.7	Very low	46.6	Very low	91 Å²	91	66.5 Å²	66.5	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-47.7	172.6	-78	-177.1	2.7	0	0	112.5	D33 L39 L40 E41	D33-Q37 PolarHBondContact O-N 3.11Å; Q37-L39 VanDerWaalsContact C-N 3.26Å; Q37-L39 PolarHBondContact O-N 2.98Å; Q37-L40 PolarHBondContact O-N 2.82Å; Q37-E41 WeakPolarHBondContact O-CB 3.29Å; Q37-E41 WeakPolarHBondContact O-CG 3.46Å; Q37-E41 PolarHBondContact O-N 2.82Å
38	N	50.6	Low	47.9	Very low	100 Å²	100	59.8 Å²	59.8	54%	0.535	34%	0.335	S	S	.	.	H	α-helix	trans	-61.7	-37.2	175.6	-83.2	-55	0	0	0	111.6	M34 S35 E41 S42	M34-N38 WeakPolarHBondContact O-CB 3.4Å; M34-N38 PolarHBondContact O-N 3.31Å; M34-N38 VanDerWaalsContact O-N 3.11Å; M34-N38 PolarHBondContact O-ND2 2.75Å; S35-N38 PolarHBondContact O-N 3.21Å; N38-E41 PolarHBondContact O-N 2.62Å; N38-S42 WeakPolarHBondContact O-CB 3.13Å; N38-S42 PolarHBondContact O-N 3.13Å
39	L	50.1	Low	49.8	Very low	34 Å²	34	55.8 Å²	55.8	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-49.4	174.3	-72.6	167.5	0	0	0	109.8	S35 D36 Q37 E41 S42 G43 S48 I246	S35-L39 VanDerWaalsContact O-CB 3.27Å; S35-L39 WeakPolarHBondContact O-CB 3.44Å; S35-L39 WeakPolarHBondContact O-CD1 3.43Å; S35-L39 WeakPolarHBondContact O-CG 3.44Å; S35-L39 PolarHBondContact O-N 3.36Å; D36-L39 PolarHBondContact O-N 3.46Å; Q37-L39 VanDerWaalsContact C-N 3.26Å; Q37-L39 PolarHBondContact O-N 2.98Å; L39-E41 VanDerWaalsContact C-N 3.29Å; L39-E41 PolarHBondContact O-N 3.11Å; L39-S42 WeakPolarHBondContact CA-OG 2.99Å; L39-S42 CarbonylContact O-C 3.54Å; L39-S42 WeakPolarHBondContact O-CA 3.4Å; L39-S42 WeakPolarHBondContact O-CB 3.17Å; L39-S42 PolarHBondContact O-N 2.83Å; L39-S42 PolarHBondContact O-OG 3.49Å; L39-G43 CarbonylContact C-O 3.5Å; L39-G43 CarbonylContact O-C 3.55Å; L39-G43 PolarHBondContact O-N 3.44Å; L39-S48 WeakPolarHBondContact CB-OG 3.42Å; L39-I246 HydrophobicContact CD2-CG2 4.46Å
40	L	51.6	Low	51.1	Low	43 Å²	43	48.3 Å²	48.3	23%	0.225	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-33.9	177	-71.9	167	0	0	0	113.6	D36 Q37 M52 M206	D36-L40 WeakPolarHBondContact O-CB 2.85Å; D36-L40 WeakPolarHBondContact O-CG 3.37Å; D36-L40 PolarHBondContact O-N 2.71Å; Q37-L40 PolarHBondContact O-N 2.82Å; L40-M52 HydrophobicContact CD2-CE 3.55Å; L40-M206 WeakPolarHBondContact O-CE 3.38Å
41	E	50.1	Low	52.4	Low	119 Å²	119	47.1 Å²	47.1	56%	0.556	26%	0.26	S	S	*	.	H	α-helix	trans	-73.9	-32.1	171.3	-71.5	-176	176.1	0	0	111.9	Q37 N38 L39 G43 R161	Q37-E41 WeakPolarHBondContact O-CB 3.29Å; Q37-E41 WeakPolarHBondContact O-CG 3.46Å; Q37-E41 PolarHBondContact O-N 2.82Å; N38-E41 PolarHBondContact O-N 2.62Å; L39-E41 VanDerWaalsContact C-N 3.29Å; L39-E41 PolarHBondContact O-N 3.11Å; E41-G43 PolarHBondContact O-N 2.84Å; E41-R161 PolarHBondContact O-NH2 2.72Å
42	S	56	Low	53.9	Low	39 Å²	39	44.8 Å²	44.8	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-71.2	-20.7	175.1	86.4	0	0	0	0	112.9	N38 L39 I159 R161 R239	N38-S42 WeakPolarHBondContact O-CB 3.13Å; N38-S42 PolarHBondContact O-N 3.13Å; L39-S42 WeakPolarHBondContact CA-OG 2.99Å; L39-S42 CarbonylContact O-C 3.54Å; L39-S42 WeakPolarHBondContact O-CA 3.4Å; L39-S42 WeakPolarHBondContact O-CB 3.17Å; L39-S42 PolarHBondContact O-N 2.83Å; L39-S42 PolarHBondContact O-OG 3.49Å; S42-I159 WeakPolarHBondContact O-CD1 3.28Å; S42-R161 PolarHBondContact O-NH2 2.93Å; S42-R239 PolarHBondContact O-NH2 3.42Å
43	G	58.4	Low	55.1	Low	1 Å²	1	43.3 Å²	43.3	1%	0.01	23%	0.228	C	C	.	.			trans	130.2	160	-171	0	0	0	0	0	111.9	L39 E41 S45	L39-G43 CarbonylContact C-O 3.5Å; L39-G43 CarbonylContact O-C 3.55Å; L39-G43 PolarHBondContact O-N 3.44Å; E41-G43 PolarHBondContact O-N 2.84Å; G43-S45 VanDerWaalsContact C-N 3.32Å; G43-S45 PolarHBondContact O-N 3.05Å
44	I	62.9	Low	55.9	Low	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.			trans	-69.7	94.6	173.7	-54	164.5	0	0	0	108.1	M49 E135 Y137 A199 W210	I44-M49 HydrophobicContact CG2-CB 3.85Å; I44-E135 HydrophobicContact CD1-CB 4.36Å; I44-E135 HydrophobicContact CD1-CG 4.26Å; I44-Y137 HydrophobicContact CD1-CE1 4.08Å; I44-Y137 HydrophobicContact CG2-CE1 4.15Å; I44-A199 HydrophobicContact CD1-CB 3.54Å; I44-A199 HydrophobicContact CG1-CB 3.8Å; I44-W210 HydrophobicContact CB-CZ2 4.12Å; I44-W210 HydrophobicContact CG2-CH2 4.34Å; I44-W210 HydrophobicContact CG2-CZ2 3.89Å; I44-W210 WeakPolarHBondContact O-CZ2 3.18Å
45	S	59.6	Low	57	Low	2 Å²	2	45.4 Å²	45.4	1%	0.014	24%	0.235	C	C	.	.			trans	-67	149.2	168.2	92.1	0	0	0	0	108.5	G43 L47 S48 M49	G43-S45 VanDerWaalsContact C-N 3.32Å; G43-S45 PolarHBondContact O-N 3.05Å; S45-L47 PolarHBondContact O-N 3.28Å; S45-L47 PolarHBondContact OG-N 3.13Å; S45-S48 PolarHBondContact O-N 3.02Å; S45-S48 VanDerWaalsContact O-N 3.15Å; S45-S48 WeakPolarHBondContact OG-CB 3.37Å; S45-S48 PolarHBondContact OG-N 3.41Å; S45-S48 PolarHBondContact OG-OG 3.33Å; S45-M49 PolarHBondContact O-N 3.28Å
46	W	60.7	Low	57.3	Low	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-57	-34.7	176.3	-175.2	-87.8	0	0	0	111.9	M49 T50 F139 F143 R149 I151 W210 H243	W46-M49 HydrophobicContact CD2-CE 3.87Å; W46-M49 HydrophobicContact CE3-CE 3.73Å; W46-M49 HydrophobicContact CH2-CE 3.31Å; W46-M49 HydrophobicContact CZ2-CE 3.34Å; W46-M49 HydrophobicContact CZ3-CE 3.51Å; W46-M49 HydrophobicContact CZ3-SD 4.43Å; W46-M49 PolarHBondContact O-N 2.96Å; W46-T50 PolarHBondContact NE1-OG1 3.23Å; W46-T50 VanDerWaalsContact NE1-OG1 3.14Å; W46-T50 PolarHBondContact O-N 3.23Å; W46-T50 PolarHBondContact O-OG1 2.81Å; W46-F139 HydrophobicContact CH2-CD1 4.25Å; W46-F139 AromaticContact CH2-CE1 3.67Å; W46-F139 HydrophobicContact CH2-CE1 3.67Å; W46-F139 AromaticContact CH2-CZ 3.94Å; W46-F139 HydrophobicContact CH2-CZ 3.94Å; W46-F139 HydrophobicContact CZ3-CD1 4.3Å; W46-F139 AromaticContact CZ3-CE1 3.39Å; W46-F139 HydrophobicContact CZ3-CE1 3.39Å; W46-F139 AromaticContact CZ3-CZ 3.71Å; W46-F139 HydrophobicContact CZ3-CZ 3.71Å; W46-F143 HydrophobicContact CH2-CD1 4.11Å; W46-F143 AromaticContact CH2-CE1 3.28Å; W46-F143 HydrophobicContact CH2-CE1 3.28Å; W46-F143 HydrophobicContact CH2-CE2 4.23Å; W46-F143 AromaticContact CH2-CZ 3.42Å; W46-F143 HydrophobicContact CH2-CZ 3.42Å; W46-F143 VanDerWaalsContact CH2-CZ 3.42Å; W46-F143 AromaticContact CZ2-CE1 3.59Å; W46-F143 HydrophobicContact CZ2-CE1 3.59Å; W46-F143 HydrophobicContact CZ2-CE2 4.06Å; W46-F143 AromaticContact CZ2-CZ 3.24Å; W46-F143 HydrophobicContact CZ2-CZ 3.24Å; W46-R149 VanDerWaalsContact CD2-NH2 3.27Å; W46-R149 VanDerWaalsContact CH2-CZ 3.47Å; W46-R149 VanDerWaalsContact CH2-NH1 3.29Å; W46-R149 HydrophobicContact CZ2-CG 4.4Å; W46-R149 VanDerWaalsContact CZ2-NH2 3.31Å; W46-I151 HydrophobicContact CB-CD1 4.48Å; W46-W210 HydrophobicContact CE3-CB 4.19Å; W46-W210 AromaticContact CE3-CD1 3.71Å; W46-W210 AromaticContact CE3-CD2 3.73Å; W46-W210 HydrophobicContact CE3-CD2 3.73Å; W46-W210 AromaticContact CE3-CE2 3.95Å; W46-W210 HydrophobicContact CE3-CE3 4.28Å; W46-W210 AromaticContact CE3-CG 3.62Å; W46-W210 HydrophobicContact CE3-CG 3.62Å; W46-W210 AromaticContact CE3-NE1 3.92Å; W46-W210 HydrophobicContact CZ3-CB 4.45Å; W46-W210 HydrophobicContact CZ3-CD2 4.05Å; W46-W210 HydrophobicContact CZ3-CE3 4.16Å; W46-W210 HydrophobicContact CZ3-CG 4.15Å; W46-H243 WeakPolarHBondContact CB-CE1 3.48Å
47	L	54	Low	57.6	Low	62 Å²	62	49.3 Å²	49.3	33%	0.325	25%	0.25	S	C	.	.	H	α-helix	trans	-64.3	-50.2	177.5	-153.6	68.9	0	0	0	110	S45 M49 T50 Q51 I151	S45-L47 PolarHBondContact O-N 3.28Å; S45-L47 PolarHBondContact OG-N 3.13Å; L47-M49 VanDerWaalsContact C-N 3.28Å; L47-M49 PolarHBondContact O-N 3.45Å; L47-T50 CarbonylContact O-C 3.57Å; L47-T50 PolarHBondContact O-N 2.96Å; L47-Q51 VanDerWaalsContact C-OE1 3.3Å; L47-Q51 WeakPolarHBondContact O-CB 3.09Å; L47-Q51 WeakPolarHBondContact O-CG 3.24Å; L47-Q51 PolarHBondContact O-N 3.13Å; L47-Q51 PolarHBondContact O-OE1 3.42Å; L47-I151 HydrophobicContact CB-CD1 3.46Å; L47-I151 VanDerWaalsContact CB-CD1 3.46Å; L47-I151 HydrophobicContact CB-CG1 4.41Å; L47-I151 HydrophobicContact CD1-CD1 3.43Å; L47-I151 VanDerWaalsContact CD1-CD1 3.43Å; L47-I151 HydrophobicContact CD1-CG1 3.62Å; L47-I151 HydrophobicContact CG-CD1 3.94Å
48	S	60.5	Low	57.8	Low	4 Å²	4	52.3 Å²	52.3	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-38.3	-179.2	-52.2	0	0	0	0	111.2	L39 S45 M52	L39-S48 WeakPolarHBondContact CB-OG 3.42Å; S45-S48 PolarHBondContact O-N 3.02Å; S45-S48 VanDerWaalsContact O-N 3.15Å; S45-S48 WeakPolarHBondContact OG-CB 3.37Å; S45-S48 PolarHBondContact OG-N 3.41Å; S45-S48 PolarHBondContact OG-OG 3.33Å; S48-M52 WeakPolarHBondContact O-CB 3.25Å; S48-M52 PolarHBondContact O-N 3.33Å
49	M	70.2	Confident	58	Low	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-49.8	171.2	-172.9	-168.8	73	0	0	110.9	I44 S45 W46 L47 Q51 M52 L53 Y137 F139 P145 W210	I44-M49 HydrophobicContact CG2-CB 3.85Å; S45-M49 PolarHBondContact O-N 3.28Å; W46-M49 HydrophobicContact CD2-CE 3.87Å; W46-M49 HydrophobicContact CE3-CE 3.73Å; W46-M49 HydrophobicContact CH2-CE 3.31Å; W46-M49 HydrophobicContact CZ2-CE 3.34Å; W46-M49 HydrophobicContact CZ3-CE 3.51Å; W46-M49 HydrophobicContact CZ3-SD 4.43Å; W46-M49 PolarHBondContact O-N 2.96Å; L47-M49 VanDerWaalsContact C-N 3.28Å; L47-M49 PolarHBondContact O-N 3.45Å; M49-Q51 VanDerWaalsContact C-N 3.35Å; M49-Q51 PolarHBondContact O-N 2.93Å; M49-M52 PolarHBondContact O-N 3.14Å; M49-L53 HydrophobicContact CG-CD1 3.94Å; M49-L53 HydrophobicContact CG-CG 4.43Å; M49-L53 WeakPolarHBondContact O-CB 3.4Å; M49-L53 WeakPolarHBondContact O-CG 3.46Å; M49-L53 PolarHBondContact O-N 3.31Å; M49-Y137 HydrophobicContact CG-CE1 3.75Å; M49-Y137 HydrophobicContact SD-CD1 3.73Å; M49-Y137 HydrophobicContact SD-CE1 3.46Å; M49-Y137 WeakPolarHBondContact SD-CE1 3.24Å; M49-F139 HydrophobicContact CE-CE2 4.14Å; M49-F139 HydrophobicContact CE-CZ 3.79Å; M49-F139 HydrophobicContact SD-CE2 3.69Å; M49-F139 HydrophobicContact SD-CZ 3.42Å; M49-F139 WeakPolarHBondContact SD-CZ 3.34Å; M49-P145 HydrophobicContact CE-CB 4.5Å; M49-W210 HydrophobicContact SD-CH2 4.29Å
50	T	65.7	Low	58.3	Low	14 Å²	14	54.2 Å²	54.2	9%	0.086	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-39.4	-178.5	-49.1	0	0	0	0	111.8	W46 L47 R54 P148	W46-T50 PolarHBondContact NE1-OG1 3.23Å; W46-T50 VanDerWaalsContact NE1-OG1 3.14Å; W46-T50 PolarHBondContact O-N 3.23Å; W46-T50 PolarHBondContact O-OG1 2.81Å; L47-T50 CarbonylContact O-C 3.57Å; L47-T50 PolarHBondContact O-N 2.96Å; T50-R54 VanDerWaalsContact O-CB 3.27Å; T50-R54 WeakPolarHBondContact O-CB 3.39Å; T50-R54 PolarHBondContact O-N 2.83Å; T50-P148 HydrophobicContact CG2-CB 4.46Å
51	Q	62.7	Low	58.3	Low	61 Å²	61	59.2 Å²	59.2	29%	0.285	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-44.1	174.5	-74	165.7	-63.8	0	0	111.5	D36 L47 M49 L53 R54 S55	D36-Q51 PolarHBondContact OD1-NE2 3.08Å; D36-Q51 PolarHBondContact OD1-OE1 3.43Å; L47-Q51 VanDerWaalsContact C-OE1 3.3Å; L47-Q51 WeakPolarHBondContact O-CB 3.09Å; L47-Q51 WeakPolarHBondContact O-CG 3.24Å; L47-Q51 PolarHBondContact O-N 3.13Å; L47-Q51 PolarHBondContact O-OE1 3.42Å; M49-Q51 VanDerWaalsContact C-N 3.35Å; M49-Q51 PolarHBondContact O-N 2.93Å; Q51-L53 VanDerWaalsContact C-N 3.32Å; Q51-L53 PolarHBondContact O-N 3.4Å; Q51-R54 WeakPolarHBondContact O-CB 3.5Å; Q51-R54 PolarHBondContact O-N 3.35Å; Q51-S55 PolarHBondContact O-N 2.81Å
52	M	61.9	Low	58.4	Low	17 Å²	17	59 Å²	59	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-46.3	175.5	-178.7	-167.6	-55.2	0	0	110.5	L40 S48 M49 R54 S55 K56 W89 E135	L40-M52 HydrophobicContact CD2-CE 3.55Å; S48-M52 WeakPolarHBondContact O-CB 3.25Å; S48-M52 PolarHBondContact O-N 3.33Å; M49-M52 PolarHBondContact O-N 3.14Å; M52-R54 VanDerWaalsContact C-N 3.34Å; M52-R54 PolarHBondContact O-N 2.86Å; M52-S55 PolarHBondContact O-N 2.88Å; M52-S55 PolarHBondContact O-OG 3.37Å; M52-K56 HydrophobicContact CG-CD 4.21Å; M52-K56 WeakPolarHBondContact O-CD 3.39Å; M52-W89 HydrophobicContact CE-CZ2 4.47Å; M52-W89 HydrophobicContact CG-CZ2 3.78Å; M52-W89 HydrophobicContact SD-CD2 3.8Å; M52-W89 HydrophobicContact SD-CG 4.02Å; M52-W89 HydrophobicContact SD-CH2 4.31Å; M52-W89 HydrophobicContact SD-CZ2 3.51Å; M52-W89 VanDerWaalsContact SD-CZ2 3.51Å; M52-W89 PolarHBondContact SD-NE1 3.07Å; M52-W89 VanDerWaalsContact SD-NE1 3.38Å; M52-E135 VanDerWaalsContact CE-OE2 3.26Å; M52-E135 WeakPolarHBondContact CE-OE2 2.96Å
53	L	63.6	Low	57.8	Low	11 Å²	11	62.6 Å²	62.6	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-68.6	-34.4	178.3	-63.4	179.1	0	0	0	112.2	M49 Q51 S55 K56 L105 P145	M49-L53 HydrophobicContact CG-CD1 3.94Å; M49-L53 HydrophobicContact CG-CG 4.43Å; M49-L53 WeakPolarHBondContact O-CB 3.4Å; M49-L53 WeakPolarHBondContact O-CG 3.46Å; M49-L53 PolarHBondContact O-N 3.31Å; Q51-L53 VanDerWaalsContact C-N 3.32Å; Q51-L53 PolarHBondContact O-N 3.4Å; L53-S55 PolarHBondContact O-N 2.89Å; L53-K56 PolarHBondContact O-N 2.8Å; L53-L105 HydrophobicContact CD1-CD2 4.02Å; L53-L105 HydrophobicContact CD2-CB 3.78Å; L53-L105 HydrophobicContact CD2-CD1 3.98Å; L53-L105 HydrophobicContact CD2-CD2 3.42Å; L53-L105 VanDerWaalsContact CD2-CD2 3.42Å; L53-L105 HydrophobicContact CD2-CG 3.88Å; L53-L105 HydrophobicContact CG-CD2 4.33Å; L53-P145 HydrophobicContact CD1-CB 3.65Å; L53-P145 HydrophobicContact CD1-CG 4.45Å; L53-P145 WeakPolarHBondContact CD1-O 3.07Å
54	R	61.5	Low	57.3	Low	176 Å²	176	64.6 Å²	64.6	66%	0.664	33%	0.327	S	S	*	.	H	α-helix	trans	-60.4	-42.5	171.6	-174.6	-170.4	-138	172.2	6.1	112.5	T50 Q51 M52 K56	T50-R54 VanDerWaalsContact O-CB 3.27Å; T50-R54 WeakPolarHBondContact O-CB 3.39Å; T50-R54 PolarHBondContact O-N 2.83Å; Q51-R54 WeakPolarHBondContact O-CB 3.5Å; Q51-R54 PolarHBondContact O-N 3.35Å; M52-R54 VanDerWaalsContact C-N 3.34Å; M52-R54 PolarHBondContact O-N 2.86Å; R54-K56 PolarHBondContact O-N 3.11Å; R54-K56 VanDerWaalsContact O-N 3.16Å
55	S	54.8	Low	56.4	Low	82 Å²	82	73.4 Å²	73.4	57%	0.573	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.3	-178.6	66.4	0	0	0	0	113.4	Q51 M52 L53	Q51-S55 PolarHBondContact O-N 2.81Å; M52-S55 PolarHBondContact O-N 2.88Å; M52-S55 PolarHBondContact O-OG 3.37Å; L53-S55 PolarHBondContact O-N 2.89Å
56	K	53	Low	55.7	Low	14 Å²	14	79.2 Å²	79.2	6%	0.061	40%	0.401	C	S	.	.			trans	-132.9	60.4	-162.8	-69.4	164.9	-178.8	-111	0	113	M52 L53 R54 Q58 W89 H101 E102 G103	M52-K56 HydrophobicContact CG-CD 4.21Å; M52-K56 WeakPolarHBondContact O-CD 3.39Å; L53-K56 PolarHBondContact O-N 2.8Å; R54-K56 PolarHBondContact O-N 3.11Å; R54-K56 VanDerWaalsContact O-N 3.16Å; K56-Q58 PolarHBondContact O-N 2.89Å; K56-W89 HydrophobicContact CD-CZ2 4.14Å; K56-W89 VanDerWaalsContact NZ-CE2 3.25Å; K56-H101 WeakPolarHBondContact CE-O 3.29Å; K56-H101 PolarHBondContact NZ-O 3.03Å; K56-E102 PolarHBondContact NZ-O 2.82Å; K56-G103 WeakPolarHBondContact CD-O 3.28Å
57	L	53.4	Low	55.3	Low	164 Å²	164	82.7 Å²	82.7	86%	0.859	42%	0.42	S	S	*	.			trans	-67.4	29.7	177.1	-85.7	162.2	0	0	0	115.1
58	Q	53.4	Low	54.7	Low	154 Å²	154	85.3 Å²	85.3	72%	0.72	44%	0.44	S	S	*	.			trans	-109.4	74.6	160.3	-67.4	-166.3	22.4	0	0	109.3	K56 H60	K56-Q58 PolarHBondContact O-N 2.89Å; Q58-H60 PolarHBondContact O-N 3.47Å
59	V	53.8	Low	54	Low	62 Å²	62	93.7 Å²	93.7	38%	0.376	47%	0.471	S	S	.	.			trans	-77	101.4	167.7	-178.8	0	0	0	0	106.6	T146	V59-T146 HydrophobicContact CG1-CG2 4.28Å; V59-T146 HydrophobicContact CG2-CG2 3.52Å
60	H	56.4	Low	52.9	Low	113 Å²	113	97.8 Å²	97.8	52%	0.523	50%	0.5	S	S	.	.			trans	-87.8	109.2	169.5	-164.9	68	0	0	0	108	Q58 R62 T104 S106	Q58-H60 PolarHBondContact O-N 3.47Å; H60-R62 VanDerWaalsContact C-N 3.26Å; H60-R62 PolarHBondContact O-N 2.96Å; H60-T104 HydrophobicContact CB-CG2 4.03Å; H60-S106 WeakPolarHBondContact O-CA 3.42Å; H60-S106 WeakPolarHBondContact O-CB 3.2Å; H60-S106 PolarHBondContact O-OG 3.11Å
61	E	52.6	Low	52.1	Low	147 Å²	147	109 Å²	109	69%	0.687	54%	0.541	S	S	*	.			trans	-62.1	98.5	157	-72.4	-169	164.5	0	0	106.7
62	R	52	Low	51.4	Low	115 Å²	115	113 Å²	113	43%	0.434	56%	0.564	S	S	.	*			trans	-53.1	131.1	154.5	-80.8	-174.7	179.4	156	9.4	104.5	H60 A64 E90	H60-R62 VanDerWaalsContact C-N 3.26Å; H60-R62 PolarHBondContact O-N 2.96Å; R62-A64 VanDerWaalsContact C-N 3.28Å; R62-A64 PolarHBondContact O-N 2.94Å; R62-E90 IonicContact CZ-OE2 2.73Å; R62-E90 IonicContact NH1-OE2 3.92Å; R62-E90 PolarHBondContact NH1-OE2 2.98Å; R62-E90 IonicContact NH2-OE2 3.23Å; R62-E90 PolarHBondContact NH2-OE2 3.01Å
63	P	42.8	Very low	51.1	Low	115 Å²	115	120.7 Å²	120.7	75%	0.747	59%	0.592	S	S	*	*			trans	-53.3	109.1	171.4	22	-30.3	0	0	0	104.5	K65	P63-K65 PolarHBondContact O-N 2.76Å
64	A	47	Very low	51	Low	42 Å²	42	124.7 Å²	124.7	35%	0.347	62%	0.621	S	S	.	*			trans	-47.3	139.1	169.6	0	0	0	0	0	103.7	R62 T66	R62-A64 VanDerWaalsContact C-N 3.28Å; R62-A64 PolarHBondContact O-N 2.94Å; A64-T66 PolarHBondContact O-N 2.7Å; A64-T66 PolarHBondContact O-OG1 2.9Å
65	K	45.9	Very low	51.4	Low	186 Å²	186	125.2 Å²	125.2	81%	0.809	63%	0.628	S	S	*	*			trans	-59.3	90.6	162.3	-83.9	179.1	178.8	173.6	0	104.2	P63 L67	P63-K65 PolarHBondContact O-N 2.76Å; K65-L67 PolarHBondContact O-N 3.44Å
66	T	44.9	Very low	52.1	Low	124 Å²	124	125.3 Å²	125.3	76%	0.761	63%	0.627	S	S	*	*			trans	-65.5	98	177.3	-39.7	0	0	0	0	101	A64 P68	A64-T66 PolarHBondContact O-N 2.7Å; A64-T66 PolarHBondContact O-OG1 2.9Å; T66-P68 VanDerWaalsContact O-N 3.11Å
