A0A087XK19_POEFO Loading...

Torsin family 3, member A

AlphaFold DB (A0A3B3TSJ3), UniProt , Accession A0A087XK19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 367 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	37	Very low	32.2	Very low	229 Å²	229	164.4 Å²	164.4	100%	1.128	82%	0.823	S	S	*	*				0	95.2	0	-78.9	158.9	71.8	0	0	106.4
2	F	27.4	Very low	31.8	Very low	205 Å²	205	158 Å²	158	90%	0.899	82%	0.815	S	S	*	*				60.2	123.6	93.1	-90.5	-104.2	0	0	0	110.7
3	V	31.8	Very low	31.2	Very low	108 Å²	108	159 Å²	159	66%	0.655	82%	0.821	S	S	*	*			cis	-168	129.6	6.6	140.9	0	0	0	0	102.4
4	R	32.3	Very low	31.1	Very low	202 Å²	202	155.4 Å²	155.4	76%	0.762	82%	0.816	S	S	*	*				81	131.5	57.1	-144.4	-167.2	175	-169.8	3.7	112.8
5	W	32.2	Very low	31.2	Very low	191 Å²	191	150.5 Å²	150.5	72%	0.723	81%	0.807	S	S	*	*			trans	88	126.3	166	-61.9	73.4	0	0	0	116.6
6	L	27.7	Very low	30.7	Very low	144 Å²	144	152.6 Å²	152.6	75%	0.754	81%	0.81	S	S	*	*			cis	-165.6	137.2	17	-111.8	159.3	0	0	0	110.5
7	L	31.3	Very low	31.2	Very low	153 Å²	153	148.9 Å²	148.9	80%	0.801	81%	0.807	S	S	*	*			trans	-69.7	-167.2	150	-89.5	113.1	0	0	0	109.1
8	P	46.3	Very low	30.9	Very low	100 Å²	100	148.3 Å²	148.3	65%	0.649	80%	0.803	S	S	*	*				-131.4	171.8	-60.6	36.7	-21.1	0	0	0	110.4
9	L	26.6	Very low	31	Very low	170 Å²	170	148.4 Å²	148.4	89%	0.89	80%	0.801	S	S	*	*			trans	-163.7	73.8	157	-130.9	129.4	0	0	0	114.5
10	I	31.1	Very low	30.8	Very low	170 Å²	170	151 Å²	151	87%	0.872	81%	0.805	S	S	*	*			trans	-149.6	81.3	142.3	-48.7	-178.3	0	0	0	108.7
11	C	30.5	Very low	30.7	Very low	136 Å²	136	149.2 Å²	149.2	92%	0.919	80%	0.802	S	S	*	*			trans	-148.8	89.6	154	-97.4	0	0	0	0	106.8
12	A	27.2	Very low	31.1	Very low	88 Å²	88	144.8 Å²	144.8	73%	0.727	78%	0.782	S	S	*	*			trans	-178.8	103.4	150.7	0	0	0	0	0	107.5
13	L	24.4	Very low	31.4	Very low	171 Å²	171	142.9 Å²	142.9	90%	0.895	78%	0.781	S	S	*	*				171.9	103.4	123.5	-87.8	156.6	0	0	0	108
14	S	30.4	Very low	31.8	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	79%	0.79	S	S	*	*			trans	-72.4	156.7	150	67.3	0	0	0	0	109.2
15	A	31.9	Very low	32.1	Very low	82 Å²	82	138.3 Å²	138.3	68%	0.678	78%	0.776	S	S	*	*			trans	78.2	128.2	170.9	0	0	0	0	0	113.1
16	E	23.9	Very low	33.2	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	77%	0.768	S	S	*	*			cis	-140	155.4	22.6	-97	126.5	178.9	0	0	111.1
17	A	38.3	Very low	34.1	Very low	90 Å²	90	132.9 Å²	132.9	74%	0.744	77%	0.769	S	S	*	*			trans	-61.8	134.7	161.3	0	0	0	0	0	109.7
18	D	25.3	Very low	34.7	Very low	139 Å²	139	130 Å²	130	74%	0.743	76%	0.757	S	S	*	*			trans	-164.9	105.9	142.7	-93.5	-28.8	0	0	0	110.5
19	I	32.8	Very low	35	Very low	149 Å²	149	127.6 Å²	127.6	76%	0.764	74%	0.742	S	S	*	*				40.2	94.3	128.5	-52	167.2	0	0	0	114.6	P21	I19-P21 WeakPolarHBondContact O-CD 3.39Å
20	F	28.3	Very low	36	Very low	201 Å²	201	122.4 Å²	122.4	88%	0.882	72%	0.718	S	S	*	*			trans	-68.9	120.2	160.3	-80.9	-78.4	0	0	0	109.3	L22	F20-L22 PolarHBondContact O-N 3.21Å
21	P	28.8	Very low	37.1	Very low	114 Å²	114	119.2 Å²	119.2	74%	0.74	70%	0.696	S	S	*	*			trans	-76.3	114.4	170.1	31	-27.9	0	0	0	108.2	I19 D23	I19-P21 WeakPolarHBondContact O-CD 3.39Å; P21-D23 PolarHBondContact O-N 3.49Å
22	L	43.7	Very low	38.2	Very low	136 Å²	136	119.6 Å²	119.6	71%	0.712	68%	0.679	S	S	*	*			trans	-72	101.9	167.1	-102.3	128.4	0	0	0	108	F20 I25	F20-L22 PolarHBondContact O-N 3.21Å; L22-I25 HydrophobicContact CD2-CD1 3.52Å; L22-I25 HydrophobicContact CD2-CG1 4.22Å
23	D	34.4	Very low	39.5	Very low	165 Å²	165	122.1 Å²	122.1	88%	0.882	67%	0.674	S	S	*	*			trans	-155.4	84.6	158.4	-94.5	-29.5	0	0	0	109.8	P21	P21-D23 PolarHBondContact O-N 3.49Å
24	S	40.1	Very low	40.7	Very low	119 Å²	119	118.4 Å²	118.4	83%	0.832	66%	0.655	S	S	*	*			trans	157.5	76.3	149.3	-175.2	0	0	0	0	107.9
25	I	39.6	Very low	41.9	Very low	94 Å²	94	119.3 Å²	119.3	48%	0.482	64%	0.643	S	S	.	*			trans	-103.9	113.6	164.6	-65.6	-172.4	0	0	0	105.8	L22 S29	L22-I25 HydrophobicContact CD2-CD1 3.52Å; L22-I25 HydrophobicContact CD2-CG1 4.22Å; I25-S29 WeakPolarHBondContact CG2-OG 3.34Å
26	S	54.8	Low	42.8	Very low	77 Å²	77	121.8 Å²	121.8	54%	0.538	64%	0.638	S	S	.	*			trans	-60.3	149.9	177.9	60.3	0	0	0	0	110.9	V28 S29	S26-V28 PolarHBondContact O-N 3.07Å; S26-S29 WeakPolarHBondContact O-CB 3.44Å; S26-S29 PolarHBondContact O-N 3.22Å
27	N	47.3	Very low	43.9	Very low	145 Å²	145	119 Å²	119	78%	0.775	62%	0.621	S	S	*	*	H	α-helix	trans	-49.4	-26.7	-178.4	-96.4	-7.8	0	0	0	114.8	T30 Y31	N27-T30 PolarHBondContact O-N 2.81Å; N27-Y31 PolarHBondContact O-N 3.32Å; N27-Y31 VanDerWaalsContact O-N 3.16Å
28	V	44.1	Very low	44.5	Very low	92 Å²	92	117.3 Å²	117.3	56%	0.558	60%	0.603	S	S	*	*	H	α-helix	trans	-67.3	-38.3	177.1	-178.6	0	0	0	0	111.2	S26 Y31 Y32	S26-V28 PolarHBondContact O-N 3.07Å; V28-Y31 PolarHBondContact O-N 3.02Å; V28-Y32 HydrophobicContact CG1-CD2 3.85Å; V28-Y32 HydrophobicContact CG1-CE2 3.68Å; V28-Y32 WeakPolarHBondContact O-CD2 3.35Å; V28-Y32 PolarHBondContact O-N 3.2Å; V28-Y32 VanDerWaalsContact O-N 3.11Å
29	S	51.6	Low	45.7	Very low	49 Å²	49	116 Å²	116	34%	0.343	60%	0.596	S	S	.	*	H	α-helix	trans	-73.6	-31.3	178.1	167.3	0	0	0	0	112.2	I25 S26 Y31 F33	I25-S29 WeakPolarHBondContact CG2-OG 3.34Å; S26-S29 WeakPolarHBondContact O-CB 3.44Å; S26-S29 PolarHBondContact O-N 3.22Å; S29-Y31 VanDerWaalsContact C-N 3.31Å; S29-F33 WeakPolarHBondContact O-CB 3.31Å; S29-F33 PolarHBondContact O-N 3.06Å
30	T	48.4	Very low	46.4	Very low	62 Å²	62	114 Å²	114	38%	0.38	59%	0.586	S	S	.	*	H	α-helix	trans	-66.9	-36.9	173.2	-34.6	0	0	0	0	111.1	N27 F33 N34	N27-T30 PolarHBondContact O-N 2.81Å; T30-F33 PolarHBondContact O-N 3.1Å; T30-N34 WeakPolarHBondContact O-CB 3.4Å; T30-N34 PolarHBondContact O-N 3.41Å
31	Y	53.3	Low	47	Very low	102 Å²	102	112.9 Å²	112.9	40%	0.4	58%	0.576	S	S	.	*	H	α-helix	trans	-64.8	-49.7	176	-179.3	-92.6	0	0	0	112.3	N27 V28 S29 F33 N34 Y35 V56	N27-Y31 PolarHBondContact O-N 3.32Å; N27-Y31 VanDerWaalsContact O-N 3.16Å; V28-Y31 PolarHBondContact O-N 3.02Å; S29-Y31 VanDerWaalsContact C-N 3.31Å; Y31-F33 VanDerWaalsContact C-N 3.32Å; Y31-F33 PolarHBondContact O-N 2.99Å; Y31-N34 PolarHBondContact O-N 3.12Å; Y31-Y35 WeakPolarHBondContact O-CB 3.35Å; Y31-Y35 PolarHBondContact O-N 2.98Å; Y31-V56 WeakPolarHBondContact OH-CG2 3.38Å
32	Y	53.5	Low	47.4	Very low	144 Å²	144	117.7 Å²	117.7	57%	0.565	59%	0.588	S	S	*	*	H	α-helix	trans	-67.3	-33.4	177.3	-77.9	-71.1	0	0	0	112.6	V28 Y35 F36	V28-Y32 HydrophobicContact CG1-CD2 3.85Å; V28-Y32 HydrophobicContact CG1-CE2 3.68Å; V28-Y32 WeakPolarHBondContact O-CD2 3.35Å; V28-Y32 PolarHBondContact O-N 3.2Å; V28-Y32 VanDerWaalsContact O-N 3.11Å; Y32-Y35 PolarHBondContact O-N 3.02Å; Y32-F36 WeakPolarHBondContact O-CB 3.5Å; Y32-F36 PolarHBondContact O-N 3.37Å
33	F	54.3	Low	47.1	Very low	142 Å²	142	113.4 Å²	113.4	62%	0.623	58%	0.577	S	S	*	*	H	α-helix	trans	-67.4	-44.8	176.4	-158.2	-89.4	0	0	0	111.6	S29 T30 Y31 F36 Y37	S29-F33 WeakPolarHBondContact O-CB 3.31Å; S29-F33 PolarHBondContact O-N 3.06Å; T30-F33 PolarHBondContact O-N 3.1Å; Y31-F33 VanDerWaalsContact C-N 3.32Å; Y31-F33 PolarHBondContact O-N 2.99Å; F33-F36 PolarHBondContact O-N 3.02Å; F33-Y37 VanDerWaalsContact O-CB 3.25Å; F33-Y37 WeakPolarHBondContact O-CB 3.47Å; F33-Y37 PolarHBondContact O-N 3.46Å