67	L	50.5	Low	53.3	Low	74 Å²	74	133.2 Å²	133.2	39%	0.387	66%	0.661	S	S	.	*			trans	-45.4	127.7	175	-90.6	158.1	0	0	0	105.4	K65 R69 T119	K65-L67 PolarHBondContact O-N 3.44Å; L67-R69 VanDerWaalsContact C-N 3.31Å; L67-R69 PolarHBondContact O-N 3.31Å; L67-T119 HydrophobicContact CD1-CG2 3.71Å; L67-T119 HydrophobicContact CD2-CG2 3.47Å; L67-T119 VanDerWaalsContact CD2-CG2 3.47Å; L67-T119 HydrophobicContact CG-CG2 3.86Å
68	P	41.7	Very low	54.8	Low	116 Å²	116	132 Å²	132	75%	0.753	66%	0.656	S	S	*	*			trans	-52.3	109.8	174.9	20.1	-29.9	0	0	0	105	T66 S70	T66-P68 VanDerWaalsContact O-N 3.11Å; P68-S70 PolarHBondContact O-N 3.23Å
69	R	46.4	Very low	56.6	Low	180 Å²	180	128.8 Å²	128.8	68%	0.679	65%	0.648	S	S	*	*			trans	-64.4	93.4	-175.6	-176.9	173.5	167.1	171.1	1.8	104	L67 R71 R73	L67-R69 VanDerWaalsContact C-N 3.31Å; L67-R69 PolarHBondContact O-N 3.31Å; R69-R71 PolarHBondContact O-N 3.07Å; R69-R73 VanDerWaalsContact CD-NH2 3.33Å; R69-R73 VanDerWaalsContact NE-NH2 3.17Å
70	S	46.7	Very low	58.3	Low	87 Å²	87	127.2 Å²	127.2	61%	0.608	64%	0.636	S	S	*	*			trans	-47.4	120.5	-172.5	173.4	0	0	0	0	107.2	P68 N72	P68-S70 PolarHBondContact O-N 3.23Å; S70-N72 PolarHBondContact O-N 3.24Å
71	R	49.2	Very low	59.8	Low	249 Å²	249	128.3 Å²	128.3	94%	0.94	64%	0.641	S	S	*	*	S	Bend	trans	-70.9	10.9	-163.5	-143.5	168.5	171	161.2	-3.9	112.7	R69	R69-R71 PolarHBondContact O-N 3.07Å
72	N	48.4	Very low	61.6	Low	144 Å²	144	125 Å²	125	77%	0.77	63%	0.626	S	S	*	*	S	Bend	trans	-132.5	79.7	172.3	-73.4	-21.8	0	0	0	109.9	S70 S74	S70-N72 PolarHBondContact O-N 3.24Å; N72-S74 PolarHBondContact O-N 3.33Å
73	R	55.5	Low	63.6	Low	180 Å²	180	124 Å²	124	68%	0.679	63%	0.626	S	S	*	*			trans	-76.2	90.9	176.7	-77.8	-170.4	175.8	-168.8	-4.1	110.7	R69	R69-R73 VanDerWaalsContact CD-NH2 3.33Å; R69-R73 VanDerWaalsContact NE-NH2 3.17Å
74	S	62.3	Low	66	Low	94 Å²	94	119 Å²	119	66%	0.657	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-60	150	148.3	54.9	0	0	0	0	108.7	N72	N72-S74 PolarHBondContact O-N 3.33Å
75	K	68.7	Low	68.2	Low	188 Å²	188	117 Å²	117	82%	0.817	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-49.3	136.8	178.4	-70.9	-179	179.6	179.7	0	109.4	K77	K75-K77 PolarHBondContact O-N 3.18Å; K75-K77 VanDerWaalsContact O-N 3.14Å
76	P	69.8	Low	70.5	Confident	84 Å²	84	108.3 Å²	108.3	55%	0.545	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-54.6	125.3	-180	22.8	-32	0	0	0	108.7	N78 P79 T113	P76-N78 PolarHBondContact O-N 3.22Å; P76-P79 HydrophobicContact CG-CB 4.46Å; P76-T113 HydrophobicContact CB-CG2 3.84Å
77	K	77.8	Confident	72.7	Confident	179 Å²	179	103.1 Å²	103.1	78%	0.778	51%	0.505	S	S	*	.	S	Bend	trans	-73.2	124.5	173.6	-67.1	-176.7	179.3	-179	0	107.1	K75	K75-K77 PolarHBondContact O-N 3.18Å; K75-K77 VanDerWaalsContact O-N 3.14Å
78	N	84.8	Confident	74.4	Confident	140 Å²	140	99.8 Å²	99.8	75%	0.749	49%	0.487	S	S	*	.	S	Bend	trans	56.6	64.9	176.1	-51.9	-20.4	0	0	0	113.9	P76	P76-N78 PolarHBondContact O-N 3.22Å
79	P	90.9	Very high	76.5	Confident	85 Å²	85	94.9 Å²	94.9	55%	0.552	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	145.3	173	31	-34.4	0	0	0	110.9	P76 G112	P76-P79 HydrophobicContact CG-CB 4.46Å; P79-G112 CarbonylContact C-O 3.5Å; P79-G112 WeakPolarHBondContact CA-O 3.46Å
80	F	90.4	Very high	78	Confident	30 Å²	30	88.3 Å²	88.3	13%	0.132	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	161.5	161.6	-62.1	-41	0	0	0	109.8	E82 F111 G112 T113 A114 F117 T182 E183	F80-E82 WeakPolarHBondContact CB-O 3.37Å; F80-E82 PolarHBondContact O-N 3.13Å; F80-F111 HydrophobicContact CD2-CD2 4.28Å; F80-F111 AromaticContact CE2-CD2 3.91Å; F80-F111 HydrophobicContact CE2-CD2 3.91Å; F80-F111 HydrophobicContact CE2-CE2 4.3Å; F80-G112 PolarHBondContact N-O 2.95Å; F80-T113 WeakPolarHBondContact CE2-O 3.34Å; F80-A114 HydrophobicContact CE1-CB 4.37Å; F80-A114 HydrophobicContact CZ-CB 4.02Å; F80-F117 HydrophobicContact CE2-CB 4.31Å; F80-T182 WeakPolarHBondContact CD1-O 3.32Å; F80-T182 HydrophobicContact CE2-CG2 4.48Å; F80-E183 HydrophobicContact CE1-CG 4.22Å
81	Q	87.8	Confident	79.2	Confident	136 Å²	136	86.1 Å²	86.1	64%	0.636	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	-28.7	176.9	-68.2	-178.1	2.3	0	0	112.7	Q187	Q81-Q187 VanDerWaalsContact CD-NE2 3.33Å
82	E	90.3	Very high	80.1	Confident	78 Å²	78	77.3 Å²	77.3	36%	0.364	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.8	-177.5	-58.5	-76.7	-158.5	0	0	108.4	F80 W84 K140	F80-E82 WeakPolarHBondContact CB-O 3.37Å; F80-E82 PolarHBondContact O-N 3.13Å; E82-W84 HydrophobicContact CB-CZ2 4.38Å; E82-W84 PolarHBondContact O-NE1 2.91Å; E82-K140 HydrophobicContact CG-CD 4.26Å; E82-K140 IonicContact OE1-NZ 3.36Å; E82-K140 PolarHBondContact OE1-NZ 3.04Å
83	E	93	Very high	80.7	Confident	93 Å²	93	77.2 Å²	77.2	44%	0.435	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.2	164.9	-170.2	170.4	-176.7	0	0	109.1	T110 K140 E141	E83-T110 WeakPolarHBondContact OE1-CB 3.34Å; E83-T110 PolarHBondContact OE1-OG1 3.37Å; E83-K140 CarbonylContact O-C 3.57Å; E83-K140 WeakPolarHBondContact O-CA 3.23Å; E83-E141 HydrophobicContact CB-CB 3.89Å; E83-E141 HydrophobicContact CG-CB 3.87Å; E83-E141 HydrophobicContact CG-CG 4.3Å; E83-E141 PolarHBondContact O-N 3.47Å
84	W	94.5	Very high	80.9	Confident	10 Å²	10	77 Å²	77	4%	0.038	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.5	-177.4	-62.9	84.7	0	0	0	110.8	E82 T110 F111 L138 F139 K140 I181 T182	E82-W84 HydrophobicContact CB-CZ2 4.38Å; E82-W84 PolarHBondContact O-NE1 2.91Å; W84-T110 CarbonylContact O-C 3.54Å; W84-T110 VanDerWaalsContact O-CA 3.22Å; W84-T110 WeakPolarHBondContact O-CA 3.35Å; W84-F111 HydrophobicContact CB-CD2 4.14Å; W84-F111 HydrophobicContact CB-CE1 4.44Å; W84-F111 HydrophobicContact CB-CE2 3.6Å; W84-F111 HydrophobicContact CB-CZ 3.78Å; W84-F111 HydrophobicContact CG-CE2 4.26Å; W84-F111 PolarHBondContact N-O 3.16Å; W84-F111 PolarHBondContact O-N 3.49Å; W84-L138 HydrophobicContact CB-CD1 3.92Å; W84-L138 HydrophobicContact CE3-CD1 4.17Å; W84-L138 HydrophobicContact CE3-CD2 4.04Å; W84-L138 HydrophobicContact CE3-CG 3.78Å; W84-L138 HydrophobicContact CG-CD1 4.46Å; W84-L138 HydrophobicContact CZ3-CD2 4.39Å; W84-L138 HydrophobicContact CZ3-CG 4.38Å; W84-F139 CarbonylContact C-O 3.54Å; W84-F139 VanDerWaalsContact CA-O 3.28Å; W84-F139 WeakPolarHBondContact CA-O 3.4Å; W84-K140 HydrophobicContact CE3-CG 4.2Å; W84-K140 HydrophobicContact CH2-CG 3.88Å; W84-K140 HydrophobicContact CZ2-CG 4.3Å; W84-K140 HydrophobicContact CZ3-CG 3.83Å; W84-I181 HydrophobicContact CE3-CG2 4.32Å; W84-I181 HydrophobicContact CH2-CG2 3.27Å; W84-I181 HydrophobicContact CZ2-CG2 3.52Å; W84-I181 HydrophobicContact CZ3-CG2 3.71Å; W84-T182 HydrophobicContact CD2-CG2 4.18Å; W84-T182 HydrophobicContact CG-CG2 3.9Å
85	A	93.4	Very high	80.6	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134	174.8	0	0	0	0	0	110.9	G109 T110 L138 F139 E141	A85-G109 WeakPolarHBondContact CA-O 3.43Å; A85-T110 HydrophobicContact CB-CG2 4.27Å; A85-L138 WeakPolarHBondContact O-CA 3.26Å; A85-F139 PolarHBondContact N-O 2.96Å; A85-F139 PolarHBondContact O-N 2.95Å; A85-E141 WeakPolarHBondContact CB-OE2 3.39Å
86	L	93.5	Very high	80	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	135	167.1	-80.5	168.1	0	0	0	109.8	L108 G109 F111 V120 F121 Y137 L138 W174 I178	L86-L108 HydrophobicContact CB-CB 4.21Å; L86-L108 HydrophobicContact CB-CD1 4.29Å; L86-L108 WeakPolarHBondContact O-CB 3.15Å; L86-L108 PolarHBondContact O-N 3.43Å; L86-G109 PolarHBondContact N-O 3.43Å; L86-F111 HydrophobicContact CB-CE1 4.46Å; L86-F111 HydrophobicContact CD1-CE1 3.77Å; L86-F111 HydrophobicContact CD1-CZ 4.34Å; L86-F111 HydrophobicContact CG-CE1 3.75Å; L86-F111 HydrophobicContact CG-CZ 4.23Å; L86-V120 HydrophobicContact CB-CG1 4.45Å; L86-V120 HydrophobicContact CD1-CG1 4.05Å; L86-F121 HydrophobicContact CD1-CD2 4.37Å; L86-Y137 CarbonylContact C-O 3.41Å; L86-Y137 VanDerWaalsContact CA-O 3.3Å; L86-Y137 WeakPolarHBondContact CA-O 3.34Å; L86-Y137 WeakPolarHBondContact CD2-O 3.17Å; L86-L138 HydrophobicContact CD2-CB 4.15Å; L86-L138 HydrophobicContact CD2-CD1 3.93Å; L86-L138 HydrophobicContact CG-CD1 4.18Å; L86-W174 HydrophobicContact CD2-CZ2 4.21Å; L86-I178 HydrophobicContact CD2-CD1 3.96Å
87	W	90.8	Very high	79.5	Confident	16 Å²	16	69.6 Å²	69.6	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.5	176.7	-51.5	74.6	0	0	0	109.8	L105 S106 K107 C136 Y137 P145	W87-L105 HydrophobicContact CB-CD1 3.99Å; W87-L105 HydrophobicContact CD2-CD2 4.47Å; W87-L105 HydrophobicContact CE3-CD2 3.75Å; W87-L105 HydrophobicContact CE3-CG 4.02Å; W87-L105 HydrophobicContact CZ3-CD2 4.19Å; W87-S106 CarbonylContact C-O 3.59Å; W87-S106 WeakPolarHBondContact CA-O 3.3Å; W87-K107 HydrophobicContact CD2-CB 4.09Å; W87-K107 HydrophobicContact CD2-CG 4Å; W87-K107 HydrophobicContact CE3-CB 3.63Å; W87-K107 HydrophobicContact CE3-CG 4.04Å; W87-K107 HydrophobicContact CH2-CB 4.03Å; W87-K107 HydrophobicContact CH2-CD 3.74Å; W87-K107 HydrophobicContact CH2-CG 4.02Å; W87-K107 HydrophobicContact CZ2-CB 4.42Å; W87-K107 HydrophobicContact CZ2-CD 3.73Å; W87-K107 HydrophobicContact CZ2-CG 3.94Å; W87-K107 HydrophobicContact CZ3-CB 3.62Å; W87-K107 HydrophobicContact CZ3-CD 4.23Å; W87-K107 HydrophobicContact CZ3-CG 4.07Å; W87-C136 CarbonylContact O-C 3.38Å; W87-C136 WeakPolarHBondContact O-CA 3.4Å; W87-C136 PolarHBondContact O-SG 2.89Å; W87-C136 VanDerWaalsContact O-SG 3.35Å; W87-Y137 PolarHBondContact N-O 3Å; W87-Y137 PolarHBondContact O-N 3.38Å; W87-P145 HydrophobicContact CD2-CG 3.82Å; W87-P145 HydrophobicContact CE3-CG 4.14Å; W87-P145 HydrophobicContact CG-CG 4.28Å; W87-P145 HydrophobicContact CH2-CG 4.22Å; W87-P145 HydrophobicContact CZ2-CG 3.93Å; W87-P145 HydrophobicContact CZ3-CG 4.32Å
88	L	87.7	Confident	78.8	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.016	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	126.3	177.6	177.8	64.7	0	0	0	108.5	E90 L105 S106 L108 M130 E135	L88-E90 HydrophobicContact CD1-CG 4.18Å; L88-E90 VanDerWaalsContact CD2-CD 3.42Å; L88-E90 HydrophobicContact CD2-CG 3.62Å; L88-E90 WeakPolarHBondContact CD2-OE2 3.3Å; L88-E90 HydrophobicContact CG-CG 3.57Å; L88-L105 CarbonylContact O-C 3.49Å; L88-L105 WeakPolarHBondContact O-CA 3.39Å; L88-S106 PolarHBondContact N-O 3.47Å; L88-S106 PolarHBondContact O-N 3.02Å; L88-L108 HydrophobicContact CB-CD1 3.7Å; L88-L108 HydrophobicContact CB-CD2 3.83Å; L88-L108 HydrophobicContact CB-CG 3.83Å; L88-L108 HydrophobicContact CD2-CD2 4.13Å; L88-M130 HydrophobicContact CD1-CE 3.61Å; L88-M130 HydrophobicContact CD1-SD 3.47Å; L88-M130 WeakPolarHBondContact CD1-SD 3.2Å; L88-M130 HydrophobicContact CD2-CE 4.4Å; L88-E135 CarbonylContact C-O 3.56Å; L88-E135 WeakPolarHBondContact CA-O 3.49Å; L88-E135 WeakPolarHBondContact CD1-O 3.37Å
89	W	85	Confident	77.6	Confident	13 Å²	13	65.3 Å²	65.3	5%	0.049	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.9	168	-173.8	97.1	0	0	0	108.4	M52 K56 W91 T104 L105 R133 S134 E135 Y137	M52-W89 HydrophobicContact CE-CZ2 4.47Å; M52-W89 HydrophobicContact CG-CZ2 3.78Å; M52-W89 HydrophobicContact SD-CD2 3.8Å; M52-W89 HydrophobicContact SD-CG 4.02Å; M52-W89 HydrophobicContact SD-CH2 4.31Å; M52-W89 HydrophobicContact SD-CZ2 3.51Å; M52-W89 VanDerWaalsContact SD-CZ2 3.51Å; M52-W89 PolarHBondContact SD-NE1 3.07Å; M52-W89 VanDerWaalsContact SD-NE1 3.38Å; K56-W89 HydrophobicContact CD-CZ2 4.14Å; K56-W89 VanDerWaalsContact NZ-CE2 3.25Å; W89-W91 AromaticContact CH2-CE3 3.72Å; W89-W91 HydrophobicContact CH2-CE3 3.72Å; W89-W91 HydrophobicContact CH2-CZ3 4.28Å; W89-W91 HydrophobicContact CZ3-CB 4.42Å; W89-W91 HydrophobicContact CZ3-CE3 4.28Å; W89-T104 WeakPolarHBondContact CA-O 3.15Å; W89-L105 HydrophobicContact CB-CD1 3.96Å; W89-R133 WeakPolarHBondContact CZ3-O 3.27Å; W89-S134 WeakPolarHBondContact O-CA 3.46Å; W89-E135 HydrophobicContact CB-CB 4.22Å; W89-E135 HydrophobicContact CE3-CG 4.24Å; W89-E135 PolarHBondContact N-O 3.49Å; W89-E135 PolarHBondContact O-N 3.24Å; W89-Y137 HydrophobicContact CB-CE2 4.12Å
90	E	78.6	Confident	75.9	Confident	42 Å²	42	63.9 Å²	63.9	20%	0.196	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.2	177.1	-53.7	-170.1	89.7	0	0	109	R62 L88 G103 T104	R62-E90 IonicContact CZ-OE2 2.73Å; R62-E90 IonicContact NH1-OE2 3.92Å; R62-E90 PolarHBondContact NH1-OE2 2.98Å; R62-E90 IonicContact NH2-OE2 3.23Å; R62-E90 PolarHBondContact NH2-OE2 3.01Å; L88-E90 HydrophobicContact CD1-CG 4.18Å; L88-E90 VanDerWaalsContact CD2-CD 3.42Å; L88-E90 HydrophobicContact CD2-CG 3.62Å; L88-E90 WeakPolarHBondContact CD2-OE2 3.3Å; L88-E90 HydrophobicContact CG-CG 3.57Å; E90-G103 CarbonylContact O-C 3.49Å; E90-G103 WeakPolarHBondContact O-CA 3.43Å; E90-T104 PolarHBondContact N-O 3.35Å; E90-T104 PolarHBondContact O-N 3.28Å
91	W	70.9	Confident	74.3	Confident	41 Å²	41	66.8 Å²	66.8	16%	0.155	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	134.9	169.4	-175.9	-92.2	0	0	0	109.8	W89 H93 P100 H101	W89-W91 AromaticContact CH2-CE3 3.72Å; W89-W91 HydrophobicContact CH2-CE3 3.72Å; W89-W91 HydrophobicContact CH2-CZ3 4.28Å; W89-W91 HydrophobicContact CZ3-CB 4.42Å; W89-W91 HydrophobicContact CZ3-CE3 4.28Å; W91-H93 PolarHBondContact O-N 3.41Å; W91-P100 HydrophobicContact CH2-CB 4.29Å; W91-P100 WeakPolarHBondContact CH2-O 3.29Å; W91-P100 HydrophobicContact CZ2-CB 4.19Å; W91-P100 WeakPolarHBondContact CZ2-O 3.32Å; W91-P100 WeakPolarHBondContact CZ3-O 2.81Å; W91-H101 AromaticContact CH2-ND1 3.72Å; W91-H101 HydrophobicContact CZ3-CB 4.41Å; W91-H101 AromaticContact CZ3-ND1 3.86Å
92	D	67.5	Low	73.1	Confident	64 Å²	64	64.2 Å²	64.2	34%	0.342	32%	0.323	S	S	.	.			trans	-79.4	111.2	171.2	-164.7	-15.2	0	0	0	109.1	Q94 A95 E102	D92-Q94 PolarHBondContact O-N 2.9Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.14Å; D92-Q94 PolarHBondContact OD1-N 3.42Å; D92-A95 HydrophobicContact CB-CB 4.42Å; D92-A95 WeakPolarHBondContact O-CB 3.43Å; D92-A95 PolarHBondContact O-N 3.32Å; D92-E102 PolarHBondContact N-O 3.36Å
93	H	61.1	Low	72.3	Confident	143 Å²	143	60.9 Å²	60.9	66%	0.662	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-15	176.3	-68.3	-66.1	0	0	0	112.8	W91	W91-H93 PolarHBondContact O-N 3.41Å
94	Q	59.5	Low	71.6	Confident	175 Å²	175	58.4 Å²	58.4	82%	0.818	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	7.8	174.3	-64.5	-172.7	-13.6	0	0	113.3	D92 D96	D92-Q94 PolarHBondContact O-N 2.9Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.14Å; D92-Q94 PolarHBondContact OD1-N 3.42Å; Q94-D96 PolarHBondContact O-N 3.33Å
95	A	56.7	Low	71.1	Confident	20 Å²	20	58 Å²	58	17%	0.165	30%	0.3	C	S	.	.			trans	-47.1	129.2	177.5	0	0	0	0	0	110.7	D92 E102	D92-A95 HydrophobicContact CB-CB 4.42Å; D92-A95 WeakPolarHBondContact O-CB 3.43Å; D92-A95 PolarHBondContact O-N 3.32Å; A95-E102 HydrophobicContact CB-CB 4.21Å
96	D	55.1	Low	70.7	Confident	67 Å²	67	58.1 Å²	58.1	36%	0.358	30%	0.301	S	S	.	.			trans	-45.9	131.5	172.6	179.4	-0.6	0	0	0	109	Q94 D98 H99	Q94-D96 PolarHBondContact O-N 3.33Å; D96-D98 PolarHBondContact O-N 2.95Å; D96-D98 PolarHBondContact OD1-N 3.07Å; D96-D98 VanDerWaalsContact OD1-N 3.08Å; D96-H99 HydrophobicContact CB-CB 4.25Å; D96-H99 CarbonylContact O-C 3.13Å; D96-H99 WeakPolarHBondContact O-CA 3.39Å; D96-H99 PolarHBondContact O-N 3.46Å; D96-H99 IonicContact OD2-CE1 3.73Å; D96-H99 IonicContact OD2-ND1 3.13Å; D96-H99 PolarHBondContact OD2-ND1 2.7Å
97	P	60.2	Low	70.5	Confident	123 Å²	123	59.7 Å²	59.7	80%	0.799	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	-29	172.9	-28.7	34	0	0	0	113.8
98	D	62.7	Low	70.6	Confident	132 Å²	132	60.3 Å²	60.3	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-19.4	176.8	-66	-26.8	0	0	0	113.3	D96 P100	D96-D98 PolarHBondContact O-N 2.95Å; D96-D98 PolarHBondContact OD1-N 3.07Å; D96-D98 VanDerWaalsContact OD1-N 3.08Å; D98-P100 VanDerWaalsContact C-CD 3.47Å
99	H	60	Low	70.8	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.449	31%	0.314	S	S	.	.			trans	-130.2	58.3	-179.2	-54.9	89.1	0	0	0	111.1	D96 H101 E102	D96-H99 HydrophobicContact CB-CB 4.25Å; D96-H99 CarbonylContact O-C 3.13Å; D96-H99 WeakPolarHBondContact O-CA 3.39Å; D96-H99 PolarHBondContact O-N 3.46Å; D96-H99 IonicContact OD2-CE1 3.73Å; D96-H99 IonicContact OD2-ND1 3.13Å; D96-H99 PolarHBondContact OD2-ND1 2.7Å; H99-H101 PolarHBondContact O-N 3.15Å; H99-E102 HydrophobicContact CB-CG 3.81Å; H99-E102 VanDerWaalsContact CB-OE1 3.32Å; H99-E102 WeakPolarHBondContact CB-OE1 3.46Å; H99-E102 IonicContact CD2-OE1 3.54Å; H99-E102 IonicContact CG-OE1 3.05Å; H99-E102 PolarHBondContact O-N 2.79Å; H99-E102 VanDerWaalsContact O-N 3.08Å
100	P	54.3	Low	71.2	Confident	55 Å²	55	62.2 Å²	62.2	36%	0.357	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-36.9	-175.1	23	-32.4	0	0	0	109.5	W91 D98 E102	W91-P100 HydrophobicContact CH2-CB 4.29Å; W91-P100 WeakPolarHBondContact CH2-O 3.29Å; W91-P100 HydrophobicContact CZ2-CB 4.19Å; W91-P100 WeakPolarHBondContact CZ2-O 3.32Å; W91-P100 WeakPolarHBondContact CZ3-O 2.81Å; D98-P100 VanDerWaalsContact C-CD 3.47Å; P100-E102 PolarHBondContact O-N 3.24Å
101	H	57.2	Low	72	Confident	91 Å²	91	60.3 Å²	60.3	42%	0.421	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	9.7	-176.7	-59.9	-64.5	0	0	0	116.4	K56 W91 H99	K56-H101 WeakPolarHBondContact CE-O 3.29Å; K56-H101 PolarHBondContact NZ-O 3.03Å; W91-H101 AromaticContact CH2-ND1 3.72Å; W91-H101 HydrophobicContact CZ3-CB 4.41Å; W91-H101 AromaticContact CZ3-ND1 3.86Å; H99-H101 PolarHBondContact O-N 3.15Å
102	E	63.7	Low	73.1	Confident	82 Å²	82	59.2 Å²	59.2	38%	0.383	32%	0.319	S	S	.	.			trans	-76.1	152.8	175.9	-73.1	-176.5	-174.6	0	0	113.4	K56 D92 A95 H99 P100	K56-E102 PolarHBondContact NZ-O 2.82Å; D92-E102 PolarHBondContact N-O 3.36Å; A95-E102 HydrophobicContact CB-CB 4.21Å; H99-E102 HydrophobicContact CB-CG 3.81Å; H99-E102 VanDerWaalsContact CB-OE1 3.32Å; H99-E102 WeakPolarHBondContact CB-OE1 3.46Å; H99-E102 IonicContact CD2-OE1 3.54Å; H99-E102 IonicContact CG-OE1 3.05Å; H99-E102 PolarHBondContact O-N 2.79Å; H99-E102 VanDerWaalsContact O-N 3.08Å; P100-E102 PolarHBondContact O-N 3.24Å
103	G	71.9	Confident	74.4	Confident	8 Å²	8	56.8 Å²	56.8	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.2	162.2	-171.2	0	0	0	0	0	110.4	K56 E90	K56-G103 WeakPolarHBondContact CD-O 3.28Å; E90-G103 CarbonylContact O-C 3.49Å; E90-G103 WeakPolarHBondContact O-CA 3.43Å
104	T	78.3	Confident	75.9	Confident	41 Å²	41	52 Å²	52	25%	0.252	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123.5	-162.9	-57.2	0	0	0	0	109.5	H60 W89 E90	H60-T104 HydrophobicContact CB-CG2 4.03Å; W89-T104 WeakPolarHBondContact CA-O 3.15Å; E90-T104 PolarHBondContact N-O 3.35Å; E90-T104 PolarHBondContact O-N 3.28Å
105	L	84.2	Confident	77.4	Confident	2 Å²	2	48 Å²	48	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.4	165	-174	74.5	0	0	0	108.8	L53 W87 L88 W89 Y137 P145 T146	L53-L105 HydrophobicContact CD1-CD2 4.02Å; L53-L105 HydrophobicContact CD2-CB 3.78Å; L53-L105 HydrophobicContact CD2-CD1 3.98Å; L53-L105 HydrophobicContact CD2-CD2 3.42Å; L53-L105 VanDerWaalsContact CD2-CD2 3.42Å; L53-L105 HydrophobicContact CD2-CG 3.88Å; L53-L105 HydrophobicContact CG-CD2 4.33Å; W87-L105 HydrophobicContact CB-CD1 3.99Å; W87-L105 HydrophobicContact CD2-CD2 4.47Å; W87-L105 HydrophobicContact CE3-CD2 3.75Å; W87-L105 HydrophobicContact CE3-CG 4.02Å; W87-L105 HydrophobicContact CZ3-CD2 4.19Å; L88-L105 CarbonylContact O-C 3.49Å; L88-L105 WeakPolarHBondContact O-CA 3.39Å; W89-L105 HydrophobicContact CB-CD1 3.96Å; L105-Y137 HydrophobicContact CD1-CD2 4.29Å; L105-P145 HydrophobicContact CD2-CG 4.02Å; L105-T146 HydrophobicContact CD2-CG2 3.85Å
106	S	85.9	Confident	79.1	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.1	174.9	-68.8	0	0	0	0	111.2	H60 W87 L88 L108	H60-S106 WeakPolarHBondContact O-CA 3.42Å; H60-S106 WeakPolarHBondContact O-CB 3.2Å; H60-S106 PolarHBondContact O-OG 3.11Å; W87-S106 CarbonylContact C-O 3.59Å; W87-S106 WeakPolarHBondContact CA-O 3.3Å; L88-S106 PolarHBondContact N-O 3.47Å; L88-S106 PolarHBondContact O-N 3.02Å; S106-L108 PolarHBondContact O-N 2.79Å
107	K	90	Very high	81	Confident	36 Å²	36	46.6 Å²	46.6	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	121.4	166.7	-161.6	174.3	-172.9	175.7	0	109	W87 E141	W87-K107 HydrophobicContact CD2-CB 4.09Å; W87-K107 HydrophobicContact CD2-CG 4Å; W87-K107 HydrophobicContact CE3-CB 3.63Å; W87-K107 HydrophobicContact CE3-CG 4.04Å; W87-K107 HydrophobicContact CH2-CB 4.03Å; W87-K107 HydrophobicContact CH2-CD 3.74Å; W87-K107 HydrophobicContact CH2-CG 4.02Å; W87-K107 HydrophobicContact CZ2-CB 4.42Å; W87-K107 HydrophobicContact CZ2-CD 3.73Å; W87-K107 HydrophobicContact CZ2-CG 3.94Å; W87-K107 HydrophobicContact CZ3-CB 3.62Å; W87-K107 HydrophobicContact CZ3-CD 4.23Å; W87-K107 HydrophobicContact CZ3-CG 4.07Å; K107-E141 WeakPolarHBondContact CE-OE2 3.44Å; K107-E141 IonicContact NZ-OE1 3.36Å; K107-E141 PolarHBondContact NZ-OE1 3.37Å; K107-E141 IonicContact NZ-OE2 2.64Å; K107-E141 PolarHBondContact NZ-OE2 2.68Å
108	L	91.1	Very high	82.5	Confident	29 Å²	29	45.8 Å²	45.8	15%	0.152	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-33.4	-179	-63.3	172.6	0	0	0	112	L86 L88 S106 V124	L86-L108 HydrophobicContact CB-CB 4.21Å; L86-L108 HydrophobicContact CB-CD1 4.29Å; L86-L108 WeakPolarHBondContact O-CB 3.15Å; L86-L108 PolarHBondContact O-N 3.43Å; L88-L108 HydrophobicContact CB-CD1 3.7Å; L88-L108 HydrophobicContact CB-CD2 3.83Å; L88-L108 HydrophobicContact CB-CG 3.83Å; L88-L108 HydrophobicContact CD2-CD2 4.13Å; S106-L108 PolarHBondContact O-N 2.79Å; L108-V124 HydrophobicContact CB-CG2 3.92Å; L108-V124 HydrophobicContact CD1-CB 4.28Å; L108-V124 HydrophobicContact CD1-CG1 3.56Å; L108-V124 HydrophobicContact CD1-CG2 3.59Å; L108-V124 HydrophobicContact CD2-CG1 4.47Å; L108-V124 HydrophobicContact CD2-CG2 4.22Å; L108-V124 HydrophobicContact CG-CG2 4.12Å
109	G	92.6	Very high	83.9	Confident	5 Å²	5	42.4 Å²	42.4	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.3	168.4	177.2	0	0	0	0	0	112.5	A85 L86	A85-G109 WeakPolarHBondContact CA-O 3.43Å; L86-G109 PolarHBondContact N-O 3.43Å
110	T	94.3	Very high	85.4	Confident	50 Å²	50	38.6 Å²	38.6	31%	0.307	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	153.2	174.7	72	0	0	0	0	110.6	E83 W84 A85 E141	E83-T110 WeakPolarHBondContact OE1-CB 3.34Å; E83-T110 PolarHBondContact OE1-OG1 3.37Å; W84-T110 CarbonylContact O-C 3.54Å; W84-T110 VanDerWaalsContact O-CA 3.22Å; W84-T110 WeakPolarHBondContact O-CA 3.35Å; A85-T110 HydrophobicContact CB-CG2 4.27Å; T110-E141 HydrophobicContact CG2-CG 4.44Å; T110-E141 WeakPolarHBondContact CG2-OE2 3.44Å
111	F	94.7	Very high	87	Confident	2 Å²	2	38 Å²	38	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	136.9	176.5	51.6	-90.8	0	0	0	111.6	F80 W84 L86 D116 F117 V120 L138 I178 T182	F80-F111 HydrophobicContact CD2-CD2 4.28Å; F80-F111 AromaticContact CE2-CD2 3.91Å; F80-F111 HydrophobicContact CE2-CD2 3.91Å; F80-F111 HydrophobicContact CE2-CE2 4.3Å; W84-F111 HydrophobicContact CB-CD2 4.14Å; W84-F111 HydrophobicContact CB-CE1 4.44Å; W84-F111 HydrophobicContact CB-CE2 3.6Å; W84-F111 HydrophobicContact CB-CZ 3.78Å; W84-F111 HydrophobicContact CG-CE2 4.26Å; W84-F111 PolarHBondContact N-O 3.16Å; W84-F111 PolarHBondContact O-N 3.49Å; L86-F111 HydrophobicContact CB-CE1 4.46Å; L86-F111 HydrophobicContact CD1-CE1 3.77Å; L86-F111 HydrophobicContact CD1-CZ 4.34Å; L86-F111 HydrophobicContact CG-CE1 3.75Å; L86-F111 HydrophobicContact CG-CZ 4.23Å; F111-D116 HydrophobicContact CB-CB 3.55Å; F111-F117 HydrophobicContact CB-CB 4.37Å; F111-F117 HydrophobicContact CD2-CB 3.68Å; F111-F117 HydrophobicContact CD2-CD2 4.3Å; F111-F117 HydrophobicContact CD2-CG 4.45Å; F111-F117 HydrophobicContact CE1-CD2 4.16Å; F111-F117 HydrophobicContact CE2-CB 4.04Å; F111-F117 AromaticContact CE2-CD2 3.84Å; F111-F117 HydrophobicContact CE2-CD2 3.84Å; F111-F117 HydrophobicContact CE2-CG 4.33Å; F111-F117 HydrophobicContact CG-CB 3.96Å; F111-F117 AromaticContact CZ-CD2 3.76Å; F111-F117 HydrophobicContact CZ-CD2 3.76Å; F111-V120 HydrophobicContact CD1-CB 4.22Å; F111-V120 HydrophobicContact CD1-CG1 4.44Å; F111-V120 HydrophobicContact CD1-CG2 4.19Å; F111-L138 HydrophobicContact CE1-CD1 4.38Å; F111-L138 HydrophobicContact CE2-CD1 4.45Å; F111-L138 HydrophobicContact CZ-CD1 3.61Å; F111-I178 HydrophobicContact CZ-CG2 4.26Å; F111-T182 HydrophobicContact CE2-CG2 3.76Å; F111-T182 HydrophobicContact CZ-CG2 4.45Å
112	G	94.3	Very high	88.5	Confident	19 Å²	19	39.4 Å²	39.4	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	2.2	174.1	0	0	0	0	0	113.4	P79 F80	P79-G112 CarbonylContact C-O 3.5Å; P79-G112 WeakPolarHBondContact CA-O 3.46Å; F80-G112 PolarHBondContact N-O 2.95Å
113	T	93.9	Very high	89.5	Confident	13 Å²	13	37.8 Å²	37.8	8%	0.08	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	161.5	178.3	73.3	0	0	0	0	110.7	P76 F80 C115 D116 F117	P76-T113 HydrophobicContact CB-CG2 3.84Å; F80-T113 WeakPolarHBondContact CE2-O 3.34Å; T113-C115 PolarHBondContact O-N 2.96Å; T113-C115 PolarHBondContact OG1-N 2.82Å; T113-D116 PolarHBondContact O-N 2.9Å; T113-D116 PolarHBondContact OG1-N 2.76Å; T113-D116 VanDerWaalsContact OG1-N 3.15Å; T113-D116 PolarHBondContact OG1-OD2 2.99Å; T113-F117 WeakPolarHBondContact O-CB 3.4Å; T113-F117 PolarHBondContact O-N 2.93Å
114	A	93.3	Very high	90.1	Very high	41 Å²	41	38.9 Å²	38.9	34%	0.339	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-34.4	174.4	0	0	0	0	0	112.7	F80 F117 W118	F80-A114 HydrophobicContact CE1-CB 4.37Å; F80-A114 HydrophobicContact CZ-CB 4.02Å; A114-F117 WeakPolarHBondContact O-CB 3.45Å; A114-F117 PolarHBondContact O-N 2.95Å; A114-W118 PolarHBondContact O-N 3.33Å; A114-W118 VanDerWaalsContact O-N 3.07Å
115	C	92	Very high	90.3	Very high	91 Å²	91	42.1 Å²	42.1	62%	0.615	24%	0.244	S	C	*	.	H	α-helix	trans	-67.9	-44.8	178.4	-169.3	0	0	0	0	111.7	T113 F117 W118 T119	T113-C115 PolarHBondContact O-N 2.96Å; T113-C115 PolarHBondContact OG1-N 2.82Å; C115-F117 VanDerWaalsContact C-N 3.31Å; C115-F117 PolarHBondContact O-N 2.88Å; C115-W118 PolarHBondContact O-N 2.81Å; C115-T119 PolarHBondContact O-N 2.81Å; C115-T119 VanDerWaalsContact O-N 3.11Å; C115-T119 PolarHBondContact O-OG1 2.78Å
116	D	92.3	Very high	90.4	Very high	56 Å²	56	49.9 Å²	49.9	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-41	176.5	-58.4	-38.2	0	0	0	110.2	F111 T113 W118 T119 V120	F111-D116 HydrophobicContact CB-CB 3.55Å; T113-D116 PolarHBondContact O-N 2.9Å; T113-D116 PolarHBondContact OG1-N 2.76Å; T113-D116 VanDerWaalsContact OG1-N 3.15Å; T113-D116 PolarHBondContact OG1-OD2 2.99Å; D116-W118 PolarHBondContact O-N 2.87Å; D116-T119 WeakPolarHBondContact O-CB 3.18Å; D116-T119 PolarHBondContact O-N 3.35Å; D116-T119 VanDerWaalsContact O-N 3.12Å; D116-V120 WeakPolarHBondContact O-CG2 3.39Å; D116-V120 PolarHBondContact O-N 2.9Å
117	F	93.5	Very high	90.3	Very high	3 Å²	3	50 Å²	50	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-54.6	-53.4	174.3	162.8	-107.6	0	0	0	111.6	F80 F111 T113 A114 C115 T119 V120 F121 I178 I179	F80-F117 HydrophobicContact CE2-CB 4.31Å; F111-F117 HydrophobicContact CB-CB 4.37Å; F111-F117 HydrophobicContact CD2-CB 3.68Å; F111-F117 HydrophobicContact CD2-CD2 4.3Å; F111-F117 HydrophobicContact CD2-CG 4.45Å; F111-F117 HydrophobicContact CE1-CD2 4.16Å; F111-F117 HydrophobicContact CE2-CB 4.04Å; F111-F117 AromaticContact CE2-CD2 3.84Å; F111-F117 HydrophobicContact CE2-CD2 3.84Å; F111-F117 HydrophobicContact CE2-CG 4.33Å; F111-F117 HydrophobicContact CG-CB 3.96Å; F111-F117 AromaticContact CZ-CD2 3.76Å; F111-F117 HydrophobicContact CZ-CD2 3.76Å; T113-F117 WeakPolarHBondContact O-CB 3.4Å; T113-F117 PolarHBondContact O-N 2.93Å; A114-F117 WeakPolarHBondContact O-CB 3.45Å; A114-F117 PolarHBondContact O-N 2.95Å; C115-F117 VanDerWaalsContact C-N 3.31Å; C115-F117 PolarHBondContact O-N 2.88Å; F117-T119 PolarHBondContact O-N 2.78Å; F117-V120 PolarHBondContact O-N 2.85Å; F117-F121 HydrophobicContact CD2-CB 4.3Å; F117-F121 HydrophobicContact CE2-CB 3.81Å; F117-F121 AromaticContact CE2-CD2 3.82Å; F117-F121 HydrophobicContact CE2-CD2 3.82Å; F117-F121 AromaticContact CE2-CG 3.98Å; F117-F121 HydrophobicContact CE2-CG 3.98Å; F117-F121 HydrophobicContact CZ-CB 3.98Å; F117-F121 HydrophobicContact CZ-CD1 4.49Å; F117-F121 AromaticContact CZ-CD2 3.97Å; F117-F121 HydrophobicContact CZ-CD2 3.97Å; F117-F121 AromaticContact CZ-CG 3.9Å; F117-F121 HydrophobicContact CZ-CG 3.9Å; F117-F121 VanDerWaalsContact O-CB 3.28Å; F117-F121 WeakPolarHBondContact O-CB 3.11Å; F117-F121 PolarHBondContact O-N 2.9Å; F117-I178 HydrophobicContact CD2-CG2 3.94Å; F117-I178 HydrophobicContact CE2-CB 4.2Å; F117-I178 HydrophobicContact CE2-CD1 4.31Å; F117-I178 HydrophobicContact CE2-CG2 3.44Å; F117-I178 VanDerWaalsContact CE2-CG2 3.44Å; F117-I178 HydrophobicContact CZ-CG2 4.09Å; F117-I179 HydrophobicContact CE1-CD1 4.3Å; F117-I179 HydrophobicContact CE1-CG1 3.94Å; F117-I179 HydrophobicContact CZ-CG1 4.23Å
118	W	92.3	Very high	90	Very high	105 Å²	105	50 Å²	50	40%	0.398	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-31.1	179.5	-74.8	116.2	0	0	0	112.5	A114 C115 D116 F121 N122 M175 I179	A114-W118 PolarHBondContact O-N 3.33Å; A114-W118 VanDerWaalsContact O-N 3.07Å; C115-W118 PolarHBondContact O-N 2.81Å; D116-W118 PolarHBondContact O-N 2.87Å; W118-F121 HydrophobicContact CZ3-CD1 4.39Å; W118-N122 WeakPolarHBondContact O-CB 3.08Å; W118-N122 PolarHBondContact O-N 2.8Å; W118-N122 PolarHBondContact O-ND2 3.02Å; W118-M175 HydrophobicContact CH2-CG 4.35Å; W118-M175 HydrophobicContact CH2-SD 3.57Å; W118-M175 VanDerWaalsContact CH2-SD 3.57Å; W118-M175 HydrophobicContact CZ3-SD 3.79Å; W118-I179 HydrophobicContact CH2-CD1 4.37Å; W118-I179 HydrophobicContact CZ2-CD1 4.18Å
119	T	91.3	Very high	89.8	Confident	62 Å²	62	53.6 Å²	53.6	38%	0.38	29%	0.292	S	S	.	.	H	α-helix	trans	-70.4	-43.2	177.3	-54.4	0	0	0	0	112.1	L67 C115 D116 F117 G123	L67-T119 HydrophobicContact CD1-CG2 3.71Å; L67-T119 HydrophobicContact CD2-CG2 3.47Å; L67-T119 VanDerWaalsContact CD2-CG2 3.47Å; L67-T119 HydrophobicContact CG-CG2 3.86Å; C115-T119 PolarHBondContact O-N 2.81Å; C115-T119 VanDerWaalsContact O-N 3.11Å; C115-T119 PolarHBondContact O-OG1 2.78Å; D116-T119 WeakPolarHBondContact O-CB 3.18Å; D116-T119 PolarHBondContact O-N 3.35Å; D116-T119 VanDerWaalsContact O-N 3.12Å; F117-T119 PolarHBondContact O-N 2.78Å; T119-G123 PolarHBondContact O-N 3.13Å
120	V	91.8	Very high	89.4	Confident	17 Å²	17	53.9 Å²	53.9	10%	0.103	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-52.4	174.3	177.2	0	0	0	0	109.8	L86 F111 D116 F117 N122 G123 V124	L86-V120 HydrophobicContact CB-CG1 4.45Å; L86-V120 HydrophobicContact CD1-CG1 4.05Å; F111-V120 HydrophobicContact CD1-CB 4.22Å; F111-V120 HydrophobicContact CD1-CG1 4.44Å; F111-V120 HydrophobicContact CD1-CG2 4.19Å; D116-V120 WeakPolarHBondContact O-CG2 3.39Å; D116-V120 PolarHBondContact O-N 2.9Å; F117-V120 PolarHBondContact O-N 2.85Å; V120-N122 PolarHBondContact O-N 2.76Å; V120-G123 WeakPolarHBondContact O-CA 3.36Å; V120-G123 PolarHBondContact O-N 3.13Å; V120-V124 WeakPolarHBondContact O-CG2 3.41Å; V120-V124 PolarHBondContact O-N 3.12Å
121	F	89.4	Confident	88.8	Confident	42 Å²	42	53.1 Å²	53.1	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-42	-174.3	-167.6	-96.5	0	0	0	112.8	L86 F117 W118 G123 V124 M175 I178	L86-F121 HydrophobicContact CD1-CD2 4.37Å; F117-F121 HydrophobicContact CD2-CB 4.3Å; F117-F121 HydrophobicContact CE2-CB 3.81Å; F117-F121 AromaticContact CE2-CD2 3.82Å; F117-F121 HydrophobicContact CE2-CD2 3.82Å; F117-F121 AromaticContact CE2-CG 3.98Å; F117-F121 HydrophobicContact CE2-CG 3.98Å; F117-F121 HydrophobicContact CZ-CB 3.98Å; F117-F121 HydrophobicContact CZ-CD1 4.49Å; F117-F121 AromaticContact CZ-CD2 3.97Å; F117-F121 HydrophobicContact CZ-CD2 3.97Å; F117-F121 AromaticContact CZ-CG 3.9Å; F117-F121 HydrophobicContact CZ-CG 3.9Å; F117-F121 VanDerWaalsContact O-CB 3.28Å; F117-F121 WeakPolarHBondContact O-CB 3.11Å; F117-F121 PolarHBondContact O-N 2.9Å; W118-F121 HydrophobicContact CZ3-CD1 4.39Å; F121-G123 PolarHBondContact O-N 2.87Å; F121-V124 PolarHBondContact O-N 3.06Å; F121-M175 HydrophobicContact CE1-CB 4.26Å; F121-M175 HydrophobicContact CE1-CG 4.09Å; F121-M175 HydrophobicContact CE1-SD 4.11Å; F121-M175 HydrophobicContact CE2-CB 4.45Å; F121-M175 HydrophobicContact CZ-CB 3.8Å; F121-M175 HydrophobicContact CZ-CG 4.07Å; F121-I178 HydrophobicContact CD2-CD1 4.13Å; F121-I178 HydrophobicContact CE2-CD1 3.88Å
122	N	88.7	Confident	88.2	Confident	121 Å²	121	60 Å²	60	65%	0.647	31%	0.314	S	S	*	.	H	α-helix	trans	-71.1	-18.1	176.3	-68.5	-25.5	0	0	0	113.3	W118 V120	W118-N122 WeakPolarHBondContact O-CB 3.08Å; W118-N122 PolarHBondContact O-N 2.8Å; W118-N122 PolarHBondContact O-ND2 3.02Å; V120-N122 PolarHBondContact O-N 2.76Å
123	G	84.7	Confident	87.6	Confident	48 Å²	48	65.7 Å²	65.7	50%	0.495	33%	0.33	S	S	.	.	H	α-helix	trans	-82	-13	175.7	0	0	0	0	0	114	T119 V120 F121	T119-G123 PolarHBondContact O-N 3.13Å; V120-G123 WeakPolarHBondContact O-CA 3.36Å; V120-G123 PolarHBondContact O-N 3.13Å; F121-G123 PolarHBondContact O-N 2.87Å
124	V	83.2	Confident	87.1	Confident	30 Å²	30	65.1 Å²	65.1	18%	0.182	33%	0.326	C	S	.	.	S	Bend	trans	-96.2	147.4	-176.2	-179.2	0	0	0	0	109.6	L108 V120 F121 R126 M130	L108-V124 HydrophobicContact CB-CG2 3.92Å; L108-V124 HydrophobicContact CD1-CB 4.28Å; L108-V124 HydrophobicContact CD1-CG1 3.56Å; L108-V124 HydrophobicContact CD1-CG2 3.59Å; L108-V124 HydrophobicContact CD2-CG1 4.47Å; L108-V124 HydrophobicContact CD2-CG2 4.22Å; L108-V124 HydrophobicContact CG-CG2 4.12Å; V120-V124 WeakPolarHBondContact O-CG2 3.41Å; V120-V124 PolarHBondContact O-N 3.12Å; F121-V124 PolarHBondContact O-N 3.06Å; V124-R126 PolarHBondContact O-N 3.12Å; V124-M130 HydrophobicContact CG1-CE 4.01Å
125	K	82.3	Confident	86.8	Confident	110 Å²	110	63.2 Å²	63.2	48%	0.478	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-57	138.3	170.9	-165.9	-174.5	-163.8	-173	0	108.9	V127 M129 M130	K125-V127 PolarHBondContact O-N 3.27Å; K125-M129 HydrophobicContact CD-CB 4.32Å; K125-M129 WeakPolarHBondContact CE-O 3.34Å; K125-M129 HydrophobicContact CG-CB 4.16Å; K125-M129 HydrophobicContact CG-CE 4.45Å; K125-M129 PolarHBondContact NZ-O 2.84Å; K125-M130 HydrophobicContact CD-CG 4.45Å; K125-M130 WeakPolarHBondContact O-CE 3.28Å
126	R	87.1	Confident	86.8	Confident	165 Å²	165	59 Å²	59	62%	0.623	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-57.6	141.7	173.1	-63.7	-159.9	-173.7	150.3	-1.1	110.3	V124 N128 M129 M130 D171	V124-R126 PolarHBondContact O-N 3.12Å; R126-N128 VanDerWaalsContact C-N 3.29Å; R126-N128 VanDerWaalsContact CB-OD1 3.28Å; R126-N128 WeakPolarHBondContact CB-OD1 3.36Å; R126-N128 PolarHBondContact O-N 2.92Å; R126-M129 HydrophobicContact CB-CE 3.57Å; R126-M129 HydrophobicContact CB-CG 4.36Å; R126-M129 HydrophobicContact CG-CE 3.75Å; R126-M129 PolarHBondContact O-N 2.95Å; R126-M130 PolarHBondContact O-N 3.31Å; R126-D171 WeakPolarHBondContact CB-OD2 3.44Å; R126-D171 WeakPolarHBondContact CD-OD2 3.21Å