34	N	49.3	Very low	47.2	Very low	92 Å²	92	115.1 Å²	115.1	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-66.3	-36.9	173.9	-83.2	-16.7	0	0	0	112.5	T30 Y31 Y37 C38	T30-N34 WeakPolarHBondContact O-CB 3.4Å; T30-N34 PolarHBondContact O-N 3.41Å; Y31-N34 PolarHBondContact O-N 3.12Å; N34-Y37 PolarHBondContact O-N 2.92Å; N34-C38 WeakPolarHBondContact O-CB 3.37Å; N34-C38 PolarHBondContact O-N 3.4Å; N34-C38 PolarHBondContact O-SG 3.27Å
35	Y	55.6	Low	47.7	Very low	128 Å²	128	112.8 Å²	112.8	50%	0.502	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-41.7	175.3	-176.2	-93.8	0	0	0	112.2	Y31 Y32 N39	Y31-Y35 WeakPolarHBondContact O-CB 3.35Å; Y31-Y35 PolarHBondContact O-N 2.98Å; Y32-Y35 PolarHBondContact O-N 3.02Å; Y35-N39 VanDerWaalsContact CZ-ND2 3.26Å; Y35-N39 WeakPolarHBondContact O-CB 3.35Å; Y35-N39 PolarHBondContact O-N 3.17Å
36	F	51.6	Low	47.6	Very low	134 Å²	134	116.9 Å²	116.9	59%	0.588	58%	0.58	S	S	*	*	H	α-helix	trans	-68.4	-43.2	174.9	-111.8	-100.9	0	0	0	111.8	Y32 F33 I40	Y32-F36 WeakPolarHBondContact O-CB 3.5Å; Y32-F36 PolarHBondContact O-N 3.37Å; F33-F36 PolarHBondContact O-N 3.02Å; F36-I40 HydrophobicContact CD1-CD1 3.3Å; F36-I40 HydrophobicContact CD1-CG1 4.4Å; F36-I40 HydrophobicContact CE1-CD1 3.55Å; F36-I40 HydrophobicContact CG-CD1 4.31Å; F36-I40 VanDerWaalsContact O-CB 3.3Å; F36-I40 WeakPolarHBondContact O-CB 3.49Å; F36-I40 WeakPolarHBondContact O-CG1 3Å; F36-I40 PolarHBondContact O-N 3Å; F36-I40 VanDerWaalsContact O-N 3.12Å
37	Y	47.7	Very low	46.7	Very low	126 Å²	126	118.7 Å²	118.7	49%	0.494	59%	0.589	S	S	.	*	H	α-helix	trans	-64.1	-45.9	-178.4	-168.1	-93.3	0	0	0	112.1	F33 N34 W41	F33-Y37 VanDerWaalsContact O-CB 3.25Å; F33-Y37 WeakPolarHBondContact O-CB 3.47Å; F33-Y37 PolarHBondContact O-N 3.46Å; N34-Y37 PolarHBondContact O-N 2.92Å; Y37-W41 HydrophobicContact CE2-CE3 4.24Å; Y37-W41 PolarHBondContact O-N 3.36Å; Y37-W41 VanDerWaalsContact O-N 3.13Å
38	C	50.5	Low	46.1	Very low	54 Å²	54	121 Å²	121	37%	0.365	60%	0.595	S	S	.	*	H	α-helix	trans	-74.5	-25.1	-179.8	-65.8	0	0	0	0	114.1	N34 C45	N34-C38 WeakPolarHBondContact O-CB 3.37Å; N34-C38 PolarHBondContact O-N 3.4Å; N34-C38 PolarHBondContact O-SG 3.27Å; C38-C45 HydrophobicContact CB-CB 4.3Å; C38-C45 WeakPolarHBondContact CB-SG 3.04Å; C38-C45 WeakPolarHBondContact SG-CB 3.2Å; C38-C45 CovalentContact SG-SG 2.07Å; C38-C45 PolarHBondContact SG-SG 2.67Å
39	N	49.8	Very low	45.8	Very low	111 Å²	111	125 Å²	125	59%	0.594	61%	0.608	S	S	*	*	H	α-helix	trans	-88.4	-19.3	177.8	-92.7	-38.1	0	0	0	113.9	Y35	Y35-N39 VanDerWaalsContact CZ-ND2 3.26Å; Y35-N39 WeakPolarHBondContact O-CB 3.35Å; Y35-N39 PolarHBondContact O-N 3.17Å
40	I	47.3	Very low	45	Very low	108 Å²	108	130.2 Å²	130.2	55%	0.554	63%	0.632	S	S	*	*	H	α-helix	trans	-101	-35.4	-177	-66.8	-177.7	0	0	0	111.8	F36	F36-I40 HydrophobicContact CD1-CD1 3.3Å; F36-I40 HydrophobicContact CD1-CG1 4.4Å; F36-I40 HydrophobicContact CE1-CD1 3.55Å; F36-I40 HydrophobicContact CG-CD1 4.31Å; F36-I40 VanDerWaalsContact O-CB 3.3Å; F36-I40 WeakPolarHBondContact O-CB 3.49Å; F36-I40 WeakPolarHBondContact O-CG1 3Å; F36-I40 PolarHBondContact O-N 3Å; F36-I40 VanDerWaalsContact O-N 3.12Å
41	W	40.8	Very low	44.3	Very low	177 Å²	177	133.9 Å²	133.9	67%	0.67	65%	0.649	S	S	*	*	S	Bend	trans	-117.4	121.3	178.4	-82.6	8.5	0	0	0	110.4	Y37 G43	Y37-W41 HydrophobicContact CE2-CE3 4.24Å; Y37-W41 PolarHBondContact O-N 3.36Å; Y37-W41 VanDerWaalsContact O-N 3.13Å; W41-G43 PolarHBondContact O-N 2.62Å