127	V	82.6	Confident	86.7	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.036	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-68.2	-31.8	-171.6	-66.5	0	0	0	0	111.7	K125 M129 M130 C136 V170 D171 W174 L198	K125-V127 PolarHBondContact O-N 3.27Å; V127-M129 PolarHBondContact O-N 2.85Å; V127-M130 HydrophobicContact CB-CE 4.28Å; V127-M130 HydrophobicContact CB-SD 4.13Å; V127-M130 HydrophobicContact CG1-CE 3.56Å; V127-M130 HydrophobicContact CG1-SD 3.89Å; V127-M130 WeakPolarHBondContact O-CB 3.46Å; V127-M130 PolarHBondContact O-N 3.03Å; V127-M130 VanDerWaalsContact O-N 3.14Å; V127-C136 HydrophobicContact CG1-CB 4.36Å; V127-V170 HydrophobicContact CG2-CG1 4.08Å; V127-D171 WeakPolarHBondContact CA-OD1 3.45Å; V127-D171 HydrophobicContact CG2-CB 4.26Å; V127-D171 WeakPolarHBondContact CG2-OD1 3.32Å; V127-D171 PolarHBondContact N-OD1 3.02Å; V127-W174 HydrophobicContact CG2-CB 4.29Å; V127-L198 HydrophobicContact CB-CD2 3.39Å; V127-L198 HydrophobicContact CG1-CD2 3.62Å; V127-L198 HydrophobicContact CG2-CD2 3.45Å; V127-L198 VanDerWaalsContact CG2-CD2 3.45Å
128	N	83.8	Confident	86.7	Confident	36 Å²	36	56.3 Å²	56.3	19%	0.193	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-69.8	-5.9	170.8	68.8	-2.5	0	0	0	114.9	R126 H167 V170 D171	R126-N128 VanDerWaalsContact C-N 3.29Å; R126-N128 VanDerWaalsContact CB-OD1 3.28Å; R126-N128 WeakPolarHBondContact CB-OD1 3.36Å; R126-N128 PolarHBondContact O-N 2.92Å; N128-H167 WeakPolarHBondContact CA-NE2 3.21Å; N128-H167 PolarHBondContact O-NE2 3.26Å; N128-V170 HydrophobicContact CB-CG1 4.13Å; N128-D171 PolarHBondContact N-OD1 2.72Å; N128-D171 PolarHBondContact ND2-OD2 3.4Å; N128-D171 PolarHBondContact OD1-OD1 2.68Å; N128-D171 PolarHBondContact OD1-OD2 2.81Å
129	M	87	Confident	86.7	Confident	104 Å²	104	51.3 Å²	51.3	51%	0.512	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-107.9	-2.8	173.4	-61.6	-169.1	-71.3	0	0	111.3	K125 R126 V127	K125-M129 HydrophobicContact CD-CB 4.32Å; K125-M129 WeakPolarHBondContact CE-O 3.34Å; K125-M129 HydrophobicContact CG-CB 4.16Å; K125-M129 HydrophobicContact CG-CE 4.45Å; K125-M129 PolarHBondContact NZ-O 2.84Å; R126-M129 HydrophobicContact CB-CE 3.57Å; R126-M129 HydrophobicContact CB-CG 4.36Å; R126-M129 HydrophobicContact CG-CE 3.75Å; R126-M129 PolarHBondContact O-N 2.95Å; V127-M129 PolarHBondContact O-N 2.85Å
130	M	85	Confident	86.7	Confident	11 Å²	11	50.4 Å²	50.4	5%	0.054	24%	0.239	C	C	.	.	S	Bend	trans	-67.5	149.4	177.7	-67.9	177.5	-179.4	0	0	110.6	L88 V124 K125 R126 V127	L88-M130 HydrophobicContact CD1-CE 3.61Å; L88-M130 HydrophobicContact CD1-SD 3.47Å; L88-M130 WeakPolarHBondContact CD1-SD 3.2Å; L88-M130 HydrophobicContact CD2-CE 4.4Å; V124-M130 HydrophobicContact CG1-CE 4.01Å; K125-M130 HydrophobicContact CD-CG 4.45Å; K125-M130 WeakPolarHBondContact O-CE 3.28Å; R126-M130 PolarHBondContact O-N 3.31Å; V127-M130 HydrophobicContact CB-CE 4.28Å; V127-M130 HydrophobicContact CB-SD 4.13Å; V127-M130 HydrophobicContact CG1-CE 3.56Å; V127-M130 HydrophobicContact CG1-SD 3.89Å; V127-M130 WeakPolarHBondContact O-CB 3.46Å; V127-M130 PolarHBondContact O-N 3.03Å; V127-M130 VanDerWaalsContact O-N 3.14Å
131	P	82.5	Confident	86.7	Confident	33 Å²	33	52.8 Å²	52.8	21%	0.214	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-53.4	155	172.7	-24.9	34.1	0	0	0	112.7	R133 S134	P131-R133 PolarHBondContact O-N 2.8Å; P131-S134 WeakPolarHBondContact CD-OG 3.37Å; P131-S134 VanDerWaalsContact O-CB 3.22Å; P131-S134 WeakPolarHBondContact O-CB 3.48Å; P131-S134 PolarHBondContact O-N 2.8Å; P131-S134 VanDerWaalsContact O-N 3.13Å; P131-S134 PolarHBondContact O-OG 2.99Å; P131-S134 VanDerWaalsContact O-OG 3.09Å
132	W	82.1	Confident	86.6	Confident	147 Å²	147	56 Å²	56	56%	0.557	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	144.3	169.9	-67.1	120.6	0	0	0	110.4	S134 I200 R201	W132-S134 PolarHBondContact O-N 3.21Å; W132-I200 HydrophobicContact CE3-CG2 3.71Å; W132-I200 HydrophobicContact CZ3-CG2 3.85Å; W132-R201 VanDerWaalsContact CZ3-O 3.27Å; W132-R201 WeakPolarHBondContact CZ3-O 3.49Å
133	R	79.9	Confident	86.4	Confident	139 Å²	139	52.1 Å²	52.1	53%	0.525	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	-4.6	-176.1	-50.4	176.2	173.7	177.6	-2.8	115.1	W89 P131 I200	W89-R133 WeakPolarHBondContact CZ3-O 3.27Å; P131-R133 PolarHBondContact O-N 2.8Å; R133-I200 VanDerWaalsContact CA-O 3.29Å; R133-I200 WeakPolarHBondContact CA-O 3.4Å; R133-I200 PolarHBondContact N-O 3.13Å; R133-I200 VanDerWaalsContact N-O 3.13Å
134	S	84.8	Confident	86.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.248	C	C	.	.			trans	-61.7	151.5	172.1	-69.4	0	0	0	0	112.5	W89 P131 W132 I200	W89-S134 WeakPolarHBondContact O-CA 3.46Å; P131-S134 WeakPolarHBondContact CD-OG 3.37Å; P131-S134 VanDerWaalsContact O-CB 3.22Å; P131-S134 WeakPolarHBondContact O-CB 3.48Å; P131-S134 PolarHBondContact O-N 2.8Å; P131-S134 VanDerWaalsContact O-N 3.13Å; P131-S134 PolarHBondContact O-OG 2.99Å; P131-S134 VanDerWaalsContact O-OG 3.09Å; W132-S134 PolarHBondContact O-N 3.21Å; S134-I200 PolarHBondContact O-N 2.85Å
135	E	87.4	Confident	85.9	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138	-179.7	-49.9	178.8	147.8	0	0	111.4	I44 M52 L88 W89 Y137 L198 R201	I44-E135 HydrophobicContact CD1-CB 4.36Å; I44-E135 HydrophobicContact CD1-CG 4.26Å; M52-E135 VanDerWaalsContact CE-OE2 3.26Å; M52-E135 WeakPolarHBondContact CE-OE2 2.96Å; L88-E135 CarbonylContact C-O 3.56Å; L88-E135 WeakPolarHBondContact CA-O 3.49Å; L88-E135 WeakPolarHBondContact CD1-O 3.37Å; W89-E135 HydrophobicContact CB-CB 4.22Å; W89-E135 HydrophobicContact CE3-CG 4.24Å; W89-E135 PolarHBondContact N-O 3.49Å; W89-E135 PolarHBondContact O-N 3.24Å; E135-Y137 HydrophobicContact CB-CE2 3.69Å; E135-Y137 PolarHBondContact OE2-OH 3.47Å; E135-L198 CarbonylContact C-O 3.48Å; E135-L198 WeakPolarHBondContact CA-O 3.38Å; E135-L198 WeakPolarHBondContact CB-O 3.21Å; E135-R201 IonicContact OE1-CZ 3.55Å; E135-R201 IonicContact OE1-NH1 2.62Å; E135-R201 PolarHBondContact OE1-NH1 2.95Å; E135-R201 IonicContact OE1-NH2 3.35Å; E135-R201 PolarHBondContact OE1-NH2 3.3Å
136	C	90.4	Very high	85.5	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.8	176.4	-173.7	0	0	0	0	109.7	W87 V127 W174 G197 L198	W87-C136 CarbonylContact O-C 3.38Å; W87-C136 WeakPolarHBondContact O-CA 3.4Å; W87-C136 PolarHBondContact O-SG 2.89Å; W87-C136 VanDerWaalsContact O-SG 3.35Å; V127-C136 HydrophobicContact CG1-CB 4.36Å; C136-W174 HydrophobicContact CB-CZ2 4.28Å; C136-G197 CarbonylContact O-C 3.55Å; C136-G197 VanDerWaalsContact O-CA 3.24Å; C136-G197 WeakPolarHBondContact O-CA 3.07Å; C136-L198 HydrophobicContact CB-CB 4.39Å; C136-L198 PolarHBondContact N-O 3.31Å; C136-L198 PolarHBondContact O-N 3.43Å
137	Y	91.6	Very high	85	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.7	-176.4	-60.3	-84.6	0	0	0	111.7	I44 M49 L86 W87 W89 L105 E135 F139 A196 W210	I44-Y137 HydrophobicContact CD1-CE1 4.08Å; I44-Y137 HydrophobicContact CG2-CE1 4.15Å; M49-Y137 HydrophobicContact CG-CE1 3.75Å; M49-Y137 HydrophobicContact SD-CD1 3.73Å; M49-Y137 HydrophobicContact SD-CE1 3.46Å; M49-Y137 WeakPolarHBondContact SD-CE1 3.24Å; L86-Y137 CarbonylContact C-O 3.41Å; L86-Y137 VanDerWaalsContact CA-O 3.3Å; L86-Y137 WeakPolarHBondContact CA-O 3.34Å; L86-Y137 WeakPolarHBondContact CD2-O 3.17Å; W87-Y137 PolarHBondContact N-O 3Å; W87-Y137 PolarHBondContact O-N 3.38Å; W89-Y137 HydrophobicContact CB-CE2 4.12Å; L105-Y137 HydrophobicContact CD1-CD2 4.29Å; E135-Y137 HydrophobicContact CB-CE2 3.69Å; E135-Y137 PolarHBondContact OE2-OH 3.47Å; Y137-F139 AromaticContact CD1-CE2 3.93Å; Y137-F139 HydrophobicContact CD1-CE2 3.93Å; Y137-F139 HydrophobicContact CD1-CZ 4.01Å; Y137-F139 AromaticContact CG-CE2 4Å; Y137-F139 HydrophobicContact CG-CE2 4Å; Y137-A196 CarbonylContact C-O 3.53Å; Y137-A196 WeakPolarHBondContact CA-O 3.43Å; Y137-W210 AromaticContact CD1-CH2 3.81Å; Y137-W210 HydrophobicContact CD1-CH2 3.81Å; Y137-W210 HydrophobicContact CD1-CZ3 4.09Å; Y137-W210 AromaticContact CE1-CH2 3.75Å; Y137-W210 HydrophobicContact CE1-CH2 3.75Å; Y137-W210 HydrophobicContact CE1-CZ3 4.47Å
138	L	93.7	Very high	84.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.2	171.5	178.3	75.8	0	0	0	108.5	W84 A85 L86 F111 W174 I178 I181 T182 G195 A196	W84-L138 HydrophobicContact CB-CD1 3.92Å; W84-L138 HydrophobicContact CE3-CD1 4.17Å; W84-L138 HydrophobicContact CE3-CD2 4.04Å; W84-L138 HydrophobicContact CE3-CG 3.78Å; W84-L138 HydrophobicContact CG-CD1 4.46Å; W84-L138 HydrophobicContact CZ3-CD2 4.39Å; W84-L138 HydrophobicContact CZ3-CG 4.38Å; A85-L138 WeakPolarHBondContact O-CA 3.26Å; L86-L138 HydrophobicContact CD2-CB 4.15Å; L86-L138 HydrophobicContact CD2-CD1 3.93Å; L86-L138 HydrophobicContact CG-CD1 4.18Å; F111-L138 HydrophobicContact CE1-CD1 4.38Å; F111-L138 HydrophobicContact CE2-CD1 4.45Å; F111-L138 HydrophobicContact CZ-CD1 3.61Å; L138-W174 HydrophobicContact CB-CH2 4.04Å; L138-W174 HydrophobicContact CB-CZ2 4.31Å; L138-I178 HydrophobicContact CD1-CG2 4.14Å; L138-I178 HydrophobicContact CD2-CB 4.25Å; L138-I178 HydrophobicContact CD2-CG1 4.1Å; L138-I178 HydrophobicContact CD2-CG2 3.96Å; L138-I181 HydrophobicContact CD2-CB 4.21Å; L138-I181 HydrophobicContact CD2-CD1 4.04Å; L138-I181 HydrophobicContact CD2-CG2 3.98Å; L138-T182 HydrophobicContact CD2-CG2 4.4Å; L138-G195 CarbonylContact O-C 3.45Å; L138-G195 WeakPolarHBondContact O-CA 3.3Å; L138-A196 PolarHBondContact N-O 2.87Å; L138-A196 PolarHBondContact O-N 2.48Å
139	F	91.4	Very high	83.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	158.9	175.2	-69.8	-56.4	0	0	0	111.6	W46 M49 W84 A85 Y137 F143 P145 W210	W46-F139 HydrophobicContact CH2-CD1 4.25Å; W46-F139 AromaticContact CH2-CE1 3.67Å; W46-F139 HydrophobicContact CH2-CE1 3.67Å; W46-F139 AromaticContact CH2-CZ 3.94Å; W46-F139 HydrophobicContact CH2-CZ 3.94Å; W46-F139 HydrophobicContact CZ3-CD1 4.3Å; W46-F139 AromaticContact CZ3-CE1 3.39Å; W46-F139 HydrophobicContact CZ3-CE1 3.39Å; W46-F139 AromaticContact CZ3-CZ 3.71Å; W46-F139 HydrophobicContact CZ3-CZ 3.71Å; M49-F139 HydrophobicContact CE-CE2 4.14Å; M49-F139 HydrophobicContact CE-CZ 3.79Å; M49-F139 HydrophobicContact SD-CE2 3.69Å; M49-F139 HydrophobicContact SD-CZ 3.42Å; M49-F139 WeakPolarHBondContact SD-CZ 3.34Å; W84-F139 CarbonylContact C-O 3.54Å; W84-F139 VanDerWaalsContact CA-O 3.28Å; W84-F139 WeakPolarHBondContact CA-O 3.4Å; A85-F139 PolarHBondContact N-O 2.96Å; A85-F139 PolarHBondContact O-N 2.95Å; Y137-F139 AromaticContact CD1-CE2 3.93Å; Y137-F139 HydrophobicContact CD1-CE2 3.93Å; Y137-F139 HydrophobicContact CD1-CZ 4.01Å; Y137-F139 AromaticContact CG-CE2 4Å; Y137-F139 HydrophobicContact CG-CE2 4Å; F139-F143 HydrophobicContact CB-CB 4.39Å; F139-F143 HydrophobicContact CB-CD1 3.8Å; F139-F143 AromaticContact CD1-CD1 3.74Å; F139-F143 HydrophobicContact CD1-CD1 3.74Å; F139-F143 HydrophobicContact CD1-CE1 4.19Å; F139-F143 HydrophobicContact CD2-CD1 4.21Å; F139-F143 HydrophobicContact CD2-CE1 4.42Å; F139-F143 AromaticContact CG-CD1 3.62Å; F139-F143 HydrophobicContact CG-CD1 3.62Å; F139-F143 HydrophobicContact CG-CE1 4.18Å; F139-P145 HydrophobicContact CD2-CB 3.84Å; F139-P145 HydrophobicContact CD2-CG 4.12Å; F139-P145 HydrophobicContact CE2-CB 3.83Å; F139-P145 HydrophobicContact CE2-CG 4.48Å; F139-W210 AromaticContact CE1-CE3 3.85Å; F139-W210 HydrophobicContact CE1-CE3 3.85Å; F139-W210 AromaticContact CE1-CZ3 3.9Å; F139-W210 HydrophobicContact CE1-CZ3 3.9Å; F139-W210 HydrophobicContact CZ-CE3 4.07Å; F139-W210 HydrophobicContact CZ-CH2 4.41Å; F139-W210 AromaticContact CZ-CZ3 3.68Å; F139-W210 HydrophobicContact CZ-CZ3 3.68Å
140	K	91.3	Very high	82.8	Confident	44 Å²	44	48.4 Å²	48.4	19%	0.191	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	144.2	164.9	-62.8	-172.2	179.2	-165.6	0	108.6	E82 E83 W84 S142 F143	E82-K140 HydrophobicContact CG-CD 4.26Å; E82-K140 IonicContact OE1-NZ 3.36Å; E82-K140 PolarHBondContact OE1-NZ 3.04Å; E83-K140 CarbonylContact O-C 3.57Å; E83-K140 WeakPolarHBondContact O-CA 3.23Å; W84-K140 HydrophobicContact CE3-CG 4.2Å; W84-K140 HydrophobicContact CH2-CG 3.88Å; W84-K140 HydrophobicContact CZ2-CG 4.3Å; W84-K140 HydrophobicContact CZ3-CG 3.83Å; K140-S142 PolarHBondContact O-N 3.12Å; K140-F143 HydrophobicContact CB-CB 4.32Å; K140-F143 WeakPolarHBondContact O-CA 3.31Å; K140-F143 VanDerWaalsContact O-CB 3.31Å; K140-F143 WeakPolarHBondContact O-CB 3.25Å; K140-F143 PolarHBondContact O-N 3.11Å
141	E	91.3	Very high	82	Confident	66 Å²	66	50 Å²	50	31%	0.308	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.6	178.8	175.1	57.2	-170.7	0	0	112.2	E83 A85 K107 T110 F143	E83-E141 HydrophobicContact CB-CB 3.89Å; E83-E141 HydrophobicContact CG-CB 3.87Å; E83-E141 HydrophobicContact CG-CG 4.3Å; E83-E141 PolarHBondContact O-N 3.47Å; A85-E141 WeakPolarHBondContact CB-OE2 3.39Å; K107-E141 WeakPolarHBondContact CE-OE2 3.44Å; K107-E141 IonicContact NZ-OE1 3.36Å; K107-E141 PolarHBondContact NZ-OE1 3.37Å; K107-E141 IonicContact NZ-OE2 2.64Å; K107-E141 PolarHBondContact NZ-OE2 2.68Å; T110-E141 HydrophobicContact CG2-CG 4.44Å; T110-E141 WeakPolarHBondContact CG2-OE2 3.44Å; E141-F143 PolarHBondContact O-N 2.86Å; E141-F143 VanDerWaalsContact O-N 3.14Å
142	S	88	Confident	81.7	Confident	110 Å²	110	51.8 Å²	51.8	77%	0.769	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.2	173.2	66.5	0	0	0	0	113.8	K140	K140-S142 PolarHBondContact O-N 3.12Å
143	F	84.5	Confident	81.4	Confident	39 Å²	39	47.7 Å²	47.7	17%	0.171	27%	0.266	C	S	.	.			trans	-110.4	108	-178.1	-176.5	-91.3	0	0	0	109.9	W46 F139 K140 E141 P145	W46-F143 HydrophobicContact CH2-CD1 4.11Å; W46-F143 AromaticContact CH2-CE1 3.28Å; W46-F143 HydrophobicContact CH2-CE1 3.28Å; W46-F143 HydrophobicContact CH2-CE2 4.23Å; W46-F143 AromaticContact CH2-CZ 3.42Å; W46-F143 HydrophobicContact CH2-CZ 3.42Å; W46-F143 VanDerWaalsContact CH2-CZ 3.42Å; W46-F143 AromaticContact CZ2-CE1 3.59Å; W46-F143 HydrophobicContact CZ2-CE1 3.59Å; W46-F143 HydrophobicContact CZ2-CE2 4.06Å; W46-F143 AromaticContact CZ2-CZ 3.24Å; W46-F143 HydrophobicContact CZ2-CZ 3.24Å; F139-F143 HydrophobicContact CB-CB 4.39Å; F139-F143 HydrophobicContact CB-CD1 3.8Å; F139-F143 AromaticContact CD1-CD1 3.74Å; F139-F143 HydrophobicContact CD1-CD1 3.74Å; F139-F143 HydrophobicContact CD1-CE1 4.19Å; F139-F143 HydrophobicContact CD2-CD1 4.21Å; F139-F143 HydrophobicContact CD2-CE1 4.42Å; F139-F143 AromaticContact CG-CD1 3.62Å; F139-F143 HydrophobicContact CG-CD1 3.62Å; F139-F143 HydrophobicContact CG-CE1 4.18Å; K140-F143 HydrophobicContact CB-CB 4.32Å; K140-F143 WeakPolarHBondContact O-CA 3.31Å; K140-F143 VanDerWaalsContact O-CB 3.31Å; K140-F143 WeakPolarHBondContact O-CB 3.25Å; K140-F143 PolarHBondContact O-N 3.11Å; E141-F143 PolarHBondContact O-N 2.86Å; E141-F143 VanDerWaalsContact O-N 3.14Å; F143-P145 HydrophobicContact CE1-CB 4Å; F143-P145 WeakPolarHBondContact O-CD 3.38Å
144	D	81.1	Confident	81.5	Confident	69 Å²	69	43.5 Å²	43.5	37%	0.369	25%	0.254	S	S	.	.			trans	-86.6	112.8	173.3	-172.4	-17.4	0	0	0	109.9	T146 V147	D144-T146 VanDerWaalsContact CG-OG1 3.23Å; D144-T146 PolarHBondContact O-N 3.45Å; D144-T146 VanDerWaalsContact OD1-CB 3.3Å; D144-T146 WeakPolarHBondContact OD1-CB 3.27Å; D144-T146 WeakPolarHBondContact OD1-CG2 3.13Å; D144-T146 PolarHBondContact OD1-N 2.67Å; D144-T146 PolarHBondContact OD1-OG1 3.32Å; D144-T146 PolarHBondContact OD2-OG1 2.91Å; D144-V147 HydrophobicContact CB-CB 4.45Å; D144-V147 HydrophobicContact CB-CG2 3.89Å; D144-V147 PolarHBondContact O-N 2.93Å
145	P	76.5	Confident	81.5	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.019	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.8	-179.9	32.2	-36.8	0	0	0	113.3	M49 L53 W87 L105 F139 F143 V147	M49-P145 HydrophobicContact CE-CB 4.5Å; L53-P145 HydrophobicContact CD1-CB 3.65Å; L53-P145 HydrophobicContact CD1-CG 4.45Å; L53-P145 WeakPolarHBondContact CD1-O 3.07Å; W87-P145 HydrophobicContact CD2-CG 3.82Å; W87-P145 HydrophobicContact CE3-CG 4.14Å; W87-P145 HydrophobicContact CG-CG 4.28Å; W87-P145 HydrophobicContact CH2-CG 4.22Å; W87-P145 HydrophobicContact CZ2-CG 3.93Å; W87-P145 HydrophobicContact CZ3-CG 4.32Å; L105-P145 HydrophobicContact CD2-CG 4.02Å; F139-P145 HydrophobicContact CD2-CB 3.84Å; F139-P145 HydrophobicContact CD2-CG 4.12Å; F139-P145 HydrophobicContact CE2-CB 3.83Å; F139-P145 HydrophobicContact CE2-CG 4.48Å; F143-P145 HydrophobicContact CE1-CB 4Å; F143-P145 WeakPolarHBondContact O-CD 3.38Å; P145-V147 VanDerWaalsContact C-N 3.34Å
146	T	74.2	Confident	81.3	Confident	39 Å²	39	43.5 Å²	43.5	24%	0.239	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-21.3	-178.3	73.4	0	0	0	0	112.5	V59 L105 D144 P148	V59-T146 HydrophobicContact CG1-CG2 4.28Å; V59-T146 HydrophobicContact CG2-CG2 3.52Å; L105-T146 HydrophobicContact CD2-CG2 3.85Å; D144-T146 VanDerWaalsContact CG-OG1 3.23Å; D144-T146 PolarHBondContact O-N 3.45Å; D144-T146 VanDerWaalsContact OD1-CB 3.3Å; D144-T146 WeakPolarHBondContact OD1-CB 3.27Å; D144-T146 WeakPolarHBondContact OD1-CG2 3.13Å; D144-T146 PolarHBondContact OD1-N 2.67Å; D144-T146 PolarHBondContact OD1-OG1 3.32Å; D144-T146 PolarHBondContact OD2-OG1 2.91Å; T146-P148 WeakPolarHBondContact O-CD 3.5Å
147	V	76.4	Confident	81.2	Confident	80 Å²	80	43.6 Å²	43.6	49%	0.485	25%	0.254	S	S	.	.	S	Bend	trans	-79.9	121.2	-178.8	177.2	0	0	0	0	109.4	D144 P145 R149	D144-V147 HydrophobicContact CB-CB 4.45Å; D144-V147 HydrophobicContact CB-CG2 3.89Å; D144-V147 PolarHBondContact O-N 2.93Å; P145-V147 VanDerWaalsContact C-N 3.34Å; V147-R149 PolarHBondContact O-N 3.38Å
148	P	68.4	Low	81.1	Confident	84 Å²	84	44.4 Å²	44.4	55%	0.545	26%	0.257	S	S	.	.			trans	-58.4	127.5	176.2	-23.4	33.8	0	0	0	110.6	T50 T146	T50-P148 HydrophobicContact CG2-CB 4.46Å; T146-P148 WeakPolarHBondContact O-CD 3.5Å
149	R	72	Confident	80.9	Confident	50 Å²	50	44.4 Å²	44.4	19%	0.189	26%	0.257	C	S	.	.			trans	-123.7	146.5	169.8	75.8	-177.6	-151.5	-161	-2.6	109.9	W46 V147 E155	W46-R149 VanDerWaalsContact CD2-NH2 3.27Å; W46-R149 VanDerWaalsContact CH2-CZ 3.47Å; W46-R149 VanDerWaalsContact CH2-NH1 3.29Å; W46-R149 HydrophobicContact CZ2-CG 4.4Å; W46-R149 VanDerWaalsContact CZ2-NH2 3.31Å; V147-R149 PolarHBondContact O-N 3.38Å; R149-E155 IonicContact CZ-OE1 3.63Å; R149-E155 IonicContact CZ-OE2 3.71Å; R149-E155 IonicContact NE-OE2 2.72Å; R149-E155 IonicContact NH2-OE1 3.93Å; R149-E155 PolarHBondContact NH2-OE1 2.8Å; R149-E155 IonicContact NH2-OE2 3.33Å; R149-E155 PolarHBondContact NH2-OE2 2.95Å
150	S	65.8	Low	80.9	Confident	97 Å²	97	44.4 Å²	44.4	68%	0.678	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-64.4	139	166.8	48.5	0	0	0	0	109.2	Q152	S150-Q152 PolarHBondContact O-N 3.41Å
151	I	67.9	Low	80.8	Confident	44 Å²	44	46.4 Å²	46.4	23%	0.226	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-60.6	128.4	164.2	-77.6	-165.2	0	0	0	108.1	W46 L47 H243	W46-I151 HydrophobicContact CB-CD1 4.48Å; L47-I151 HydrophobicContact CB-CD1 3.46Å; L47-I151 VanDerWaalsContact CB-CD1 3.46Å; L47-I151 HydrophobicContact CB-CG1 4.41Å; L47-I151 HydrophobicContact CD1-CD1 3.43Å; L47-I151 VanDerWaalsContact CD1-CD1 3.43Å; L47-I151 HydrophobicContact CD1-CG1 3.62Å; L47-I151 HydrophobicContact CG-CD1 3.94Å; I151-H243 HydrophobicContact CG2-CB 3.48Å; I151-H243 VanDerWaalsContact CG2-CB 3.48Å
152	Q	77.3	Confident	80.7	Confident	70 Å²	70	44 Å²	44	33%	0.327	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-89.3	136.6	175.1	-52.1	-176.9	18.5	0	0	108.6	S150 D154 E155	S150-Q152 PolarHBondContact O-N 3.41Å; Q152-D154 VanDerWaalsContact CB-OD1 3.23Å; Q152-D154 WeakPolarHBondContact CB-OD1 3.12Å; Q152-D154 PolarHBondContact O-N 2.96Å; Q152-D154 VanDerWaalsContact O-N 3.11Å; Q152-E155 HydrophobicContact CB-CG 3.93Å; Q152-E155 WeakPolarHBondContact O-CB 3.43Å; Q152-E155 PolarHBondContact O-N 2.91Å
153	A	76	Confident	80.7	Confident	61 Å²	61	43.1 Å²	43.1	50%	0.504	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.8	-177	0	0	0	0	0	113.1	Q244	A153-Q244 HydrophobicContact CB-CG 4.18Å; A153-Q244 VanDerWaalsContact O-CD 3.28Å; A153-Q244 WeakPolarHBondContact O-CG 3.39Å; A153-Q244 PolarHBondContact O-NE2 3Å
154	D	82.2	Confident	80.9	Confident	52 Å²	52	44.4 Å²	44.4	28%	0.278	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	3.3	176.3	63.2	-20.1	0	0	0	113.5	Q152 K212 R213	Q152-D154 VanDerWaalsContact CB-OD1 3.23Å; Q152-D154 WeakPolarHBondContact CB-OD1 3.12Å; Q152-D154 PolarHBondContact O-N 2.96Å; Q152-D154 VanDerWaalsContact O-N 3.11Å; D154-K212 WeakPolarHBondContact OD2-CE 3.34Å; D154-K212 IonicContact OD2-NZ 3.77Å; D154-R213 VanDerWaalsContact O-CB 3.32Å; D154-R213 WeakPolarHBondContact O-CB 3.35Å; D154-R213 PolarHBondContact O-N 3.49Å
155	E	83.9	Confident	81.3	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	155.5	174.4	-68.1	178.8	-174.7	0	0	112.5	R149 Q152 L194 T211 K212 H243	R149-E155 IonicContact CZ-OE1 3.63Å; R149-E155 IonicContact CZ-OE2 3.71Å; R149-E155 IonicContact NE-OE2 2.72Å; R149-E155 IonicContact NH2-OE1 3.93Å; R149-E155 PolarHBondContact NH2-OE1 2.8Å; R149-E155 IonicContact NH2-OE2 3.33Å; R149-E155 PolarHBondContact NH2-OE2 2.95Å; Q152-E155 HydrophobicContact CB-CG 3.93Å; Q152-E155 WeakPolarHBondContact O-CB 3.43Å; Q152-E155 PolarHBondContact O-N 2.91Å; E155-L194 HydrophobicContact CG-CD1 3.83Å; E155-T211 WeakPolarHBondContact CA-O 3.33Å; E155-K212 HydrophobicContact CG-CB 4.19Å; E155-K212 HydrophobicContact CG-CG 4.31Å; E155-H243 VanDerWaalsContact CB-ND1 3.26Å; E155-H243 WeakPolarHBondContact CB-ND1 3.22Å; E155-H243 WeakPolarHBondContact O-CB 3.42Å; E155-H243 PolarHBondContact O-N 3.05Å
156	G	84.1	Confident	81.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	-175.6	173.9	0	0	0	0	0	110.4	T211 V241	G156-T211 PolarHBondContact N-O 3.15Å; G156-T211 PolarHBondContact O-N 3.05Å; G156-V241 CarbonylContact C-O 3.57Å; G156-V241 VanDerWaalsContact CA-O 3.24Å; G156-V241 WeakPolarHBondContact CA-O 3.32Å
157	H	87.1	Confident	82.3	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.019	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	148.9	177.3	58.1	-73.2	0	0	0	112.9	T208 V209 W210 Y240 V241 H243	H157-T208 HydrophobicContact CB-CG2 3.69Å; H157-V209 CarbonylContact C-O 3.33Å; H157-V209 WeakPolarHBondContact CA-O 3.19Å; H157-V209 WeakPolarHBondContact CB-O 3.48Å; H157-W210 HydrophobicContact CB-CG 4.19Å; H157-Y240 CarbonylContact O-C 3.59Å; H157-Y240 WeakPolarHBondContact O-CA 2.65Å; H157-Y240 WeakPolarHBondContact O-CD2 3.35Å; H157-V241 PolarHBondContact N-O 2.89Å; H157-V241 PolarHBondContact O-N 3.37Å; H157-H243 AromaticContact CE1-NE2 3.9Å; H157-H243 AromaticContact ND1-CD2 3.51Å; H157-H243 AromaticContact ND1-NE2 3.16Å; H157-H243 PolarHBondContact ND1-NE2 2.78Å; H157-H243 VanDerWaalsContact ND1-NE2 3.16Å
158	W	89.6	Confident	82.8	Confident	18 Å²	18	54.1 Å²	54.1	7%	0.068	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.8	166.9	-67	93.7	0	0	0	109.3	T208 V209 R221 L228 F238 R239 Y240	W158-T208 CarbonylContact O-C 3.59Å; W158-T208 VanDerWaalsContact O-CA 3.25Å; W158-T208 WeakPolarHBondContact O-CA 3.46Å; W158-V209 PolarHBondContact N-O 3.22Å; W158-V209 PolarHBondContact O-N 3.14Å; W158-R221 HydrophobicContact CZ2-CG 3.71Å; W158-R221 VanDerWaalsContact CZ2-O 3.25Å; W158-R221 WeakPolarHBondContact CZ2-O 3.46Å; W158-L228 HydrophobicContact CB-CD1 3.86Å; W158-L228 HydrophobicContact CD2-CD1 4.44Å; W158-L228 HydrophobicContact CG-CD1 3.68Å; W158-F238 HydrophobicContact CB-CE2 3.82Å; W158-F238 HydrophobicContact CB-CZ 3.83Å; W158-F238 HydrophobicContact CD2-CE1 4.07Å; W158-F238 HydrophobicContact CD2-CE2 4.48Å; W158-F238 AromaticContact CD2-CZ 3.67Å; W158-F238 HydrophobicContact CD2-CZ 3.67Å; W158-F238 HydrophobicContact CE3-CD1 4.05Å; W158-F238 AromaticContact CE3-CE1 3.2Å; W158-F238 HydrophobicContact CE3-CE1 3.2Å; W158-F238 HydrophobicContact CE3-CE2 4.05Å; W158-F238 AromaticContact CE3-CZ 3.21Å; W158-F238 HydrophobicContact CE3-CZ 3.21Å; W158-F238 HydrophobicContact CG-CE2 4.45Å; W158-F238 AromaticContact CG-CZ 3.96Å; W158-F238 HydrophobicContact CG-CZ 3.96Å; W158-F238 HydrophobicContact CH2-CE1 4.49Å; W158-F238 HydrophobicContact CZ3-CD1 4.18Å; W158-F238 AromaticContact CZ3-CE1 3.45Å; W158-F238 HydrophobicContact CZ3-CE1 3.45Å; W158-F238 VanDerWaalsContact CZ3-CE1 3.45Å; W158-F238 AromaticContact CZ3-CZ 3.96Å; W158-F238 HydrophobicContact CZ3-CZ 3.96Å; W158-R239 WeakPolarHBondContact CA-O 3.42Å; W158-Y240 AromaticContact CD1-CD2 3.84Å; W158-Y240 AromaticContact CD2-CD2 3.76Å; W158-Y240 HydrophobicContact CD2-CD2 3.76Å; W158-Y240 HydrophobicContact CD2-CG 4.36Å; W158-Y240 AromaticContact CE2-CD2 3.49Å; W158-Y240 VanDerWaalsContact CE2-CD2 3.49Å; W158-Y240 HydrophobicContact CE3-CD2 4.39Å; W158-Y240 HydrophobicContact CG-CD2 4Å; W158-Y240 AromaticContact CZ2-CD2 3.94Å; W158-Y240 HydrophobicContact CZ2-CD2 3.94Å; W158-Y240 HydrophobicContact CZ2-CG 4.26Å; W158-Y240 AromaticContact NE1-CD2 3.52Å; W158-Y240 AromaticContact NE1-CE2 3.91Å
159	I	89.7	Confident	83.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.9	177	-175.2	165.4	0	0	0	111.2	S42 R161 M206 I207 F238 R239	S42-I159 WeakPolarHBondContact O-CD1 3.28Å; I159-R161 HydrophobicContact CG1-CG 4.45Å; I159-M206 HydrophobicContact CD1-CB 4.28Å; I159-M206 HydrophobicContact CD1-CG 4.49Å; I159-M206 HydrophobicContact CD1-SD 3.86Å; I159-M206 HydrophobicContact CG1-CB 4.49Å; I159-I207 WeakPolarHBondContact CA-O 3.43Å; I159-F238 VanDerWaalsContact O-CA 3.29Å; I159-F238 WeakPolarHBondContact O-CA 3.46Å; I159-R239 HydrophobicContact CG2-CG 3.55Å; I159-R239 PolarHBondContact N-O 3.3Å; I159-R239 PolarHBondContact O-N 2.88Å; I159-R239 VanDerWaalsContact O-N 3.11Å
160	A	91.4	Very high	84.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.8	165.5	0	0	0	0	0	109.3	F162 M206 I207 L232 A234 S237 F238	A160-F162 HydrophobicContact CB-CE2 3.96Å; A160-F162 HydrophobicContact CB-CZ 3.88Å; A160-M206 VanDerWaalsContact O-CA 3.31Å; A160-M206 WeakPolarHBondContact O-CA 3.13Å; A160-I207 PolarHBondContact N-O 3.15Å; A160-I207 PolarHBondContact O-N 2.58Å; A160-L232 HydrophobicContact CB-CB 4.15Å; A160-L232 HydrophobicContact CB-CD1 3.79Å; A160-L232 HydrophobicContact CB-CG 4.38Å; A160-A234 HydrophobicContact CB-CB 3.74Å; A160-S237 WeakPolarHBondContact CA-O 3.49Å; A160-F238 HydrophobicContact CB-CD2 4.01Å
161	R	89.3	Confident	85.8	Confident	86 Å²	86	45.6 Å²	45.6	33%	0.325	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.9	168.7	-56.1	-160.6	173.2	119.1	-20.3	110.5	E41 S42 I159 M206 S237	E41-R161 PolarHBondContact O-NH2 2.72Å; S42-R161 PolarHBondContact O-NH2 2.93Å; I159-R161 HydrophobicContact CG1-CG 4.45Å; R161-M206 HydrophobicContact CB-CG 4.4Å; R161-M206 HydrophobicContact CG-CG 3.88Å; R161-M206 HydrophobicContact CG-SD 4Å; R161-M206 PolarHBondContact NE-SD 3.25Å; R161-M206 VanDerWaalsContact NE-SD 3.38Å; R161-S237 PolarHBondContact N-O 3.19Å
162	F	89.4	Confident	87	Confident	15 Å²	15	51.7 Å²	51.7	7%	0.066	27%	0.271	C	S	.	.			trans	-107.6	134.5	178.4	-58.2	-80.3	0	0	0	108.9	A160 V170 Y173 G204 D205 I207 L232	A160-F162 HydrophobicContact CB-CE2 3.96Å; A160-F162 HydrophobicContact CB-CZ 3.88Å; F162-V170 HydrophobicContact CD2-CG2 4.43Å; F162-Y173 AromaticContact CD1-CD2 3.72Å; F162-Y173 HydrophobicContact CD1-CD2 3.72Å; F162-Y173 AromaticContact CD1-CE2 3.81Å; F162-Y173 HydrophobicContact CD1-CE2 3.81Å; F162-Y173 HydrophobicContact CE1-CD1 4.47Å; F162-Y173 AromaticContact CE1-CD2 3.32Å; F162-Y173 HydrophobicContact CE1-CD2 3.32Å; F162-Y173 AromaticContact CE1-CE2 3.66Å; F162-Y173 HydrophobicContact CE1-CE2 3.66Å; F162-Y173 AromaticContact CE1-CG 3.79Å; F162-Y173 HydrophobicContact CE1-CG 3.79Å; F162-Y173 AromaticContact CZ-CD2 3.89Å; F162-Y173 HydrophobicContact CZ-CD2 3.89Å; F162-Y173 HydrophobicContact CZ-CG 4.02Å; F162-G204 CarbonylContact O-C 3.55Å; F162-G204 WeakPolarHBondContact O-CA 3.4Å; F162-D205 HydrophobicContact CB-CB 4.42Å; F162-D205 HydrophobicContact CD2-CB 4.42Å; F162-D205 WeakPolarHBondContact CD2-O 3.32Å; F162-D205 PolarHBondContact N-O 3.42Å; F162-D205 PolarHBondContact O-N 3.41Å; F162-I207 HydrophobicContact CE2-CB 4Å; F162-I207 HydrophobicContact CE2-CD1 3.65Å; F162-I207 HydrophobicContact CE2-CG1 3.71Å; F162-I207 HydrophobicContact CZ-CD1 3.94Å; F162-I207 HydrophobicContact CZ-CG1 4.44Å; F162-L232 WeakPolarHBondContact CE1-O 3.35Å; F162-L232 HydrophobicContact CZ-CB 4.34Å; F162-L232 HydrophobicContact CZ-CD2 4.46Å; F162-L232 WeakPolarHBondContact CZ-O 3.3Å
163	D	88.5	Confident	87.7	Confident	92 Å²	92	50.6 Å²	50.6	49%	0.492	26%	0.264	S	S	.	.			trans	-64.3	140.7	173.4	-177	-58.7	0	0	0	109.3	A165 H166	D163-A165 PolarHBondContact O-N 2.88Å; D163-A165 VanDerWaalsContact OD1-CB 3.27Å; D163-A165 WeakPolarHBondContact OD1-CB 3.4Å; D163-A165 PolarHBondContact OD1-N 2.75Å; D163-H166 WeakPolarHBondContact O-CA 3.37Å; D163-H166 PolarHBondContact O-N 2.83Å
164	P	87.6	Confident	88.5	Confident	66 Å²	66	47.8 Å²	47.8	43%	0.429	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-48	-32.8	177.1	-28.8	34.3	0	0	0	114.3	H166 H167	P164-H166 PolarHBondContact O-N 2.85Å; P164-H166 VanDerWaalsContact O-N 3.13Å; P164-H167 WeakPolarHBondContact O-CB 3.46Å; P164-H167 PolarHBondContact O-N 3.01Å; P164-H167 VanDerWaalsContact O-N 3.12Å
165	A	89	Confident	89	Confident	84 Å²	84	47.5 Å²	47.5	69%	0.694	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-62.2	-18.7	176.3	0	0	0	0	0	113.9	D163	D163-A165 PolarHBondContact O-N 2.88Å; D163-A165 VanDerWaalsContact OD1-CB 3.27Å; D163-A165 WeakPolarHBondContact OD1-CB 3.4Å; D163-A165 PolarHBondContact OD1-N 2.75Å
166	H	86.6	Confident	89.5	Confident	102 Å²	102	51.1 Å²	51.1	47%	0.472	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-102.7	9.8	179	-60.4	85.6	0	0	0	113.4	D163 P164 Q168 A169	D163-H166 WeakPolarHBondContact O-CA 3.37Å; D163-H166 PolarHBondContact O-N 2.83Å; P164-H166 PolarHBondContact O-N 2.85Å; P164-H166 VanDerWaalsContact O-N 3.13Å; H166-Q168 PolarHBondContact O-N 3.14Å; H166-Q168 VanDerWaalsContact O-N 3.12Å; H166-A169 WeakPolarHBondContact O-CB 3.28Å; H166-A169 PolarHBondContact O-N 2.99Å
167	H	86.1	Confident	89.9	Confident	37 Å²	37	51.1 Å²	51.1	17%	0.171	26%	0.255	C	S	.	.	H	α-helix	trans	-51.6	-38.2	179.6	-179.2	65.4	0	0	0	112.6	N128 P164 A169 V170 D205	N128-H167 WeakPolarHBondContact CA-NE2 3.21Å; N128-H167 PolarHBondContact O-NE2 3.26Å; P164-H167 WeakPolarHBondContact O-CB 3.46Å; P164-H167 PolarHBondContact O-N 3.01Å; P164-H167 VanDerWaalsContact O-N 3.12Å; H167-A169 PolarHBondContact O-N 3.14Å; H167-A169 VanDerWaalsContact O-N 3.13Å; H167-V170 WeakPolarHBondContact O-CB 3.22Å; H167-V170 WeakPolarHBondContact O-CG1 3.47Å; H167-V170 PolarHBondContact O-N 2.88Å; H167-D205 IonicContact CE1-OD1 3.46Å; H167-D205 IonicContact CE1-OD2 3.41Å; H167-D205 IonicContact CG-OD2 2.68Å; H167-D205 IonicContact ND1-OD1 3.44Å; H167-D205 PolarHBondContact ND1-OD1 3.09Å; H167-D205 IonicContact ND1-OD2 2.72Å; H167-D205 PolarHBondContact ND1-OD2 3.45Å
168	Q	87.1	Confident	90.3	Very high	172 Å²	172	50.9 Å²	50.9	80%	0.804	25%	0.254	S	S	*	.	H	α-helix	trans	-61.6	-24.6	177.7	-65.1	-174.1	-8	0	0	113.9	H166	H166-Q168 PolarHBondContact O-N 3.14Å; H166-Q168 VanDerWaalsContact O-N 3.12Å
169	A	89.8	Confident	90.5	Very high	31 Å²	31	51.6 Å²	51.6	26%	0.256	26%	0.259	S	S	.	.	H	α-helix	trans	-90.6	-9.2	178.9	0	0	0	0	0	113.3	H166 H167 D171 R172 Y173	H166-A169 WeakPolarHBondContact O-CB 3.28Å; H166-A169 PolarHBondContact O-N 2.99Å; H167-A169 PolarHBondContact O-N 3.14Å; H167-A169 VanDerWaalsContact O-N 3.13Å; A169-D171 VanDerWaalsContact C-N 3.29Å; A169-D171 PolarHBondContact O-N 2.78Å; A169-R172 WeakPolarHBondContact O-CB 3.32Å; A169-R172 PolarHBondContact O-N 3.22Å; A169-Y173 HydrophobicContact CB-CD2 4.29Å; A169-Y173 HydrophobicContact CB-CE2 3.68Å; A169-Y173 VanDerWaalsContact O-CD2 3.32Å; A169-Y173 WeakPolarHBondContact O-CD2 3.36Å; A169-Y173 PolarHBondContact O-N 3.4Å
170	V	89.7	Confident	90.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-35.7	-174	81.4	0	0	0	0	112.5	V127 N128 F162 H167 R172 Y173 W174 L198 I200 D205	V127-V170 HydrophobicContact CG2-CG1 4.08Å; N128-V170 HydrophobicContact CB-CG1 4.13Å; F162-V170 HydrophobicContact CD2-CG2 4.43Å; H167-V170 WeakPolarHBondContact O-CB 3.22Å; H167-V170 WeakPolarHBondContact O-CG1 3.47Å; H167-V170 PolarHBondContact O-N 2.88Å; V170-R172 PolarHBondContact O-N 3.35Å; V170-Y173 PolarHBondContact O-N 3.38Å; V170-W174 WeakPolarHBondContact O-CB 3.16Å; V170-W174 PolarHBondContact O-N 2.82Å; V170-L198 HydrophobicContact CG2-CD1 3.55Å; V170-I200 HydrophobicContact CG1-CD1 4.27Å; V170-D205 HydrophobicContact CB-CB 4.48Å; V170-D205 HydrophobicContact CG2-CB 3.71Å
171	D	90.4	Very high	90.7	Very high	22 Å²	22	52 Å²	52	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-51	-46.6	172.1	-76.4	-12.6	0	0	0	111.8	R126 V127 N128 A169 M175	R126-D171 WeakPolarHBondContact CB-OD2 3.44Å; R126-D171 WeakPolarHBondContact CD-OD2 3.21Å; V127-D171 WeakPolarHBondContact CA-OD1 3.45Å; V127-D171 HydrophobicContact CG2-CB 4.26Å; V127-D171 WeakPolarHBondContact CG2-OD1 3.32Å; V127-D171 PolarHBondContact N-OD1 3.02Å; N128-D171 PolarHBondContact N-OD1 2.72Å; N128-D171 PolarHBondContact ND2-OD2 3.4Å; N128-D171 PolarHBondContact OD1-OD1 2.68Å; N128-D171 PolarHBondContact OD1-OD2 2.81Å; A169-D171 VanDerWaalsContact C-N 3.29Å; A169-D171 PolarHBondContact O-N 2.78Å; D171-M175 VanDerWaalsContact O-CB 3.27Å; D171-M175 WeakPolarHBondContact O-CB 3.35Å; D171-M175 PolarHBondContact O-N 3.44Å
172	R	91.3	Very high	90.8	Very high	172 Å²	172	48.2 Å²	48.2	65%	0.649	25%	0.249	S	C	*	.	H	α-helix	trans	-68.2	-45.9	-177.8	-178.7	-177.4	172.9	-172.2	-1.2	110.1	A169 V170 W174 M175 M176	A169-R172 WeakPolarHBondContact O-CB 3.32Å; A169-R172 PolarHBondContact O-N 3.22Å; V170-R172 PolarHBondContact O-N 3.35Å; R172-W174 VanDerWaalsContact C-N 3.32Å; R172-W174 PolarHBondContact O-N 2.91Å; R172-M175 PolarHBondContact O-N 2.98Å; R172-M176 HydrophobicContact CG-CG 4.31Å; R172-M176 WeakPolarHBondContact O-CB 3.48Å; R172-M176 WeakPolarHBondContact O-CG 3.46Å; R172-M176 PolarHBondContact O-N 3.48Å
173	Y	92	Very high	90.9	Very high	47 Å²	47	52.2 Å²	52.2	18%	0.184	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-40.7	178.9	-61	-49.9	0	0	0	111.7	F162 A169 V170 M176 T177 L232	F162-Y173 AromaticContact CD1-CD2 3.72Å; F162-Y173 HydrophobicContact CD1-CD2 3.72Å; F162-Y173 AromaticContact CD1-CE2 3.81Å; F162-Y173 HydrophobicContact CD1-CE2 3.81Å; F162-Y173 HydrophobicContact CE1-CD1 4.47Å; F162-Y173 AromaticContact CE1-CD2 3.32Å; F162-Y173 HydrophobicContact CE1-CD2 3.32Å; F162-Y173 AromaticContact CE1-CE2 3.66Å; F162-Y173 HydrophobicContact CE1-CE2 3.66Å; F162-Y173 AromaticContact CE1-CG 3.79Å; F162-Y173 HydrophobicContact CE1-CG 3.79Å; F162-Y173 AromaticContact CZ-CD2 3.89Å; F162-Y173 HydrophobicContact CZ-CD2 3.89Å; F162-Y173 HydrophobicContact CZ-CG 4.02Å; A169-Y173 HydrophobicContact CB-CD2 4.29Å; A169-Y173 HydrophobicContact CB-CE2 3.68Å; A169-Y173 VanDerWaalsContact O-CD2 3.32Å; A169-Y173 WeakPolarHBondContact O-CD2 3.36Å; A169-Y173 PolarHBondContact O-N 3.4Å; V170-Y173 PolarHBondContact O-N 3.38Å; Y173-M176 PolarHBondContact O-N 3.29Å; Y173-T177 WeakPolarHBondContact O-CB 3.42Å; Y173-T177 PolarHBondContact O-N 3.35Å; Y173-T177 PolarHBondContact O-OG1 3.36Å; Y173-L232 WeakPolarHBondContact CD1-O 3.2Å; Y173-L232 WeakPolarHBondContact CE1-O 3.11Å