42	E	37.3	Very low	43.5	Very low	214 Å²	214	134.2 Å²	134.2	100%	1	67%	0.673	S	S	*	*			trans	-69.3	68.7	178.7	-70.9	-176.7	155.2	0	0	112.2
43	G	38.9	Very low	42.7	Very low	46 Å²	46	133.3 Å²	133.3	47%	0.474	68%	0.683	S	S	.	*			trans	-107.9	145.6	167.6	0	0	0	0	0	111.4	W41 C45	W41-G43 PolarHBondContact O-N 2.62Å; G43-C45 PolarHBondContact O-N 2.77Å
44	E	36.6	Very low	41.9	Very low	201 Å²	201	134.2 Å²	134.2	94%	0.939	69%	0.689	S	S	*	*			trans	-60.9	104.3	178.7	-68.3	-173.3	165.7	0	0	111.8
45	C	48.8	Very low	41.3	Very low	71 Å²	71	138.9 Å²	138.9	48%	0.48	71%	0.708	S	S	.	*			trans	-89.3	102	172.7	-62.9	0	0	0	0	109.5	C38 G43	C38-C45 HydrophobicContact CB-CB 4.3Å; C38-C45 WeakPolarHBondContact CB-SG 3.04Å; C38-C45 WeakPolarHBondContact SG-CB 3.2Å; C38-C45 CovalentContact SG-SG 2.07Å; C38-C45 PolarHBondContact SG-SG 2.67Å; G43-C45 PolarHBondContact O-N 2.77Å
46	Q	37.7	Very low	40.4	Very low	179 Å²	179	136.9 Å²	136.9	84%	0.836	71%	0.708	S	S	*	*			trans	-82.2	126.6	165.3	-91.7	177.7	-23.4	0	0	109.9	H48	Q46-H48 PolarHBondContact O-N 2.82Å
47	P	37.4	Very low	39.4	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	71%	0.711	S	S	*	*			trans	-78.4	125	178.3	29.9	-30	0	0	0	110	Q49	P47-Q49 PolarHBondContact O-N 3.38Å; P47-Q49 VanDerWaalsContact O-N 3.12Å
48	H	34.1	Very low	39.1	Very low	194 Å²	194	136.7 Å²	136.7	90%	0.898	73%	0.733	S	S	*	*			trans	-65.5	109.9	159.5	-85.7	-78.4	0	0	0	108.1	Q46 D50	Q46-H48 PolarHBondContact O-N 2.82Å; H48-D50 PolarHBondContact O-N 3.22Å; H48-D50 VanDerWaalsContact O-N 3.15Å
49	Q	38.2	Very low	38.4	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.822	74%	0.736	S	S	*	*			trans	-63.3	104.7	165.7	-78.7	171.3	-36.4	0	0	107.6	P47	P47-Q49 PolarHBondContact O-N 3.38Å; P47-Q49 VanDerWaalsContact O-N 3.12Å
50	D	34.4	Very low	38.2	Very low	159 Å²	159	139.2 Å²	139.2	85%	0.85	75%	0.753	S	S	*	*			trans	-177.7	55.3	151.2	-84.4	-23.7	0	0	0	109.9	H48	H48-D50 PolarHBondContact O-N 3.22Å; H48-D50 VanDerWaalsContact O-N 3.15Å
51	D	34.1	Very low	37.8	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	76%	0.762	S	S	*	*			trans	-166.2	81.2	151.2	-121.6	-20.6	0	0	0	111.2	T53	D51-T53 VanDerWaalsContact C-N 3.29Å; D51-T53 PolarHBondContact O-N 3.32Å
52	A	35.4	Very low	37.7	Very low	109 Å²	109	141.1 Å²	141.1	90%	0.901	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	40.2	-174.7	0	0	0	0	0	113.6
53	T	37.5	Very low	37.6	Very low	125 Å²	125	137.4 Å²	137.4	77%	0.767	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	3.9	173.7	52.4	0	0	0	0	116.3	D51	D51-T53 VanDerWaalsContact C-N 3.29Å; D51-T53 PolarHBondContact O-N 3.32Å
54	Q	37.6	Very low	37.8	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	77%	0.767	S	S	*	*			trans	-103.5	90.5	167.9	-85.7	172.8	-21.3	0	0	111	V56	Q54-V56 PolarHBondContact O-N 3.12Å; Q54-V56 VanDerWaalsContact O-N 3.09Å
55	Q	36.3	Very low	38	Very low	190 Å²	190	136 Å²	136	89%	0.888	75%	0.754	S	S	*	*			trans	-66.2	104.1	161.9	-72.8	179.8	-21.3	0	0	108.2	P57	Q55-P57 WeakPolarHBondContact O-CD 3.38Å
56	V	35.9	Very low	38	Very low	85 Å²	85	137.3 Å²	137.3	52%	0.515	76%	0.761	S	S	.	*			trans	-67.6	121.6	166.7	-171	0	0	0	0	106.4	Y31 Q54 V58	Y31-V56 WeakPolarHBondContact OH-CG2 3.38Å; Q54-V56 PolarHBondContact O-N 3.12Å; Q54-V56 VanDerWaalsContact O-N 3.09Å; V56-V58 PolarHBondContact O-N 3.4Å; V56-V58 VanDerWaalsContact O-N 3.09Å
57	P	32.4	Very low	38.7	Very low	99 Å²	99	138.1 Å²	138.1	64%	0.643	77%	0.765	S	S	*	*			trans	-64.7	117.1	177.4	7.7	-1.4	0	0	0	108.4	Q55 G59	Q55-P57 WeakPolarHBondContact O-CD 3.38Å; P57-G59 PolarHBondContact O-N 2.52Å