174	W	93.4	Very high	90.7	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-48.8	176.4	-178.5	-128.4	0	0	0	112.1	L86 V127 C136 L138 V170 R172 M176 T177 I178 A196 L198 I207	L86-W174 HydrophobicContact CD2-CZ2 4.21Å; V127-W174 HydrophobicContact CG2-CB 4.29Å; C136-W174 HydrophobicContact CB-CZ2 4.28Å; L138-W174 HydrophobicContact CB-CH2 4.04Å; L138-W174 HydrophobicContact CB-CZ2 4.31Å; V170-W174 WeakPolarHBondContact O-CB 3.16Å; V170-W174 PolarHBondContact O-N 2.82Å; R172-W174 VanDerWaalsContact C-N 3.32Å; R172-W174 PolarHBondContact O-N 2.91Å; W174-M176 PolarHBondContact O-N 3.39Å; W174-T177 HydrophobicContact CZ3-CG2 4.48Å; W174-T177 WeakPolarHBondContact O-CB 3.31Å; W174-T177 PolarHBondContact O-N 2.99Å; W174-T177 VanDerWaalsContact O-N 3.13Å; W174-I178 HydrophobicContact CD2-CD1 4.11Å; W174-I178 HydrophobicContact CD2-CG1 4.3Å; W174-I178 HydrophobicContact CG-CD1 4.31Å; W174-I178 HydrophobicContact CH2-CG1 4.39Å; W174-I178 HydrophobicContact CZ2-CD1 3.96Å; W174-I178 HydrophobicContact CZ2-CG1 4.06Å; W174-I178 WeakPolarHBondContact O-CG1 3.32Å; W174-I178 PolarHBondContact O-N 3.37Å; W174-A196 HydrophobicContact CH2-CB 3.98Å; W174-A196 HydrophobicContact CZ3-CB 3.78Å; W174-L198 HydrophobicContact CB-CD2 4.08Å; W174-L198 HydrophobicContact CD2-CB 3.89Å; W174-L198 HydrophobicContact CD2-CD2 4.28Å; W174-L198 HydrophobicContact CE3-CB 3.89Å; W174-L198 HydrophobicContact CG-CB 4.36Å; W174-L198 HydrophobicContact CG-CD2 3.88Å; W174-L198 HydrophobicContact CZ3-CB 4.24Å; W174-I207 HydrophobicContact CB-CD1 4.27Å; W174-I207 HydrophobicContact CE3-CD1 4.43Å; W174-I207 HydrophobicContact CE3-CG1 4.33Å; W174-I207 HydrophobicContact CE3-CG2 4.2Å; W174-I207 HydrophobicContact CZ3-CG2 4.29Å
175	M	93.9	Very high	90.5	Very high	46 Å²	46	51.2 Å²	51.2	23%	0.227	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-47.2	175.9	-176.8	-177.7	69.7	0	0	112	W118 F121 D171 R172 T177 I178 I179	W118-M175 HydrophobicContact CH2-CG 4.35Å; W118-M175 HydrophobicContact CH2-SD 3.57Å; W118-M175 VanDerWaalsContact CH2-SD 3.57Å; W118-M175 HydrophobicContact CZ3-SD 3.79Å; F121-M175 HydrophobicContact CE1-CB 4.26Å; F121-M175 HydrophobicContact CE1-CG 4.09Å; F121-M175 HydrophobicContact CE1-SD 4.11Å; F121-M175 HydrophobicContact CE2-CB 4.45Å; F121-M175 HydrophobicContact CZ-CB 3.8Å; F121-M175 HydrophobicContact CZ-CG 4.07Å; D171-M175 VanDerWaalsContact O-CB 3.27Å; D171-M175 WeakPolarHBondContact O-CB 3.35Å; D171-M175 PolarHBondContact O-N 3.44Å; R172-M175 PolarHBondContact O-N 2.98Å; M175-T177 VanDerWaalsContact C-N 3.26Å; M175-T177 PolarHBondContact O-N 3.39Å; M175-I178 PolarHBondContact O-N 2.81Å; M175-I179 HydrophobicContact CG-CD1 3.95Å; M175-I179 WeakPolarHBondContact O-CG1 3.46Å; M175-I179 PolarHBondContact O-N 3.46Å
176	M	93.7	Very high	90.2	Very high	78 Å²	78	47.2 Å²	47.2	38%	0.384	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-35.3	177.8	-69.9	-62.6	-59.1	0	0	111.9	R172 Y173 W174 A180 V231	R172-M176 HydrophobicContact CG-CG 4.31Å; R172-M176 WeakPolarHBondContact O-CB 3.48Å; R172-M176 WeakPolarHBondContact O-CG 3.46Å; R172-M176 PolarHBondContact O-N 3.48Å; Y173-M176 PolarHBondContact O-N 3.29Å; W174-M176 PolarHBondContact O-N 3.39Å; M176-A180 VanDerWaalsContact O-CB 3.3Å; M176-A180 WeakPolarHBondContact O-CB 3.43Å; M176-A180 PolarHBondContact O-N 3.42Å; M176-V231 HydrophobicContact CB-CG1 4.01Å; M176-V231 WeakPolarHBondContact O-CG1 3.27Å
177	T	93.5	Very high	89.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-48.9	175.4	-57.4	0	0	0	0	111.1	Y173 W174 M175 I179 A180 I181 A196 I207 V209 L232	Y173-T177 WeakPolarHBondContact O-CB 3.42Å; Y173-T177 PolarHBondContact O-N 3.35Å; Y173-T177 PolarHBondContact O-OG1 3.36Å; W174-T177 HydrophobicContact CZ3-CG2 4.48Å; W174-T177 WeakPolarHBondContact O-CB 3.31Å; W174-T177 PolarHBondContact O-N 2.99Å; W174-T177 VanDerWaalsContact O-N 3.13Å; M175-T177 VanDerWaalsContact C-N 3.26Å; M175-T177 PolarHBondContact O-N 3.39Å; T177-I179 VanDerWaalsContact C-N 3.35Å; T177-I179 PolarHBondContact O-N 2.74Å; T177-A180 PolarHBondContact O-N 2.72Å; T177-I181 HydrophobicContact CG2-CD1 3.88Å; T177-I181 VanDerWaalsContact O-CG1 3.28Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 3.01Å; T177-A196 HydrophobicContact CG2-CB 4.17Å; T177-I207 HydrophobicContact CG2-CG2 4.14Å; T177-V209 HydrophobicContact CG2-CG2 4.01Å; T177-L232 HydrophobicContact CG2-CD2 4.47Å; T177-L232 WeakPolarHBondContact OG1-CD2 3.44Å
178	I	94.3	Very high	89.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-48.8	178.1	-63.3	161.9	0	0	0	110.3	L86 F111 F117 F121 L138 W174 M175 A180 I181 T182	L86-I178 HydrophobicContact CD2-CD1 3.96Å; F111-I178 HydrophobicContact CZ-CG2 4.26Å; F117-I178 HydrophobicContact CD2-CG2 3.94Å; F117-I178 HydrophobicContact CE2-CB 4.2Å; F117-I178 HydrophobicContact CE2-CD1 4.31Å; F117-I178 HydrophobicContact CE2-CG2 3.44Å; F117-I178 VanDerWaalsContact CE2-CG2 3.44Å; F117-I178 HydrophobicContact CZ-CG2 4.09Å; F121-I178 HydrophobicContact CD2-CD1 4.13Å; F121-I178 HydrophobicContact CE2-CD1 3.88Å; L138-I178 HydrophobicContact CD1-CG2 4.14Å; L138-I178 HydrophobicContact CD2-CB 4.25Å; L138-I178 HydrophobicContact CD2-CG1 4.1Å; L138-I178 HydrophobicContact CD2-CG2 3.96Å; W174-I178 HydrophobicContact CD2-CD1 4.11Å; W174-I178 HydrophobicContact CD2-CG1 4.3Å; W174-I178 HydrophobicContact CG-CD1 4.31Å; W174-I178 HydrophobicContact CH2-CG1 4.39Å; W174-I178 HydrophobicContact CZ2-CD1 3.96Å; W174-I178 HydrophobicContact CZ2-CG1 4.06Å; W174-I178 WeakPolarHBondContact O-CG1 3.32Å; W174-I178 PolarHBondContact O-N 3.37Å; M175-I178 PolarHBondContact O-N 2.81Å; I178-A180 PolarHBondContact O-N 3.02Å; I178-I181 PolarHBondContact O-N 3.39Å; I178-T182 HydrophobicContact CG2-CG2 3.92Å; I178-T182 WeakPolarHBondContact O-CB 3.28Å; I178-T182 WeakPolarHBondContact O-CG2 3.49Å; I178-T182 PolarHBondContact O-N 2.85Å; I178-T182 PolarHBondContact O-OG1 3.18Å
179	I	93.6	Very high	88.8	Confident	32 Å²	32	43.5 Å²	43.5	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-45.1	179.9	-66.3	168.5	0	0	0	111.2	F117 W118 M175 T177 I181 T182 E183	F117-I179 HydrophobicContact CE1-CD1 4.3Å; F117-I179 HydrophobicContact CE1-CG1 3.94Å; F117-I179 HydrophobicContact CZ-CG1 4.23Å; W118-I179 HydrophobicContact CH2-CD1 4.37Å; W118-I179 HydrophobicContact CZ2-CD1 4.18Å; M175-I179 HydrophobicContact CG-CD1 3.95Å; M175-I179 WeakPolarHBondContact O-CG1 3.46Å; M175-I179 PolarHBondContact O-N 3.46Å; T177-I179 VanDerWaalsContact C-N 3.35Å; T177-I179 PolarHBondContact O-N 2.74Å; I179-I181 VanDerWaalsContact C-N 3.26Å; I179-I181 PolarHBondContact O-N 2.79Å; I179-T182 PolarHBondContact O-N 2.81Å; I179-T182 PolarHBondContact O-OG1 3.11Å; I179-E183 HydrophobicContact CG2-CG 3.97Å; I179-E183 VanDerWaalsContact O-CB 3.29Å; I179-E183 WeakPolarHBondContact O-CB 3.12Å; I179-E183 WeakPolarHBondContact O-CG 3.24Å; I179-E183 PolarHBondContact O-N 2.81Å
180	A	92.7	Very high	87.6	Confident	7 Å²	7	43.1 Å²	43.1	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-35.5	179.5	0	0	0	0	0	112.8	M176 T177 I178 K185 L186 V231	M176-A180 VanDerWaalsContact O-CB 3.3Å; M176-A180 WeakPolarHBondContact O-CB 3.43Å; M176-A180 PolarHBondContact O-N 3.42Å; T177-A180 PolarHBondContact O-N 2.72Å; I178-A180 PolarHBondContact O-N 3.02Å; A180-K185 PolarHBondContact O-N 2.82Å; A180-K185 VanDerWaalsContact O-N 3.13Å; A180-L186 HydrophobicContact CB-CD1 4.08Å; A180-L186 HydrophobicContact CB-CG 4.13Å; A180-V231 HydrophobicContact CB-CG1 3.94Å; A180-V231 HydrophobicContact CB-CG2 3.93Å
181	I	92.6	Very high	86.9	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-71.5	-51.1	176	-67.9	170.9	0	0	0	110.6	W84 L138 T177 I178 I179 G184 L186 L193 A196 V209	W84-I181 HydrophobicContact CE3-CG2 4.32Å; W84-I181 HydrophobicContact CH2-CG2 3.27Å; W84-I181 HydrophobicContact CZ2-CG2 3.52Å; W84-I181 HydrophobicContact CZ3-CG2 3.71Å; L138-I181 HydrophobicContact CD2-CB 4.21Å; L138-I181 HydrophobicContact CD2-CD1 4.04Å; L138-I181 HydrophobicContact CD2-CG2 3.98Å; T177-I181 HydrophobicContact CG2-CD1 3.88Å; T177-I181 VanDerWaalsContact O-CG1 3.28Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 3.01Å; I178-I181 PolarHBondContact O-N 3.39Å; I179-I181 VanDerWaalsContact C-N 3.26Å; I179-I181 PolarHBondContact O-N 2.79Å; I181-G184 PolarHBondContact O-N 3.3Å; I181-L186 HydrophobicContact CG1-CD1 3.69Å; I181-L193 HydrophobicContact CB-CD1 4.43Å; I181-L193 HydrophobicContact CG1-CD1 4.07Å; I181-L193 HydrophobicContact CG2-CD1 4.24Å; I181-A196 HydrophobicContact CD1-CB 3.56Å; I181-V209 HydrophobicContact CD1-CG1 4.5Å
182	T	92.4	Very high	86.5	Confident	6 Å²	6	44.8 Å²	44.8	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-75.4	-34.7	-169.9	59.4	0	0	0	0	112.7	F80 W84 F111 L138 I178 I179 G184	F80-T182 WeakPolarHBondContact CD1-O 3.32Å; F80-T182 HydrophobicContact CE2-CG2 4.48Å; W84-T182 HydrophobicContact CD2-CG2 4.18Å; W84-T182 HydrophobicContact CG-CG2 3.9Å; F111-T182 HydrophobicContact CE2-CG2 3.76Å; F111-T182 HydrophobicContact CZ-CG2 4.45Å; L138-T182 HydrophobicContact CD2-CG2 4.4Å; I178-T182 HydrophobicContact CG2-CG2 3.92Å; I178-T182 WeakPolarHBondContact O-CB 3.28Å; I178-T182 WeakPolarHBondContact O-CG2 3.49Å; I178-T182 PolarHBondContact O-N 2.85Å; I178-T182 PolarHBondContact O-OG1 3.18Å; I179-T182 PolarHBondContact O-N 2.81Å; I179-T182 PolarHBondContact O-OG1 3.11Å; T182-G184 PolarHBondContact O-N 3.35Å
183	E	90	Very high	86.3	Confident	98 Å²	98	37.5 Å²	37.5	46%	0.458	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-1.6	173.1	-66.7	-166.7	166.2	0	0	113.6	F80 I179 K185	F80-E183 HydrophobicContact CE1-CG 4.22Å; I179-E183 HydrophobicContact CG2-CG 3.97Å; I179-E183 VanDerWaalsContact O-CB 3.29Å; I179-E183 WeakPolarHBondContact O-CB 3.12Å; I179-E183 WeakPolarHBondContact O-CG 3.24Å; I179-E183 PolarHBondContact O-N 2.81Å; E183-K185 VanDerWaalsContact C-N 3.28Å; E183-K185 HydrophobicContact CB-CG 4.15Å; E183-K185 PolarHBondContact O-N 2.76Å; E183-K185 WeakPolarHBondContact OE2-CE 3.38Å; E183-K185 IonicContact OE2-NZ 3.91Å
184	G	85.8	Confident	86.1	Confident	15 Å²	15	36.5 Å²	36.5	16%	0.155	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	17.9	178.2	0	0	0	0	0	114.6	I181 T182 L186 Q187	I181-G184 PolarHBondContact O-N 3.3Å; T182-G184 PolarHBondContact O-N 3.35Å; G184-L186 PolarHBondContact O-N 3.5Å; G184-Q187 VanDerWaalsContact O-CB 3.29Å; G184-Q187 WeakPolarHBondContact O-CB 3.32Å; G184-Q187 WeakPolarHBondContact O-CG 3.36Å; G184-Q187 PolarHBondContact O-N 3.02Å
185	K	83.7	Confident	86	Confident	122 Å²	122	36.5 Å²	36.5	53%	0.53	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.6	179	-59.5	-59.8	-177.2	-172.7	0	112.8	A180 E183 Q187	A180-K185 PolarHBondContact O-N 2.82Å; A180-K185 VanDerWaalsContact O-N 3.13Å; E183-K185 VanDerWaalsContact C-N 3.28Å; E183-K185 HydrophobicContact CB-CG 4.15Å; E183-K185 PolarHBondContact O-N 2.76Å; E183-K185 WeakPolarHBondContact OE2-CE 3.38Å; E183-K185 IonicContact OE2-NZ 3.91Å; K185-Q187 VanDerWaalsContact C-N 3.33Å
186	L	82.2	Confident	85.9	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	5.4	179.7	-60.4	174.7	0	0	0	113	A180 I181 G184 Y189 L193 L224 M227 L228	A180-L186 HydrophobicContact CB-CD1 4.08Å; A180-L186 HydrophobicContact CB-CG 4.13Å; I181-L186 HydrophobicContact CG1-CD1 3.69Å; G184-L186 PolarHBondContact O-N 3.5Å; L186-Y189 WeakPolarHBondContact O-CD2 3.46Å; L186-L193 HydrophobicContact CB-CD1 3.55Å; L186-L193 HydrophobicContact CD1-CD1 3.79Å; L186-L193 HydrophobicContact CG-CD1 4.32Å; L186-L224 HydrophobicContact CB-CD1 3.81Å; L186-L224 HydrophobicContact CD2-CD1 3.82Å; L186-L224 HydrophobicContact CG-CD1 4.25Å; L186-M227 HydrophobicContact CD2-CB 4.03Å; L186-M227 HydrophobicContact CD2-CG 3.66Å; L186-M227 HydrophobicContact CD2-SD 3.78Å; L186-L228 HydrophobicContact CD1-CD2 3.67Å; L186-L228 HydrophobicContact CD2-CD2 4.04Å; L186-L228 HydrophobicContact CD2-CG 4.29Å
187	Q	76.3	Confident	85.8	Confident	89 Å²	89	30.6 Å²	30.6	42%	0.416	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	153.1	176.6	-62.4	177.2	2.3	0	0	111	Q81 G184 K185	Q81-Q187 VanDerWaalsContact CD-NE2 3.33Å; G184-Q187 VanDerWaalsContact O-CB 3.29Å; G184-Q187 WeakPolarHBondContact O-CB 3.32Å; G184-Q187 WeakPolarHBondContact O-CG 3.36Å; G184-Q187 PolarHBondContact O-N 3.02Å; K185-Q187 VanDerWaalsContact C-N 3.33Å
188	G	75.5	Confident	85.7	Confident	82 Å²	82	30.6 Å²	30.6	85%	0.845	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.1	-9.8	-179.8	0	0	0	0	0	114.8	G190	G188-G190 PolarHBondContact O-N 3.23Å
189	Y	78.2	Confident	85.5	Confident	61 Å²	61	30.6 Å²	30.6	24%	0.239	18%	0.178	C	C	.	.	S	Bend	trans	-83.8	21.4	176.3	-65.7	-75.9	0	0	0	114.3	L186 E191 P220 G223 L224 M227	L186-Y189 WeakPolarHBondContact O-CD2 3.46Å; Y189-E191 PolarHBondContact O-N 2.78Å; Y189-P220 WeakPolarHBondContact CB-O 3.19Å; Y189-P220 WeakPolarHBondContact CD1-O 3.43Å; Y189-P220 CarbonylContact O-C 3.48Å; Y189-P220 WeakPolarHBondContact O-CB 3.26Å; Y189-G223 WeakPolarHBondContact CE1-O 3.41Å; Y189-L224 HydrophobicContact CD1-CB 4.36Å; Y189-L224 HydrophobicContact CD2-CB 4.17Å; Y189-L224 HydrophobicContact CD2-CD1 3.96Å; Y189-L224 HydrophobicContact CG-CB 3.83Å; Y189-L224 HydrophobicContact CG-CD1 4.46Å; Y189-M227 HydrophobicContact CE2-CB 4.29Å; Y189-M227 HydrophobicContact CE2-SD 3.59Å; Y189-M227 VanDerWaalsContact CE2-SD 3.59Å; Y189-M227 PolarHBondContact OH-SD 2.96Å
190	G	65.3	Low	85.2	Confident	24 Å²	24	29.1 Å²	29.1	25%	0.247	17%	0.171	C	C	.	.	S	Bend	trans	64.3	-7	175.3	0	0	0	0	0	116.4	G188 N214	G188-G190 PolarHBondContact O-N 3.23Å; G190-N214 WeakPolarHBondContact O-CB 3.16Å; G190-N214 PolarHBondContact O-N 3.45Å
191	E	74.7	Confident	84.8	Confident	14 Å²	14	30.4 Å²	30.4	7%	0.065	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.2	170.9	-58.8	-161.5	158.4	0	0	110.1	Y189 T211 K212 R221 L224	Y189-E191 PolarHBondContact O-N 2.78Å; E191-T211 VanDerWaalsContact OE2-CB 3.24Å; E191-T211 WeakPolarHBondContact OE2-CB 2.87Å; E191-T211 WeakPolarHBondContact OE2-CG2 3.46Å; E191-T211 PolarHBondContact OE2-OG1 3.45Å; E191-K212 CarbonylContact C-O 3.48Å; E191-K212 WeakPolarHBondContact CA-O 3.39Å; E191-R221 HydrophobicContact CG-CB 4.49Å; E191-R221 WeakPolarHBondContact OE1-CB 3.27Å; E191-R221 WeakPolarHBondContact OE1-CD 3.47Å; E191-R221 WeakPolarHBondContact OE1-CG 3.29Å; E191-L224 HydrophobicContact CB-CD2 4.03Å; E191-L224 HydrophobicContact CG-CD2 4.46Å; E191-L224 WeakPolarHBondContact OE2-CD2 3.47Å
192	T	81.5	Confident	84.4	Confident	43 Å²	43	37.8 Å²	37.8	26%	0.264	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	121.1	171.4	-54.7	0	0	0	0	108.5	L194 T211 K212 N214	T192-L194 PolarHBondContact O-N 2.64Å; T192-T211 CarbonylContact O-C 3.53Å; T192-T211 VanDerWaalsContact O-CA 3.3Å; T192-T211 WeakPolarHBondContact O-CA 3.49Å; T192-K212 PolarHBondContact N-O 3.44Å; T192-K212 PolarHBondContact O-N 3.23Å; T192-N214 VanDerWaalsContact OG1-CG 3.27Å; T192-N214 PolarHBondContact OG1-ND2 3.42Å; T192-N214 PolarHBondContact OG1-OD1 3.22Å
193	L	87.9	Confident	83.9	Confident	18 Å²	18	44.1 Å²	44.1	9%	0.094	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	128.1	170.4	-64.5	178.4	0	0	0	110.1	I181 L186 V209 T211 L224	I181-L193 HydrophobicContact CB-CD1 4.43Å; I181-L193 HydrophobicContact CG1-CD1 4.07Å; I181-L193 HydrophobicContact CG2-CD1 4.24Å; L186-L193 HydrophobicContact CB-CD1 3.55Å; L186-L193 HydrophobicContact CD1-CD1 3.79Å; L186-L193 HydrophobicContact CG-CD1 4.32Å; L193-V209 HydrophobicContact CD2-CG1 3.86Å; L193-T211 HydrophobicContact CD2-CG2 3.92Å; L193-L224 HydrophobicContact CD2-CD1 4.45Å; L193-L224 HydrophobicContact CD2-CD2 4.1Å
194	L	87.1	Confident	83.9	Confident	26 Å²	26	39.7 Å²	39.7	14%	0.136	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-38.8	178.8	-58.6	178.4	0	0	0	111.3	E155 T192 W210 K212	E155-L194 HydrophobicContact CG-CD1 3.83Å; T192-L194 PolarHBondContact O-N 2.64Å; L194-W210 HydrophobicContact CB-CB 4.07Å; L194-W210 HydrophobicContact CD1-CB 4.41Å; L194-W210 PolarHBondContact N-O 2.94Å; L194-K212 HydrophobicContact CD1-CB 4.12Å; L194-K212 HydrophobicContact CD2-CB 3.98Å; L194-K212 HydrophobicContact CG-CB 4.21Å
195	G	90.4	Very high	84	Confident	1 Å²	1	39 Å²	39	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169	-174	-179.7	0	0	0	0	0	111.8	L138 W210	L138-G195 CarbonylContact O-C 3.45Å; L138-G195 WeakPolarHBondContact O-CA 3.3Å; G195-W210 PolarHBondContact O-N 2.74Å