58	V	40.2	Very low	39.6	Very low	158 Å²	158	137.4 Å²	137.4	96%	0.958	76%	0.755	S	S	*	*			trans	-78.1	74.7	160.9	-172.5	0	0	0	0	106	V56	V56-V58 PolarHBondContact O-N 3.4Å; V56-V58 VanDerWaalsContact O-N 3.09Å
59	G	36.9	Very low	40.9	Very low	41 Å²	41	136 Å²	136	42%	0.423	74%	0.743	S	S	.	*			trans	-129.9	122.2	177.1	0	0	0	0	0	108.3	P57 L61	P57-G59 PolarHBondContact O-N 2.52Å; G59-L61 PolarHBondContact O-N 3.4Å
60	D	45.7	Very low	42	Very low	177 Å²	177	132.8 Å²	132.8	95%	0.947	74%	0.736	S	S	*	*			trans	-44.6	104.8	172.3	-67.8	-41.8	0	0	0	110.4
61	L	37.5	Very low	43.1	Very low	143 Å²	143	127.4 Å²	127.4	75%	0.749	71%	0.711	S	S	*	*			trans	-97.2	105.4	-179.8	-98	145.6	0	0	0	109.1	G59	G59-L61 PolarHBondContact O-N 3.4Å
62	W	38.5	Very low	44.5	Very low	181 Å²	181	125.4 Å²	125.4	69%	0.686	70%	0.699	S	S	*	*			trans	94.1	108.9	171.2	-89.4	-58.7	0	0	0	119.5	G64 F65	W62-G64 PolarHBondContact O-N 2.77Å; W62-G64 VanDerWaalsContact O-N 3.09Å; W62-F65 HydrophobicContact CB-CD2 3.78Å; W62-F65 HydrophobicContact CB-CE2 4.49Å; W62-F65 AromaticContact CD2-CD2 3.96Å; W62-F65 HydrophobicContact CD2-CD2 3.96Å; W62-F65 AromaticContact CD2-CE2 3.76Å; W62-F65 HydrophobicContact CD2-CE2 3.76Å; W62-F65 AromaticContact CE3-CD2 3.97Å; W62-F65 HydrophobicContact CE3-CD2 3.97Å; W62-F65 AromaticContact CE3-CE2 3.66Å; W62-F65 HydrophobicContact CE3-CE2 3.66Å; W62-F65 AromaticContact CG-CD2 3.91Å; W62-F65 HydrophobicContact CG-CD2 3.91Å; W62-F65 HydrophobicContact CG-CE2 4.15Å; W62-F65 HydrophobicContact CZ3-CE2 4.11Å
63	P	36.2	Very low	45.8	Very low	137 Å²	137	124.8 Å²	124.8	89%	0.89	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	89.4	157.7	32.4	-26.7	0	0	0	107.8
64	G	42.7	Very low	47	Very low	65 Å²	65	124.8 Å²	124.8	67%	0.67	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	154	0.5	176.2	0	0	0	0	0	117.5	W62 P66	W62-G64 PolarHBondContact O-N 2.77Å; W62-G64 VanDerWaalsContact O-N 3.09Å; G64-P66 WeakPolarHBondContact O-CD 3.42Å
65	F	40.8	Very low	48.2	Very low	153 Å²	153	123.6 Å²	123.6	67%	0.671	67%	0.666	S	S	*	*			trans	-89.5	115.5	170.3	-92.7	-93.6	0	0	0	109.6	W62	W62-F65 HydrophobicContact CB-CD2 3.78Å; W62-F65 HydrophobicContact CB-CE2 4.49Å; W62-F65 AromaticContact CD2-CD2 3.96Å; W62-F65 HydrophobicContact CD2-CD2 3.96Å; W62-F65 AromaticContact CD2-CE2 3.76Å; W62-F65 HydrophobicContact CD2-CE2 3.76Å; W62-F65 AromaticContact CE3-CD2 3.97Å; W62-F65 HydrophobicContact CE3-CD2 3.97Å; W62-F65 AromaticContact CE3-CE2 3.66Å; W62-F65 HydrophobicContact CE3-CE2 3.66Å; W62-F65 AromaticContact CG-CD2 3.91Å; W62-F65 HydrophobicContact CG-CD2 3.91Å; W62-F65 HydrophobicContact CG-CE2 4.15Å; W62-F65 HydrophobicContact CZ3-CE2 4.11Å
66	P	48.5	Very low	49.8	Very low	98 Å²	98	122.1 Å²	122.1	64%	0.636	65%	0.652	S	S	*	*			trans	-66.8	140.6	-177.9	-15.2	29.1	0	0	0	110.3	G64 D68	G64-P66 WeakPolarHBondContact O-CD 3.42Å; P66-D68 HydrophobicContact CB-CB 4.05Å; P66-D68 PolarHBondContact O-N 2.87Å
67	Q	51.9	Low	51.1	Low	195 Å²	195	126 Å²	126	91%	0.911	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	10.1	170.7	-71.7	-172.3	-27.1	0	0	114.4	T70	Q67-T70 PolarHBondContact O-OG1 2.9Å
68	D	56.5	Low	52.6	Low	101 Å²	101	122.9 Å²	122.9	54%	0.54	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.7	2.3	-163.2	-141	5.3	0	0	0	113.4	P66 S71 L72	P66-D68 HydrophobicContact CB-CB 4.05Å; P66-D68 PolarHBondContact O-N 2.87Å; D68-S71 PolarHBondContact O-OG 3.27Å; D68-S71 PolarHBondContact OD1-OG 3.34Å; D68-L72 WeakPolarHBondContact O-CD1 3.16Å; D68-L72 WeakPolarHBondContact O-CG 3.43Å; D68-L72 PolarHBondContact O-N 3.1Å
69	Y	62.2	Low	53.7	Low	163 Å²	163	119.6 Å²	119.6	64%	0.639	62%	0.623	S	S	*	*	H	α-helix	trans	-84.2	-27	179.6	-136	-93.7	0	0	0	112.6	L73	Y69-L73 HydrophobicContact CD1-CD1 3.7Å; Y69-L73 HydrophobicContact CD1-CG 3.83Å; Y69-L73 HydrophobicContact CE1-CD1 4.14Å; Y69-L73 HydrophobicContact CE1-CD2 4.29Å; Y69-L73 HydrophobicContact CE1-CG 4.08Å; Y69-L73 WeakPolarHBondContact O-CB 3.3Å; Y69-L73 VanDerWaalsContact O-CG 3.29Å; Y69-L73 WeakPolarHBondContact O-CG 3.26Å; Y69-L73 PolarHBondContact O-N 2.87Å
70	T	61	Low	55	Low	110 Å²	110	123.5 Å²	123.5	68%	0.675	63%	0.633	S	S	*	*	H	α-helix	trans	-68.6	-40.5	174.6	50.9	0	0	0	0	111.1	Q67 H74	Q67-T70 PolarHBondContact O-OG1 2.9Å; T70-H74 WeakPolarHBondContact O-CB 3.25Å; T70-H74 PolarHBondContact O-N 3.38Å
71	S	57.3	Low	55.5	Low	46 Å²	46	116.8 Å²	116.8	32%	0.322	61%	0.606	S	S	.	*	H	α-helix	trans	-63.8	-45.1	174	58.5	0	0	0	0	111.1	D68 H74 Q75	D68-S71 PolarHBondContact O-OG 3.27Å; D68-S71 PolarHBondContact OD1-OG 3.34Å; S71-H74 PolarHBondContact O-N 3.25Å; S71-Q75 WeakPolarHBondContact O-CB 3.21Å; S71-Q75 PolarHBondContact O-N 3.07Å
72	L	63.8	Low	56.4	Low	95 Å²	95	116.8 Å²	116.8	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-65.7	-41.8	177.7	-77.9	166	0	0	0	113.2	D68 Q75 W76	D68-L72 WeakPolarHBondContact O-CD1 3.16Å; D68-L72 WeakPolarHBondContact O-CG 3.43Å; D68-L72 PolarHBondContact O-N 3.1Å; L72-Q75 PolarHBondContact O-N 3.19Å; L72-W76 VanDerWaalsContact O-CB 3.27Å; L72-W76 WeakPolarHBondContact O-CB 3.34Å; L72-W76 PolarHBondContact O-N 3.07Å
73	L	62.6	Low	57.3	Low	96 Å²	96	110.8 Å²	110.8	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-69.6	-39.7	175.6	-74.6	173.7	0	0	0	111.8	Y69 Q75 W76 Y77	Y69-L73 HydrophobicContact CD1-CD1 3.7Å; Y69-L73 HydrophobicContact CD1-CG 3.83Å; Y69-L73 HydrophobicContact CE1-CD1 4.14Å; Y69-L73 HydrophobicContact CE1-CD2 4.29Å; Y69-L73 HydrophobicContact CE1-CG 4.08Å; Y69-L73 WeakPolarHBondContact O-CB 3.3Å; Y69-L73 VanDerWaalsContact O-CG 3.29Å; Y69-L73 WeakPolarHBondContact O-CG 3.26Å; Y69-L73 PolarHBondContact O-N 2.87Å; L73-Q75 VanDerWaalsContact C-N 3.35Å; L73-W76 PolarHBondContact O-N 2.53Å; L73-Y77 WeakPolarHBondContact O-CB 3.28Å; L73-Y77 PolarHBondContact O-N 3.11Å
74	H	61.9	Low	58.8	Low	126 Å²	126	106.8 Å²	106.8	58%	0.583	56%	0.562	S	S	*	*	H	α-helix	trans	-63.6	-42.4	173.5	-168.1	-51.2	0	0	0	110.4	T70 S71 Y77 C78	T70-H74 WeakPolarHBondContact O-CB 3.25Å; T70-H74 PolarHBondContact O-N 3.38Å; S71-H74 PolarHBondContact O-N 3.25Å; H74-Y77 PolarHBondContact O-N 3.16Å; H74-C78 PolarHBondContact CE1-SG 3.37Å; H74-C78 PolarHBondContact ND1-SG 3.31Å; H74-C78 WeakPolarHBondContact O-CB 3.47Å; H74-C78 PolarHBondContact O-N 3.13Å; H74-C78 PolarHBondContact O-SG 3.08Å
75	Q	63.2	Low	59.7	Low	136 Å²	136	113.8 Å²	113.8	64%	0.636	58%	0.577	S	S	*	*	H	α-helix	trans	-69.8	-36.2	178.9	-162.5	163.8	19.6	0	0	112	S71 L72 L73 S79	S71-Q75 WeakPolarHBondContact O-CB 3.21Å; S71-Q75 PolarHBondContact O-N 3.07Å; L72-Q75 PolarHBondContact O-N 3.19Å; L73-Q75 VanDerWaalsContact C-N 3.35Å; Q75-S79 WeakPolarHBondContact O-CB 3.32Å; Q75-S79 PolarHBondContact O-N 3.15Å; Q75-S79 PolarHBondContact O-OG 3.07Å
76	W	70	Confident	60.6	Low	160 Å²	160	109.3 Å²	109.3	61%	0.606	57%	0.565	S	S	*	*	H	α-helix	trans	-67.6	-47.6	171.8	-175.6	83.2	0	0	0	111.6	L72 L73 C78 S79 L80	L72-W76 VanDerWaalsContact O-CB 3.27Å; L72-W76 WeakPolarHBondContact O-CB 3.34Å; L72-W76 PolarHBondContact O-N 3.07Å; L73-W76 PolarHBondContact O-N 2.53Å; W76-C78 VanDerWaalsContact C-N 3.29Å; W76-C78 PolarHBondContact O-N 2.92Å; W76-S79 WeakPolarHBondContact CA-OG 3.36Å; W76-S79 PolarHBondContact O-N 2.93Å; W76-S79 PolarHBondContact O-OG 3.07Å; W76-L80 HydrophobicContact CD2-CD1 3.72Å; W76-L80 HydrophobicContact CE3-CD1 3.83Å; W76-L80 HydrophobicContact CH2-CD1 3.38Å; W76-L80 HydrophobicContact CZ2-CD1 3.25Å; W76-L80 HydrophobicContact CZ3-CD1 3.66Å; W76-L80 PolarHBondContact O-N 3.46Å