196	A	92.5	Very high	84.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.6	175.8	0	0	0	0	0	111.2	Y137 L138 W174 T177 I181 T208 V209 W210	Y137-A196 CarbonylContact C-O 3.53Å; Y137-A196 WeakPolarHBondContact CA-O 3.43Å; L138-A196 PolarHBondContact N-O 2.87Å; L138-A196 PolarHBondContact O-N 2.48Å; W174-A196 HydrophobicContact CH2-CB 3.98Å; W174-A196 HydrophobicContact CZ3-CB 3.78Å; T177-A196 HydrophobicContact CG2-CB 4.17Å; I181-A196 HydrophobicContact CD1-CB 3.56Å; A196-T208 CarbonylContact C-O 3.56Å; A196-T208 WeakPolarHBondContact CA-O 3.09Å; A196-T208 WeakPolarHBondContact CB-O 3.27Å; A196-V209 HydrophobicContact CB-CG2 4.11Å; A196-W210 WeakPolarHBondContact O-CZ3 3.36Å
197	G	91.5	Very high	84.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.5	179	0	0	0	0	0	110.9	C136 I207 T208	C136-G197 CarbonylContact O-C 3.55Å; C136-G197 VanDerWaalsContact O-CA 3.24Å; C136-G197 WeakPolarHBondContact O-CA 3.07Å; G197-I207 CarbonylContact O-C 3.46Å; G197-I207 WeakPolarHBondContact O-CA 3.38Å; G197-T208 PolarHBondContact N-O 3.19Å; G197-T208 PolarHBondContact O-N 3.24Å
198	L	91.6	Very high	85.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.2	171.8	170.6	68	0	0	0	108.2	V127 E135 C136 V170 W174 I200 D205 M206 I207	V127-L198 HydrophobicContact CB-CD2 3.39Å; V127-L198 HydrophobicContact CG1-CD2 3.62Å; V127-L198 HydrophobicContact CG2-CD2 3.45Å; V127-L198 VanDerWaalsContact CG2-CD2 3.45Å; E135-L198 CarbonylContact C-O 3.48Å; E135-L198 WeakPolarHBondContact CA-O 3.38Å; E135-L198 WeakPolarHBondContact CB-O 3.21Å; C136-L198 HydrophobicContact CB-CB 4.39Å; C136-L198 PolarHBondContact N-O 3.31Å; C136-L198 PolarHBondContact O-N 3.43Å; V170-L198 HydrophobicContact CG2-CD1 3.55Å; W174-L198 HydrophobicContact CB-CD2 4.08Å; W174-L198 HydrophobicContact CD2-CB 3.89Å; W174-L198 HydrophobicContact CD2-CD2 4.28Å; W174-L198 HydrophobicContact CE3-CB 3.89Å; W174-L198 HydrophobicContact CG-CB 4.36Å; W174-L198 HydrophobicContact CG-CD2 3.88Å; W174-L198 HydrophobicContact CZ3-CB 4.24Å; L198-I200 HydrophobicContact CD1-CD1 4.21Å; L198-I200 HydrophobicContact CD2-CD1 4Å; L198-I200 HydrophobicContact CG-CD1 4.07Å; L198-D205 HydrophobicContact CD1-CB 4.42Å; L198-M206 CarbonylContact C-O 3.44Å; L198-M206 WeakPolarHBondContact CA-O 3.47Å; L198-I207 HydrophobicContact CD1-CD1 4.39Å; L198-I207 HydrophobicContact CD1-CG1 3.62Å
199	A	89.3	Confident	86.3	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.4	171.3	0	0	0	0	0	109.6	I44 R201 D205 M206	I44-A199 HydrophobicContact CD1-CB 3.54Å; I44-A199 HydrophobicContact CG1-CB 3.8Å; A199-R201 HydrophobicContact CB-CG 4.35Å; A199-R201 VanDerWaalsContact CB-CZ 3.5Å; A199-D205 CarbonylContact O-C 3.6Å; A199-D205 VanDerWaalsContact O-CA 3.28Å; A199-D205 WeakPolarHBondContact O-CA 3.33Å; A199-M206 HydrophobicContact CB-CB 4.33Å; A199-M206 HydrophobicContact CB-CE 4.46Å; A199-M206 PolarHBondContact N-O 2.7Å; A199-M206 PolarHBondContact O-N 2.67Å
200	I	87.9	Confident	86.8	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.12	C	C	.	.			trans	-89.2	124.7	169.8	-55.2	-55.9	0	0	0	108.6	W132 R133 S134 V170 L198 D205	W132-I200 HydrophobicContact CE3-CG2 3.71Å; W132-I200 HydrophobicContact CZ3-CG2 3.85Å; R133-I200 VanDerWaalsContact CA-O 3.29Å; R133-I200 WeakPolarHBondContact CA-O 3.4Å; R133-I200 PolarHBondContact N-O 3.13Å; R133-I200 VanDerWaalsContact N-O 3.13Å; S134-I200 PolarHBondContact O-N 2.85Å; V170-I200 HydrophobicContact CG1-CD1 4.27Å; L198-I200 HydrophobicContact CD1-CD1 4.21Å; L198-I200 HydrophobicContact CD2-CD1 4Å; L198-I200 HydrophobicContact CG-CD1 4.07Å; I200-D205 WeakPolarHBondContact CA-OD1 3.49Å; I200-D205 HydrophobicContact CD1-CB 4.43Å
201	R	85.4	Confident	87.9	Confident	35 Å²	35	21.3 Å²	21.3	13%	0.132	11%	0.108	C	C	.	.			trans	-142.9	152.5	-174.4	-60.6	-66.6	-173.4	-92.4	0.1	111.9	W132 E135 A199 N203 G204 D205 M206	W132-R201 VanDerWaalsContact CZ3-O 3.27Å; W132-R201 WeakPolarHBondContact CZ3-O 3.49Å; E135-R201 IonicContact OE1-CZ 3.55Å; E135-R201 IonicContact OE1-NH1 2.62Å; E135-R201 PolarHBondContact OE1-NH1 2.95Å; E135-R201 IonicContact OE1-NH2 3.35Å; E135-R201 PolarHBondContact OE1-NH2 3.3Å; A199-R201 HydrophobicContact CB-CG 4.35Å; A199-R201 VanDerWaalsContact CB-CZ 3.5Å; R201-N203 VanDerWaalsContact C-N 3.34Å; R201-N203 PolarHBondContact O-N 3.13Å; R201-G204 WeakPolarHBondContact CB-O 3.28Å; R201-G204 PolarHBondContact O-N 2.99Å; R201-G204 VanDerWaalsContact O-N 3.15Å; R201-D205 PolarHBondContact N-OD1 2.84Å; R201-M206 HydrophobicContact CG-CE 3.84Å
202	E	82.6	Confident	88.3	Confident	158 Å²	158	23.4 Å²	23.4	74%	0.738	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-42.9	175.8	-174.1	171.8	-161.5	0	0	112.3	G204	E202-G204 PolarHBondContact O-N 2.78Å
203	N	83.7	Confident	88.2	Confident	139 Å²	139	23.5 Å²	23.5	74%	0.743	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	10.7	179.4	-66.4	-21.6	0	0	0	113.9	R201	R201-N203 VanDerWaalsContact C-N 3.34Å; R201-N203 PolarHBondContact O-N 3.13Å
204	G	88	Confident	87.2	Confident	5 Å²	5	27.6 Å²	27.6	5%	0.052	14%	0.135	C	C	.	.			trans	115.5	142.2	175.2	0	0	0	0	0	113.6	F162 R201 E202	F162-G204 CarbonylContact O-C 3.55Å; F162-G204 WeakPolarHBondContact O-CA 3.4Å; R201-G204 WeakPolarHBondContact CB-O 3.28Å; R201-G204 PolarHBondContact O-N 2.99Å; R201-G204 VanDerWaalsContact O-N 3.15Å; E202-G204 PolarHBondContact O-N 2.78Å
205	D	89.7	Confident	86.1	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.145	C	C	.	.			trans	-69.8	156	-175.4	-52.5	-40.8	0	0	0	112	F162 H167 V170 L198 A199 I200 R201	F162-D205 HydrophobicContact CB-CB 4.42Å; F162-D205 HydrophobicContact CD2-CB 4.42Å; F162-D205 WeakPolarHBondContact CD2-O 3.32Å; F162-D205 PolarHBondContact N-O 3.42Å; F162-D205 PolarHBondContact O-N 3.41Å; H167-D205 IonicContact CE1-OD1 3.46Å; H167-D205 IonicContact CE1-OD2 3.41Å; H167-D205 IonicContact CG-OD2 2.68Å; H167-D205 IonicContact ND1-OD1 3.44Å; H167-D205 PolarHBondContact ND1-OD1 3.09Å; H167-D205 IonicContact ND1-OD2 2.72Å; H167-D205 PolarHBondContact ND1-OD2 3.45Å; V170-D205 HydrophobicContact CB-CB 4.48Å; V170-D205 HydrophobicContact CG2-CB 3.71Å; L198-D205 HydrophobicContact CD1-CB 4.42Å; A199-D205 CarbonylContact O-C 3.6Å; A199-D205 VanDerWaalsContact O-CA 3.28Å; A199-D205 WeakPolarHBondContact O-CA 3.33Å; I200-D205 WeakPolarHBondContact CA-OD1 3.49Å; I200-D205 HydrophobicContact CD1-CB 4.43Å; R201-D205 PolarHBondContact N-OD1 2.84Å
206	M	90.7	Very high	85	Confident	6 Å²	6	32 Å²	32	3%	0.03	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.8	-178.3	-60	-172.8	-85.5	0	0	111.2	L40 I159 A160 R161 L198 A199 R201	L40-M206 WeakPolarHBondContact O-CE 3.38Å; I159-M206 HydrophobicContact CD1-CB 4.28Å; I159-M206 HydrophobicContact CD1-CG 4.49Å; I159-M206 HydrophobicContact CD1-SD 3.86Å; I159-M206 HydrophobicContact CG1-CB 4.49Å; A160-M206 VanDerWaalsContact O-CA 3.31Å; A160-M206 WeakPolarHBondContact O-CA 3.13Å; R161-M206 HydrophobicContact CB-CG 4.4Å; R161-M206 HydrophobicContact CG-CG 3.88Å; R161-M206 HydrophobicContact CG-SD 4Å; R161-M206 PolarHBondContact NE-SD 3.25Å; R161-M206 VanDerWaalsContact NE-SD 3.38Å; L198-M206 CarbonylContact C-O 3.44Å; L198-M206 WeakPolarHBondContact CA-O 3.47Å; A199-M206 HydrophobicContact CB-CB 4.33Å; A199-M206 HydrophobicContact CB-CE 4.46Å; A199-M206 PolarHBondContact N-O 2.7Å; A199-M206 PolarHBondContact O-N 2.67Å; R201-M206 HydrophobicContact CG-CE 3.84Å
207	I	92.5	Very high	84	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.3	167.7	-64.3	169.8	0	0	0	108.5	I159 A160 F162 W174 T177 G197 L198 L232	I159-I207 WeakPolarHBondContact CA-O 3.43Å; A160-I207 PolarHBondContact N-O 3.15Å; A160-I207 PolarHBondContact O-N 2.58Å; F162-I207 HydrophobicContact CE2-CB 4Å; F162-I207 HydrophobicContact CE2-CD1 3.65Å; F162-I207 HydrophobicContact CE2-CG1 3.71Å; F162-I207 HydrophobicContact CZ-CD1 3.94Å; F162-I207 HydrophobicContact CZ-CG1 4.44Å; W174-I207 HydrophobicContact CB-CD1 4.27Å; W174-I207 HydrophobicContact CE3-CD1 4.43Å; W174-I207 HydrophobicContact CE3-CG1 4.33Å; W174-I207 HydrophobicContact CE3-CG2 4.2Å; W174-I207 HydrophobicContact CZ3-CG2 4.29Å; T177-I207 HydrophobicContact CG2-CG2 4.14Å; G197-I207 CarbonylContact O-C 3.46Å; G197-I207 WeakPolarHBondContact O-CA 3.38Å; L198-I207 HydrophobicContact CD1-CD1 4.39Å; L198-I207 HydrophobicContact CD1-CG1 3.62Å; I207-L232 HydrophobicContact CB-CD2 3.78Å; I207-L232 HydrophobicContact CD1-CD2 3.75Å; I207-L232 HydrophobicContact CG1-CD2 4.37Å; I207-L232 HydrophobicContact CG2-CD2 3.5Å; I207-L232 VanDerWaalsContact CG2-CD2 3.5Å
208	T	91.2	Very high	83.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.6	178.7	-56.8	0	0	0	0	109.6	H157 W158 A196 G197 W210	H157-T208 HydrophobicContact CB-CG2 3.69Å; W158-T208 CarbonylContact O-C 3.59Å; W158-T208 VanDerWaalsContact O-CA 3.25Å; W158-T208 WeakPolarHBondContact O-CA 3.46Å; A196-T208 CarbonylContact C-O 3.56Å; A196-T208 WeakPolarHBondContact CA-O 3.09Å; A196-T208 WeakPolarHBondContact CB-O 3.27Å; G197-T208 PolarHBondContact N-O 3.19Å; G197-T208 PolarHBondContact O-N 3.24Å; T208-W210 HydrophobicContact CG2-CD2 4.15Å; T208-W210 HydrophobicContact CG2-CH2 4.43Å; T208-W210 HydrophobicContact CG2-CZ2 3.74Å
209	V	91.1	Very high	83	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.4	174	-179.2	0	0	0	0	108.3	H157 W158 T177 I181 L193 A196 T211 L228	H157-V209 CarbonylContact C-O 3.33Å; H157-V209 WeakPolarHBondContact CA-O 3.19Å; H157-V209 WeakPolarHBondContact CB-O 3.48Å; W158-V209 PolarHBondContact N-O 3.22Å; W158-V209 PolarHBondContact O-N 3.14Å; T177-V209 HydrophobicContact CG2-CG2 4.01Å; I181-V209 HydrophobicContact CD1-CG1 4.5Å; L193-V209 HydrophobicContact CD2-CG1 3.86Å; A196-V209 HydrophobicContact CB-CG2 4.11Å; V209-T211 HydrophobicContact CG1-CG2 4.41Å; V209-L228 HydrophobicContact CB-CD1 4.15Å; V209-L228 HydrophobicContact CB-CD2 4.48Å; V209-L228 HydrophobicContact CG1-CD1 4.19Å; V209-L228 HydrophobicContact CG1-CD2 4.38Å; V209-L228 HydrophobicContact CG2-CD1 4.42Å; V209-L228 HydrophobicContact CG2-CD2 3.99Å
210	W	88.3	Confident	82.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.6	-179.3	-62.5	-83	0	0	0	111.2	I44 W46 M49 Y137 F139 H157 L194 G195 A196 T208	I44-W210 HydrophobicContact CB-CZ2 4.12Å; I44-W210 HydrophobicContact CG2-CH2 4.34Å; I44-W210 HydrophobicContact CG2-CZ2 3.89Å; I44-W210 WeakPolarHBondContact O-CZ2 3.18Å; W46-W210 HydrophobicContact CE3-CB 4.19Å; W46-W210 AromaticContact CE3-CD1 3.71Å; W46-W210 AromaticContact CE3-CD2 3.73Å; W46-W210 HydrophobicContact CE3-CD2 3.73Å; W46-W210 AromaticContact CE3-CE2 3.95Å; W46-W210 HydrophobicContact CE3-CE3 4.28Å; W46-W210 AromaticContact CE3-CG 3.62Å; W46-W210 HydrophobicContact CE3-CG 3.62Å; W46-W210 AromaticContact CE3-NE1 3.92Å; W46-W210 HydrophobicContact CZ3-CB 4.45Å; W46-W210 HydrophobicContact CZ3-CD2 4.05Å; W46-W210 HydrophobicContact CZ3-CE3 4.16Å; W46-W210 HydrophobicContact CZ3-CG 4.15Å; M49-W210 HydrophobicContact SD-CH2 4.29Å; Y137-W210 AromaticContact CD1-CH2 3.81Å; Y137-W210 HydrophobicContact CD1-CH2 3.81Å; Y137-W210 HydrophobicContact CD1-CZ3 4.09Å; Y137-W210 AromaticContact CE1-CH2 3.75Å; Y137-W210 HydrophobicContact CE1-CH2 3.75Å; Y137-W210 HydrophobicContact CE1-CZ3 4.47Å; F139-W210 AromaticContact CE1-CE3 3.85Å; F139-W210 HydrophobicContact CE1-CE3 3.85Å; F139-W210 AromaticContact CE1-CZ3 3.9Å; F139-W210 HydrophobicContact CE1-CZ3 3.9Å; F139-W210 HydrophobicContact CZ-CE3 4.07Å; F139-W210 HydrophobicContact CZ-CH2 4.41Å; F139-W210 AromaticContact CZ-CZ3 3.68Å; F139-W210 HydrophobicContact CZ-CZ3 3.68Å; H157-W210 HydrophobicContact CB-CG 4.19Å; L194-W210 HydrophobicContact CB-CB 4.07Å; L194-W210 HydrophobicContact CD1-CB 4.41Å; L194-W210 PolarHBondContact N-O 2.94Å; G195-W210 PolarHBondContact O-N 2.74Å; A196-W210 WeakPolarHBondContact O-CZ3 3.36Å; T208-W210 HydrophobicContact CG2-CD2 4.15Å; T208-W210 HydrophobicContact CG2-CH2 4.43Å; T208-W210 HydrophobicContact CG2-CZ2 3.74Å
211	T	88	Confident	82.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.1	-176.9	75.6	0	0	0	0	110.8	E155 G156 E191 T192 L193 V209 L224	E155-T211 WeakPolarHBondContact CA-O 3.33Å; G156-T211 PolarHBondContact N-O 3.15Å; G156-T211 PolarHBondContact O-N 3.05Å; E191-T211 VanDerWaalsContact OE2-CB 3.24Å; E191-T211 WeakPolarHBondContact OE2-CB 2.87Å; E191-T211 WeakPolarHBondContact OE2-CG2 3.46Å; E191-T211 PolarHBondContact OE2-OG1 3.45Å; T192-T211 CarbonylContact O-C 3.53Å; T192-T211 VanDerWaalsContact O-CA 3.3Å; T192-T211 WeakPolarHBondContact O-CA 3.49Å; L193-T211 HydrophobicContact CD2-CG2 3.92Å; V209-T211 HydrophobicContact CG1-CG2 4.41Å; T211-L224 HydrophobicContact CG2-CD2 3.88Å
212	K	84.8	Confident	82.6	Confident	58 Å²	58	57 Å²	57	25%	0.252	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130	168.1	-178.4	174.2	-176.1	170.9	0	108.9	D154 E155 E191 T192 L194 N214	D154-K212 WeakPolarHBondContact OD2-CE 3.34Å; D154-K212 IonicContact OD2-NZ 3.77Å; E155-K212 HydrophobicContact CG-CB 4.19Å; E155-K212 HydrophobicContact CG-CG 4.31Å; E191-K212 CarbonylContact C-O 3.48Å; E191-K212 WeakPolarHBondContact CA-O 3.39Å; T192-K212 PolarHBondContact N-O 3.44Å; T192-K212 PolarHBondContact O-N 3.23Å; L194-K212 HydrophobicContact CD1-CB 4.12Å; L194-K212 HydrophobicContact CD2-CB 3.98Å; L194-K212 HydrophobicContact CG-CB 4.21Å; K212-N214 PolarHBondContact O-N 2.98Å
213	R	78.6	Confident	82.8	Confident	46 Å²	46	50.3 Å²	50.3	17%	0.174	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.4	-177.2	-164.7	-175.7	-57.1	132.3	4.2	109.8	D154 G216 Y240 S242	D154-R213 VanDerWaalsContact O-CB 3.32Å; D154-R213 WeakPolarHBondContact O-CB 3.35Å; D154-R213 PolarHBondContact O-N 3.49Å; R213-G216 VanDerWaalsContact CD-CA 3.46Å; R213-Y240 PolarHBondContact NH2-OH 3.34Å; R213-Y240 VanDerWaalsContact NH2-OH 3.07Å; R213-S242 PolarHBondContact NH2-OG 3.05Å
214	N	65.8	Low	83	Confident	103 Å²	103	43.7 Å²	43.7	55%	0.551	23%	0.227	S	C	*	.	S	Bend	trans	-83.3	-14.8	179.7	-65.8	-11.5	0	0	0	113.7	G190 T192 K212	G190-N214 WeakPolarHBondContact O-CB 3.16Å; G190-N214 PolarHBondContact O-N 3.45Å; T192-N214 VanDerWaalsContact OG1-CG 3.27Å; T192-N214 PolarHBondContact OG1-ND2 3.42Å; T192-N214 PolarHBondContact OG1-OD1 3.22Å; K212-N214 PolarHBondContact O-N 2.98Å
215	N	64.7	Low	83.1	Confident	67 Å²	67	43.5 Å²	43.5	36%	0.358	23%	0.225	S	C	.	.	S	Bend	trans	-146.7	8.1	-166.4	63.2	12.3	0	0	0	116.9	L217	N215-L217 HydrophobicContact CB-CD1 4.36Å; N215-L217 HydrophobicContact CB-CG 4.1Å; N215-L217 WeakPolarHBondContact O-CG 3.43Å; N215-L217 PolarHBondContact O-N 3.28Å; N215-L217 WeakPolarHBondContact OD1-CB 3.06Å; N215-L217 PolarHBondContact OD1-N 2.92Å; N215-L217 VanDerWaalsContact OD1-N 3.13Å
216	G	66.4	Low	83	Confident	54 Å²	54	48.7 Å²	48.7	56%	0.557	25%	0.253	S	S	*	.			trans	64.1	-1.3	-179.3	0	0	0	0	0	115.1	R213 E218	R213-G216 VanDerWaalsContact CD-CA 3.46Å; G216-E218 PolarHBondContact O-N 3.44Å
217	L	73.1	Confident	83	Confident	99 Å²	99	50.7 Å²	50.7	52%	0.518	26%	0.262	S	S	.	.			trans	-82.1	123.3	-169.4	-62	-178.1	0	0	0	110.6	N215 P220	N215-L217 HydrophobicContact CB-CD1 4.36Å; N215-L217 HydrophobicContact CB-CG 4.1Å; N215-L217 WeakPolarHBondContact O-CG 3.43Å; N215-L217 PolarHBondContact O-N 3.28Å; N215-L217 WeakPolarHBondContact OD1-CB 3.06Å; N215-L217 PolarHBondContact OD1-N 2.92Å; N215-L217 VanDerWaalsContact OD1-N 3.13Å; L217-P220 HydrophobicContact CB-CG 3.87Å; L217-P220 HydrophobicContact CD1-CG 4.33Å; L217-P220 WeakPolarHBondContact O-CD 3Å
218	E	79.5	Confident	82.9	Confident	89 Å²	89	50.7 Å²	50.7	42%	0.416	26%	0.262	S	S	.	.	H	α-helix	trans	-68.2	-36.2	179.7	-85.9	-65.9	140.3	0	0	113.8	G216 R221 K222	G216-E218 PolarHBondContact O-N 3.44Å; E218-R221 IonicContact OE1-CZ 2.76Å; E218-R221 IonicContact OE1-NE 3.65Å; E218-R221 PolarHBondContact OE1-NE 3.21Å; E218-R221 VanDerWaalsContact OE1-NE 3.13Å; E218-R221 IonicContact OE1-NH2 3.86Å; E218-R221 PolarHBondContact OE1-NH2 2.87Å; E218-R221 IonicContact OE2-CZ 2.75Å; E218-R221 IonicContact OE2-NE 3.78Å; E218-R221 IonicContact OE2-NH2 2.76Å; E218-R221 PolarHBondContact OE2-NH2 3.49Å; E218-K222 WeakPolarHBondContact O-CG 3.46Å; E218-K222 PolarHBondContact O-N 2.71Å
219	K	82.8	Confident	82.8	Confident	184 Å²	184	55.2 Å²	55.2	80%	0.8	28%	0.279	S	S	*	.	H	α-helix	trans	-65.6	-49.6	-176.3	-62.4	-179.8	179.1	179	0	112.7	R221 K222 G223	K219-R221 VanDerWaalsContact C-N 3.35Å; K219-R221 PolarHBondContact O-N 3.38Å; K219-K222 PolarHBondContact O-N 3.26Å; K219-G223 PolarHBondContact O-N 3.42Å
220	P	82.2	Confident	82.7	Confident	30 Å²	30	61.8 Å²	61.8	20%	0.195	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-42.9	177.7	-24	37	0	0	0	112.1	Y189 L217 K222 G223 L224	Y189-P220 WeakPolarHBondContact CB-O 3.19Å; Y189-P220 WeakPolarHBondContact CD1-O 3.43Å; Y189-P220 CarbonylContact O-C 3.48Å; Y189-P220 WeakPolarHBondContact O-CB 3.26Å; L217-P220 HydrophobicContact CB-CG 3.87Å; L217-P220 HydrophobicContact CD1-CG 4.33Å; L217-P220 WeakPolarHBondContact O-CD 3Å; P220-K222 PolarHBondContact O-N 2.65Å; P220-G223 PolarHBondContact O-N 2.82Å; P220-G223 VanDerWaalsContact O-N 3.16Å; P220-L224 PolarHBondContact O-N 2.8Å