77	Y	63.8	Low	61.5	Low	166 Å²	166	108.1 Å²	108.1	65%	0.651	57%	0.571	S	S	*	*	H	α-helix	trans	-59.7	-39.3	175	-169.5	-98.9	0	0	0	111.8	L73 H74 S79 L80 G81	L73-Y77 WeakPolarHBondContact O-CB 3.28Å; L73-Y77 PolarHBondContact O-N 3.11Å; H74-Y77 PolarHBondContact O-N 3.16Å; Y77-S79 VanDerWaalsContact C-N 3.34Å; Y77-L80 CarbonylContact O-C 3.57Å; Y77-L80 PolarHBondContact O-N 3.33Å; Y77-G81 PolarHBondContact O-N 2.68Å
78	C	62.4	Low	62.8	Low	34 Å²	34	100 Å²	100	23%	0.23	53%	0.534	C	S	.	.	H	α-helix	trans	-77.2	-14.6	175.1	-67.7	0	0	0	0	115.3	H74 W76 G81 C83	H74-C78 PolarHBondContact CE1-SG 3.37Å; H74-C78 PolarHBondContact ND1-SG 3.31Å; H74-C78 WeakPolarHBondContact O-CB 3.47Å; H74-C78 PolarHBondContact O-N 3.13Å; H74-C78 PolarHBondContact O-SG 3.08Å; W76-C78 VanDerWaalsContact C-N 3.29Å; W76-C78 PolarHBondContact O-N 2.92Å; C78-G81 CarbonylContact C-O 3.54Å; C78-C83 WeakPolarHBondContact CA-SG 3.43Å; C78-C83 HydrophobicContact CB-CB 3.29Å; C78-C83 WeakPolarHBondContact CB-SG 3.44Å; C78-C83 WeakPolarHBondContact SG-CB 3.27Å; C78-C83 CovalentContact SG-SG 2.01Å; C78-C83 PolarHBondContact SG-SG 2.87Å
79	S	63.4	Low	64	Low	89 Å²	89	95.9 Å²	95.9	62%	0.622	51%	0.512	S	S	*	.	H	α-helix	trans	-85	-24.1	168.6	70.7	0	0	0	0	112.2	Q75 W76 Y77	Q75-S79 WeakPolarHBondContact O-CB 3.32Å; Q75-S79 PolarHBondContact O-N 3.15Å; Q75-S79 PolarHBondContact O-OG 3.07Å; W76-S79 WeakPolarHBondContact CA-OG 3.36Å; W76-S79 PolarHBondContact O-N 2.93Å; W76-S79 PolarHBondContact O-OG 3.07Å; Y77-S79 VanDerWaalsContact C-N 3.34Å
80	L	65.3	Low	65.3	Low	122 Å²	122	90.7 Å²	90.7	64%	0.639	49%	0.492	S	S	*	.	H	α-helix	trans	-93.9	-20.2	175.3	-68.8	174.8	0	0	0	113.3	W76 Y77	W76-L80 HydrophobicContact CD2-CD1 3.72Å; W76-L80 HydrophobicContact CE3-CD1 3.83Å; W76-L80 HydrophobicContact CH2-CD1 3.38Å; W76-L80 HydrophobicContact CZ2-CD1 3.25Å; W76-L80 HydrophobicContact CZ3-CD1 3.66Å; W76-L80 PolarHBondContact O-N 3.46Å; Y77-L80 CarbonylContact O-C 3.57Å; Y77-L80 PolarHBondContact O-N 3.33Å
81	G	56.6	Low	66.8	Low	36 Å²	36	85.9 Å²	85.9	37%	0.371	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	163	178.3	0	0	0	0	0	112.9	Y77 C78 C83	Y77-G81 PolarHBondContact O-N 2.68Å; C78-G81 CarbonylContact C-O 3.54Å; G81-C83 VanDerWaalsContact C-N 3.31Å; G81-C83 PolarHBondContact O-N 2.81Å
82	Q	55.8	Low	68.4	Low	144 Å²	144	87.2 Å²	87.2	67%	0.673	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	80.1	174.3	-93.8	-175.8	11.1	0	0	110.1	C89	Q82-C89 HydrophobicContact CB-CB 4.06Å; Q82-C89 WeakPolarHBondContact CB-SG 3.35Å; Q82-C89 HydrophobicContact CG-CB 4.16Å; Q82-C89 PolarHBondContact O-SG 3.16Å
83	C	57.9	Low	69.8	Low	55 Å²	55	84.1 Å²	84.1	37%	0.372	45%	0.452	S	S	.	.			trans	-86.4	125.1	167.4	-68.9	0	0	0	0	110.3	C78 G81	C78-C83 WeakPolarHBondContact CA-SG 3.43Å; C78-C83 HydrophobicContact CB-CB 3.29Å; C78-C83 WeakPolarHBondContact CB-SG 3.44Å; C78-C83 WeakPolarHBondContact SG-CB 3.27Å; C78-C83 CovalentContact SG-SG 2.01Å; C78-C83 PolarHBondContact SG-SG 2.87Å; G81-C83 VanDerWaalsContact C-N 3.31Å; G81-C83 PolarHBondContact O-N 2.81Å