221	R	84.8	Confident	82.7	Confident	35 Å²	35	63 Å²	63	13%	0.132	32%	0.319	C	S	.	.	H	α-helix	trans	-54.3	-49.7	173	178.9	171.7	79.4	74.6	-2.2	112.6	W158 E191 E218 K219 G223 L224 G225	W158-R221 HydrophobicContact CZ2-CG 3.71Å; W158-R221 VanDerWaalsContact CZ2-O 3.25Å; W158-R221 WeakPolarHBondContact CZ2-O 3.46Å; E191-R221 HydrophobicContact CG-CB 4.49Å; E191-R221 WeakPolarHBondContact OE1-CB 3.27Å; E191-R221 WeakPolarHBondContact OE1-CD 3.47Å; E191-R221 WeakPolarHBondContact OE1-CG 3.29Å; E218-R221 IonicContact OE1-CZ 2.76Å; E218-R221 IonicContact OE1-NE 3.65Å; E218-R221 PolarHBondContact OE1-NE 3.21Å; E218-R221 VanDerWaalsContact OE1-NE 3.13Å; E218-R221 IonicContact OE1-NH2 3.86Å; E218-R221 PolarHBondContact OE1-NH2 2.87Å; E218-R221 IonicContact OE2-CZ 2.75Å; E218-R221 IonicContact OE2-NE 3.78Å; E218-R221 IonicContact OE2-NH2 2.76Å; E218-R221 PolarHBondContact OE2-NH2 3.49Å; K219-R221 VanDerWaalsContact C-N 3.35Å; K219-R221 PolarHBondContact O-N 3.38Å; R221-G223 VanDerWaalsContact C-N 3.33Å; R221-G223 PolarHBondContact O-N 3Å; R221-L224 WeakPolarHBondContact O-CB 3.22Å; R221-L224 PolarHBondContact O-N 3.03Å; R221-G225 PolarHBondContact O-N 2.9Å
222	K	85.8	Confident	82.6	Confident	122 Å²	122	63 Å²	63	53%	0.53	32%	0.319	S	S	.	.	H	α-helix	trans	-60.6	-42.6	177.7	-74.3	-179.4	-178.5	-173.6	0	112.1	E218 K219 P220 L224 G225 D226	E218-K222 WeakPolarHBondContact O-CG 3.46Å; E218-K222 PolarHBondContact O-N 2.71Å; K219-K222 PolarHBondContact O-N 3.26Å; P220-K222 PolarHBondContact O-N 2.65Å; K222-L224 VanDerWaalsContact C-N 3.32Å; K222-L224 PolarHBondContact O-N 3.23Å; K222-G225 CarbonylContact O-C 3.57Å; K222-G225 WeakPolarHBondContact O-CA 3.42Å; K222-G225 PolarHBondContact O-N 3.5Å; K222-G225 VanDerWaalsContact O-N 3.08Å; K222-D226 PolarHBondContact O-N 2.73Å
223	G	87.3	Confident	82.3	Confident	19 Å²	19	61.7 Å²	61.7	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-40.9	175.1	0	0	0	0	0	113	Y189 K219 P220 R221 G225 D226 M227	Y189-G223 WeakPolarHBondContact CE1-O 3.41Å; K219-G223 PolarHBondContact O-N 3.42Å; P220-G223 PolarHBondContact O-N 2.82Å; P220-G223 VanDerWaalsContact O-N 3.16Å; R221-G223 VanDerWaalsContact C-N 3.33Å; R221-G223 PolarHBondContact O-N 3Å; G223-G225 VanDerWaalsContact C-N 3.33Å; G223-D226 PolarHBondContact O-N 3.23Å; G223-M227 PolarHBondContact O-N 3.2Å; G223-M227 VanDerWaalsContact O-N 3.08Å
224	L	87.7	Confident	82.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-44.4	173.2	-179.6	60.8	0	0	0	110.8	L186 Y189 E191 L193 T211 P220 R221 K222 D226 M227 L228	L186-L224 HydrophobicContact CB-CD1 3.81Å; L186-L224 HydrophobicContact CD2-CD1 3.82Å; L186-L224 HydrophobicContact CG-CD1 4.25Å; Y189-L224 HydrophobicContact CD1-CB 4.36Å; Y189-L224 HydrophobicContact CD2-CB 4.17Å; Y189-L224 HydrophobicContact CD2-CD1 3.96Å; Y189-L224 HydrophobicContact CG-CB 3.83Å; Y189-L224 HydrophobicContact CG-CD1 4.46Å; E191-L224 HydrophobicContact CB-CD2 4.03Å; E191-L224 HydrophobicContact CG-CD2 4.46Å; E191-L224 WeakPolarHBondContact OE2-CD2 3.47Å; L193-L224 HydrophobicContact CD2-CD1 4.45Å; L193-L224 HydrophobicContact CD2-CD2 4.1Å; T211-L224 HydrophobicContact CG2-CD2 3.88Å; P220-L224 PolarHBondContact O-N 2.8Å; R221-L224 WeakPolarHBondContact O-CB 3.22Å; R221-L224 PolarHBondContact O-N 3.03Å; K222-L224 VanDerWaalsContact C-N 3.32Å; K222-L224 PolarHBondContact O-N 3.23Å; L224-D226 VanDerWaalsContact C-N 3.34Å; L224-D226 PolarHBondContact O-N 3.27Å; L224-M227 PolarHBondContact O-N 3.34Å; L224-L228 HydrophobicContact CD1-CD1 4.25Å; L224-L228 HydrophobicContact CD1-CG 4.17Å; L224-L228 HydrophobicContact CD2-CD1 4.49Å; L224-L228 HydrophobicContact CG-CD1 3.93Å; L224-L228 HydrophobicContact CG-CG 4.29Å; L224-L228 WeakPolarHBondContact O-CB 3.44Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 3.49Å
225	G	89.3	Confident	82.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-56.9	-44.2	175.5	0	0	0	0	0	112.9	R221 K222 G223 L228 R229 F238	R221-G225 PolarHBondContact O-N 2.9Å; K222-G225 CarbonylContact O-C 3.57Å; K222-G225 WeakPolarHBondContact O-CA 3.42Å; K222-G225 PolarHBondContact O-N 3.5Å; K222-G225 VanDerWaalsContact O-N 3.08Å; G223-G225 VanDerWaalsContact C-N 3.33Å; G225-L228 PolarHBondContact O-N 3.28Å; G225-R229 VanDerWaalsContact O-CB 3.28Å; G225-R229 WeakPolarHBondContact O-CB 3.39Å; G225-R229 PolarHBondContact O-N 3.16Å; G225-F238 WeakPolarHBondContact O-CE1 2.77Å; G225-F238 WeakPolarHBondContact O-CZ 2.77Å
226	D	88.9	Confident	82.6	Confident	110 Å²	110	70.5 Å²	70.5	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-65	-41.2	178.4	-67.4	-27.8	0	0	0	111.6	K222 G223 L224 R229 M230	K222-D226 PolarHBondContact O-N 2.73Å; G223-D226 PolarHBondContact O-N 3.23Å; L224-D226 VanDerWaalsContact C-N 3.34Å; L224-D226 PolarHBondContact O-N 3.27Å; D226-R229 PolarHBondContact O-N 2.83Å; D226-M230 PolarHBondContact O-N 3.06Å; D226-M230 VanDerWaalsContact O-N 3.11Å
227	M	89.4	Confident	83.2	Confident	47 Å²	47	69.7 Å²	69.7	23%	0.232	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-43.8	176.6	-166.1	166.6	-128.6	0	0	112.1	L186 Y189 G223 L224 R229 M230 V231	L186-M227 HydrophobicContact CD2-CB 4.03Å; L186-M227 HydrophobicContact CD2-CG 3.66Å; L186-M227 HydrophobicContact CD2-SD 3.78Å; Y189-M227 HydrophobicContact CE2-CB 4.29Å; Y189-M227 HydrophobicContact CE2-SD 3.59Å; Y189-M227 VanDerWaalsContact CE2-SD 3.59Å; Y189-M227 PolarHBondContact OH-SD 2.96Å; G223-M227 PolarHBondContact O-N 3.2Å; G223-M227 VanDerWaalsContact O-N 3.08Å; L224-M227 PolarHBondContact O-N 3.34Å; M227-R229 VanDerWaalsContact C-N 3.35Å; M227-R229 PolarHBondContact O-N 2.98Å; M227-M230 HydrophobicContact CG-CE 4.39Å; M227-M230 WeakPolarHBondContact O-CB 3.33Å; M227-M230 PolarHBondContact O-N 3.08Å; M227-V231 WeakPolarHBondContact O-CG2 3.4Å; M227-V231 PolarHBondContact O-N 3.01Å
228	L	90.5	Very high	83.9	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-42.6	174.5	-76.6	176.4	0	0	0	111.4	W158 L186 V209 L224 G225 M230 V231 L232 F238	W158-L228 HydrophobicContact CB-CD1 3.86Å; W158-L228 HydrophobicContact CD2-CD1 4.44Å; W158-L228 HydrophobicContact CG-CD1 3.68Å; L186-L228 HydrophobicContact CD1-CD2 3.67Å; L186-L228 HydrophobicContact CD2-CD2 4.04Å; L186-L228 HydrophobicContact CD2-CG 4.29Å; V209-L228 HydrophobicContact CB-CD1 4.15Å; V209-L228 HydrophobicContact CB-CD2 4.48Å; V209-L228 HydrophobicContact CG1-CD1 4.19Å; V209-L228 HydrophobicContact CG1-CD2 4.38Å; V209-L228 HydrophobicContact CG2-CD1 4.42Å; V209-L228 HydrophobicContact CG2-CD2 3.99Å; L224-L228 HydrophobicContact CD1-CD1 4.25Å; L224-L228 HydrophobicContact CD1-CG 4.17Å; L224-L228 HydrophobicContact CD2-CD1 4.49Å; L224-L228 HydrophobicContact CG-CD1 3.93Å; L224-L228 HydrophobicContact CG-CG 4.29Å; L224-L228 WeakPolarHBondContact O-CB 3.44Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 3.49Å; G225-L228 PolarHBondContact O-N 3.28Å; L228-M230 VanDerWaalsContact C-N 3.26Å; L228-M230 PolarHBondContact O-N 2.61Å; L228-V231 PolarHBondContact O-N 3.35Å; L228-L232 HydrophobicContact CB-CD1 4.17Å; L228-L232 WeakPolarHBondContact O-CB 3.33Å; L228-L232 WeakPolarHBondContact O-CD1 3.37Å; L228-L232 WeakPolarHBondContact O-CG 2.96Å; L228-L232 PolarHBondContact O-N 3.2Å; L228-F238 HydrophobicContact CB-CE2 4.09Å; L228-F238 HydrophobicContact CB-CZ 3.63Å; L228-F238 HydrophobicContact CD1-CZ 4.39Å
229	R	90.6	Very high	84.3	Confident	95 Å²	95	65.5 Å²	65.5	36%	0.358	32%	0.315	S	S	.	.	H	α-helix	trans	-57.4	-41.4	175.7	-175.3	-174.1	-66.9	-84.8	3.5	111.7	G225 D226 M227 G233 A234 F238	G225-R229 VanDerWaalsContact O-CB 3.28Å; G225-R229 WeakPolarHBondContact O-CB 3.39Å; G225-R229 PolarHBondContact O-N 3.16Å; D226-R229 PolarHBondContact O-N 2.83Å; M227-R229 VanDerWaalsContact C-N 3.35Å; M227-R229 PolarHBondContact O-N 2.98Å; R229-G233 PolarHBondContact O-N 3.17Å; R229-G233 VanDerWaalsContact O-N 3.13Å; R229-A234 WeakPolarHBondContact CG-O 3.42Å; R229-A234 PolarHBondContact O-N 3.1Å; R229-F238 HydrophobicContact CB-CD1 4Å; R229-F238 HydrophobicContact CB-CE1 4.09Å; R229-F238 HydrophobicContact CB-CG 4.48Å; R229-F238 HydrophobicContact CG-CD1 4.39Å
230	M	88.7	Confident	84.5	Confident	139 Å²	139	58.6 Å²	58.6	69%	0.685	28%	0.284	S	S	*	.	H	α-helix	trans	-66.4	-47.9	176.1	-177.9	179.3	63.1	0	0	111.9	D226 M227 L228 G233	D226-M230 PolarHBondContact O-N 3.06Å; D226-M230 VanDerWaalsContact O-N 3.11Å; M227-M230 HydrophobicContact CG-CE 4.39Å; M227-M230 WeakPolarHBondContact O-CB 3.33Å; M227-M230 PolarHBondContact O-N 3.08Å; L228-M230 VanDerWaalsContact C-N 3.26Å; L228-M230 PolarHBondContact O-N 2.61Å; M230-G233 PolarHBondContact O-N 2.79Å
231	V	88.1	Confident	84.6	Confident	25 Å²	25	58.4 Å²	58.4	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-43.4	179.6	170	0	0	0	0	111.6	M176 A180 M227 L228 G233	M176-V231 HydrophobicContact CB-CG1 4.01Å; M176-V231 WeakPolarHBondContact O-CG1 3.27Å; A180-V231 HydrophobicContact CB-CG1 3.94Å; A180-V231 HydrophobicContact CB-CG2 3.93Å; M227-V231 WeakPolarHBondContact O-CG2 3.4Å; M227-V231 PolarHBondContact O-N 3.01Å; L228-V231 PolarHBondContact O-N 3.35Å; V231-G233 VanDerWaalsContact C-N 3.26Å; V231-G233 PolarHBondContact O-N 3.31Å
232	L	86.3	Confident	84.5	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10	-178.5	-65.9	166.1	0	0	0	112.6	A160 F162 Y173 T177 I207 L228 A234 F238	A160-L232 HydrophobicContact CB-CB 4.15Å; A160-L232 HydrophobicContact CB-CD1 3.79Å; A160-L232 HydrophobicContact CB-CG 4.38Å; F162-L232 WeakPolarHBondContact CE1-O 3.35Å; F162-L232 HydrophobicContact CZ-CB 4.34Å; F162-L232 HydrophobicContact CZ-CD2 4.46Å; F162-L232 WeakPolarHBondContact CZ-O 3.3Å; Y173-L232 WeakPolarHBondContact CD1-O 3.2Å; Y173-L232 WeakPolarHBondContact CE1-O 3.11Å; T177-L232 HydrophobicContact CG2-CD2 4.47Å; T177-L232 WeakPolarHBondContact OG1-CD2 3.44Å; I207-L232 HydrophobicContact CB-CD2 3.78Å; I207-L232 HydrophobicContact CD1-CD2 3.75Å; I207-L232 HydrophobicContact CG1-CD2 4.37Å; I207-L232 HydrophobicContact CG2-CD2 3.5Å; I207-L232 VanDerWaalsContact CG2-CD2 3.5Å; L228-L232 HydrophobicContact CB-CD1 4.17Å; L228-L232 WeakPolarHBondContact O-CB 3.33Å; L228-L232 WeakPolarHBondContact O-CD1 3.37Å; L228-L232 WeakPolarHBondContact O-CG 2.96Å; L228-L232 PolarHBondContact O-N 3.2Å; L232-A234 HydrophobicContact CB-CB 4.17Å; L232-A234 PolarHBondContact O-N 3.16Å; L232-F238 HydrophobicContact CD1-CD2 4.16Å; L232-F238 HydrophobicContact CD1-CE2 3.69Å
233	G	78.5	Confident	84	Confident	30 Å²	30	52.2 Å²	52.2	31%	0.309	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	18.2	-174.5	0	0	0	0	0	114.1	R229 M230 V231 K235	R229-G233 PolarHBondContact O-N 3.17Å; R229-G233 VanDerWaalsContact O-N 3.13Å; M230-G233 PolarHBondContact O-N 2.79Å; V231-G233 VanDerWaalsContact C-N 3.26Å; V231-G233 PolarHBondContact O-N 3.31Å; G233-K235 PolarHBondContact O-N 3.06Å; G233-K235 VanDerWaalsContact O-N 3.11Å
234	A	75.5	Confident	83.3	Confident	6 Å²	6	57.4 Å²	57.4	5%	0.05	28%	0.278	C	S	.	.			trans	-77.1	101.2	-170.6	0	0	0	0	0	110.5	A160 R229 L232 F238	A160-A234 HydrophobicContact CB-CB 3.74Å; R229-A234 WeakPolarHBondContact CG-O 3.42Å; R229-A234 PolarHBondContact O-N 3.1Å; L232-A234 HydrophobicContact CB-CB 4.17Å; L232-A234 PolarHBondContact O-N 3.16Å; A234-F238 HydrophobicContact CB-CB 4.06Å
235	K	71	Confident	82	Confident	195 Å²	195	61.7 Å²	61.7	85%	0.848	31%	0.308	S	S	*	.	S	Bend	trans	-78.8	-39.6	-178.5	-66.6	-176.6	-179.6	178.2	0	113.6	G233	G233-K235 PolarHBondContact O-N 3.06Å; G233-K235 VanDerWaalsContact O-N 3.11Å
236	K	68.6	Low	80.3	Confident	199 Å²	199	66.7 Å²	66.7	87%	0.865	33%	0.334	S	S	*	.	S	Bend	trans	-110.9	-52.4	-165.3	-65.7	-175.4	179.2	179.7	0	113.9
237	S	79.7	Confident	79.9	Confident	38 Å²	38	64.6 Å²	64.6	27%	0.266	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	89.4	-173.7	176.1	0	0	0	0	110.8	A160 R161	A160-S237 WeakPolarHBondContact CA-O 3.49Å; R161-S237 PolarHBondContact N-O 3.19Å
238	F	87.3	Confident	79.4	Confident	17 Å²	17	65.5 Å²	65.5	8%	0.075	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	120.4	171.4	-178.9	-106	0	0	0	109.9	W158 I159 A160 G225 L228 R229 L232 A234	W158-F238 HydrophobicContact CB-CE2 3.82Å; W158-F238 HydrophobicContact CB-CZ 3.83Å; W158-F238 HydrophobicContact CD2-CE1 4.07Å; W158-F238 HydrophobicContact CD2-CE2 4.48Å; W158-F238 AromaticContact CD2-CZ 3.67Å; W158-F238 HydrophobicContact CD2-CZ 3.67Å; W158-F238 HydrophobicContact CE3-CD1 4.05Å; W158-F238 AromaticContact CE3-CE1 3.2Å; W158-F238 HydrophobicContact CE3-CE1 3.2Å; W158-F238 HydrophobicContact CE3-CE2 4.05Å; W158-F238 AromaticContact CE3-CZ 3.21Å; W158-F238 HydrophobicContact CE3-CZ 3.21Å; W158-F238 HydrophobicContact CG-CE2 4.45Å; W158-F238 AromaticContact CG-CZ 3.96Å; W158-F238 HydrophobicContact CG-CZ 3.96Å; W158-F238 HydrophobicContact CH2-CE1 4.49Å; W158-F238 HydrophobicContact CZ3-CD1 4.18Å; W158-F238 AromaticContact CZ3-CE1 3.45Å; W158-F238 HydrophobicContact CZ3-CE1 3.45Å; W158-F238 VanDerWaalsContact CZ3-CE1 3.45Å; W158-F238 AromaticContact CZ3-CZ 3.96Å; W158-F238 HydrophobicContact CZ3-CZ 3.96Å; I159-F238 VanDerWaalsContact O-CA 3.29Å; I159-F238 WeakPolarHBondContact O-CA 3.46Å; A160-F238 HydrophobicContact CB-CD2 4.01Å; G225-F238 WeakPolarHBondContact O-CE1 2.77Å; G225-F238 WeakPolarHBondContact O-CZ 2.77Å; L228-F238 HydrophobicContact CB-CE2 4.09Å; L228-F238 HydrophobicContact CB-CZ 3.63Å; L228-F238 HydrophobicContact CD1-CZ 4.39Å; R229-F238 HydrophobicContact CB-CD1 4Å; R229-F238 HydrophobicContact CB-CE1 4.09Å; R229-F238 HydrophobicContact CB-CG 4.48Å; R229-F238 HydrophobicContact CG-CD1 4.39Å; L232-F238 HydrophobicContact CD1-CD2 4.16Å; L232-F238 HydrophobicContact CD1-CE2 3.69Å; A234-F238 HydrophobicContact CB-CB 4.06Å
239	R	88.2	Confident	78.8	Confident	82 Å²	82	69.1 Å²	69.1	31%	0.309	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	161.6	-178.1	70.6	177.9	-172.5	-78.1	-1.7	112	S42 W158 I159 V241	S42-R239 PolarHBondContact O-NH2 3.42Å; W158-R239 WeakPolarHBondContact CA-O 3.42Å; I159-R239 HydrophobicContact CG2-CG 3.55Å; I159-R239 PolarHBondContact N-O 3.3Å; I159-R239 PolarHBondContact O-N 2.88Å; I159-R239 VanDerWaalsContact O-N 3.11Å; R239-V241 HydrophobicContact CG-CG2 4.36Å
240	Y	87	Confident	78.1	Confident	39 Å²	39	67.6 Å²	67.6	15%	0.153	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.2	168.4	-176.9	-102.3	0	0	0	109.9	H157 W158 R213	H157-Y240 CarbonylContact O-C 3.59Å; H157-Y240 WeakPolarHBondContact O-CA 2.65Å; H157-Y240 WeakPolarHBondContact O-CD2 3.35Å; W158-Y240 AromaticContact CD1-CD2 3.84Å; W158-Y240 AromaticContact CD2-CD2 3.76Å; W158-Y240 HydrophobicContact CD2-CD2 3.76Å; W158-Y240 HydrophobicContact CD2-CG 4.36Å; W158-Y240 AromaticContact CE2-CD2 3.49Å; W158-Y240 VanDerWaalsContact CE2-CD2 3.49Å; W158-Y240 HydrophobicContact CE3-CD2 4.39Å; W158-Y240 HydrophobicContact CG-CD2 4Å; W158-Y240 AromaticContact CZ2-CD2 3.94Å; W158-Y240 HydrophobicContact CZ2-CD2 3.94Å; W158-Y240 HydrophobicContact CZ2-CG 4.26Å; W158-Y240 AromaticContact NE1-CD2 3.52Å; W158-Y240 AromaticContact NE1-CE2 3.91Å; R213-Y240 PolarHBondContact NH2-OH 3.34Å; R213-Y240 VanDerWaalsContact NH2-OH 3.07Å
241	V	84.5	Confident	77.4	Confident	27 Å²	27	63.1 Å²	63.1	16%	0.164	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.5	174.3	-179.8	0	0	0	0	107.8	G156 H157 R239 I246	G156-V241 CarbonylContact C-O 3.57Å; G156-V241 VanDerWaalsContact CA-O 3.24Å; G156-V241 WeakPolarHBondContact CA-O 3.32Å; H157-V241 PolarHBondContact N-O 2.89Å; H157-V241 PolarHBondContact O-N 3.37Å; R239-V241 HydrophobicContact CG-CG2 4.36Å; V241-I246 HydrophobicContact CG1-CD1 4.25Å; V241-I246 HydrophobicContact CG1-CG1 4.41Å
242	S	81.1	Confident	76.7	Confident	22 Å²	22	65.7 Å²	65.7	15%	0.154	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	141.8	174.3	-155.3	0	0	0	0	109.1	R213 Q244 S245	R213-S242 PolarHBondContact NH2-OG 3.05Å; S242-Q244 PolarHBondContact O-N 3.08Å; S242-S245 PolarHBondContact O-N 3.25Å; S242-S245 PolarHBondContact O-OG 3.41Å
243	H	76.1	Confident	76	Confident	5 Å²	5	70.3 Å²	70.3	2%	0.023	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-74.1	-13.1	175.2	-63.6	167.6	0	0	0	113.4	W46 I151 E155 H157 S245 I246	W46-H243 WeakPolarHBondContact CB-CE1 3.48Å; I151-H243 HydrophobicContact CG2-CB 3.48Å; I151-H243 VanDerWaalsContact CG2-CB 3.48Å; E155-H243 VanDerWaalsContact CB-ND1 3.26Å; E155-H243 WeakPolarHBondContact CB-ND1 3.22Å; E155-H243 WeakPolarHBondContact O-CB 3.42Å; E155-H243 PolarHBondContact O-N 3.05Å; H157-H243 AromaticContact CE1-NE2 3.9Å; H157-H243 AromaticContact ND1-CD2 3.51Å; H157-H243 AromaticContact ND1-NE2 3.16Å; H157-H243 PolarHBondContact ND1-NE2 2.78Å; H157-H243 VanDerWaalsContact ND1-NE2 3.16Å; H243-S245 PolarHBondContact O-N 3.2Å; H243-I246 PolarHBondContact O-N 3.38Å
244	Q	71.9	Confident	75.8	Confident	127 Å²	127	73.4 Å²	73.4	59%	0.593	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-67.4	-18.4	169.6	-58	-174.6	-10.5	0	0	113.7	A153 S242	A153-Q244 HydrophobicContact CB-CG 4.18Å; A153-Q244 VanDerWaalsContact O-CD 3.28Å; A153-Q244 WeakPolarHBondContact O-CG 3.39Å; A153-Q244 PolarHBondContact O-NE2 3Å; S242-Q244 PolarHBondContact O-N 3.08Å
245	S	60.9	Low	75.9	Confident	90 Å²	90	79 Å²	79	63%	0.629	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-100	12.2	-178.8	60.6	0	0	0	0	113.1	S242 H243	S242-S245 PolarHBondContact O-N 3.25Å; S242-S245 PolarHBondContact O-OG 3.41Å; H243-S245 PolarHBondContact O-N 3.2Å
246	I	54.3	Low	76.3	Confident	107 Å²	107	68.5 Å²	68.5	55%	0.549	34%	0.344	S	S	.	.			trans	-111.2	0	176.1	-56.3	176.9	0	0	0	106.9	L39 V241 H243	L39-I246 HydrophobicContact CD2-CG2 4.46Å; V241-I246 HydrophobicContact CG1-CD1 4.25Å; V241-I246 HydrophobicContact CG1-CG1 4.41Å; H243-I246 PolarHBondContact O-N 3.38Å

Retrieved 246 of 246 residues in 465.6 ms (Link to these results)

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