84	C	67.6	Low	71.4	Confident	53 Å²	53	82.6 Å²	82.6	36%	0.358	44%	0.444	S	S	.	.			trans	-128.9	147.8	172.6	-68.7	0	0	0	0	109.4	S86 G87 C89	C84-S86 PolarHBondContact O-N 3.45Å; C84-S86 VanDerWaalsContact O-N 3.1Å; C84-G87 PolarHBondContact O-N 3.29Å; C84-C89 HydrophobicContact CB-CB 3.97Å; C84-C89 WeakPolarHBondContact CB-SG 3.26Å; C84-C89 WeakPolarHBondContact SG-CA 3.47Å; C84-C89 WeakPolarHBondContact SG-CB 3.44Å; C84-C89 CovalentContact SG-SG 2.03Å; C84-C89 PolarHBondContact SG-SG 3.15Å
85	E	60.9	Low	73	Confident	211 Å²	211	77.6 Å²	77.6	99%	0.986	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-29	-177.3	-66.2	-176.4	164.7	0	0	112.5	G87	E85-G87 VanDerWaalsContact C-N 3.35Å
86	S	60.4	Low	74.6	Confident	59 Å²	59	76.8 Å²	76.8	41%	0.413	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	3.1	179.6	-44.4	0	0	0	0	114.3	C84 D88	C84-S86 PolarHBondContact O-N 3.45Å; C84-S86 VanDerWaalsContact O-N 3.1Å; S86-D88 PolarHBondContact O-N 3.13Å; S86-D88 VanDerWaalsContact O-N 3.1Å
87	G	68.1	Low	75.8	Confident	74 Å²	74	69.8 Å²	69.8	76%	0.763	41%	0.405	S	S	*	.	S	Bend	trans	76.3	-21.3	-173.4	0	0	0	0	0	114.9	C84 E85	C84-G87 PolarHBondContact O-N 3.29Å; E85-G87 VanDerWaalsContact C-N 3.35Å
88	D	78.3	Confident	77.4	Confident	25 Å²	25	61.9 Å²	61.9	13%	0.134	37%	0.374	C	S	.	.			trans	-124.3	120.1	175.4	-174.6	-17.3	0	0	0	110.7	S86 R90 I91 P200	S86-D88 PolarHBondContact O-N 3.13Å; S86-D88 VanDerWaalsContact O-N 3.1Å; D88-R90 PolarHBondContact O-N 3.18Å; D88-R90 VanDerWaalsContact OD1-CB 3.29Å; D88-R90 WeakPolarHBondContact OD1-CB 3.46Å; D88-R90 WeakPolarHBondContact OD1-CG 3.28Å; D88-R90 IonicContact OD1-CZ 2.86Å; D88-R90 PolarHBondContact OD1-N 3.42Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.33Å; D88-R90 IonicContact OD1-NH2 3.07Å; D88-R90 IonicContact OD2-CZ 3.33Å; D88-R90 VanDerWaalsContact OD2-CZ 3.3Å; D88-R90 IonicContact OD2-NE 2.73Å; D88-R90 PolarHBondContact OD2-NE 2.82Å; D88-R90 IonicContact OD2-NH2 3.24Å; D88-R90 PolarHBondContact OD2-NH2 3.31Å; D88-I91 HydrophobicContact CB-CD1 4.22Å; D88-I91 PolarHBondContact O-N 2.92Å; D88-P200 HydrophobicContact CB-CG 4.07Å; D88-P200 WeakPolarHBondContact OD2-CD 3.46Å
89	C	82.7	Confident	79.1	Confident	13 Å²	13	61.8 Å²	61.8	9%	0.088	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.6	-178.2	-75	0	0	0	0	116.2	Q82 C84 I91	Q82-C89 HydrophobicContact CB-CB 4.06Å; Q82-C89 WeakPolarHBondContact CB-SG 3.35Å; Q82-C89 HydrophobicContact CG-CB 4.16Å; Q82-C89 PolarHBondContact O-SG 3.16Å; C84-C89 HydrophobicContact CB-CB 3.97Å; C84-C89 WeakPolarHBondContact CB-SG 3.26Å; C84-C89 WeakPolarHBondContact SG-CA 3.47Å; C84-C89 WeakPolarHBondContact SG-CB 3.44Å; C84-C89 CovalentContact SG-SG 2.03Å; C84-C89 PolarHBondContact SG-SG 3.15Å; C89-I91 VanDerWaalsContact C-N 3.32Å
90	R	89.1	Confident	80.7	Confident	54 Å²	54	64.1 Å²	64.1	20%	0.204	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-21.9	171.1	-61.2	174.9	-67	177.1	5.6	111.8	D88 Y157 R158 E164 R198 C199	D88-R90 PolarHBondContact O-N 3.18Å; D88-R90 VanDerWaalsContact OD1-CB 3.29Å; D88-R90 WeakPolarHBondContact OD1-CB 3.46Å; D88-R90 WeakPolarHBondContact OD1-CG 3.28Å; D88-R90 IonicContact OD1-CZ 2.86Å; D88-R90 PolarHBondContact OD1-N 3.42Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.33Å; D88-R90 IonicContact OD1-NH2 3.07Å; D88-R90 IonicContact OD2-CZ 3.33Å; D88-R90 VanDerWaalsContact OD2-CZ 3.3Å; D88-R90 IonicContact OD2-NE 2.73Å; D88-R90 PolarHBondContact OD2-NE 2.82Å; D88-R90 IonicContact OD2-NH2 3.24Å; D88-R90 PolarHBondContact OD2-NH2 3.31Å; R90-Y157 VanDerWaalsContact O-CA 3.29Å; R90-Y157 WeakPolarHBondContact O-CA 3.38Å; R90-R158 PolarHBondContact O-N 3.45Å; R90-E164 IonicContact NH1-OE2 2.77Å; R90-E164 PolarHBondContact NH1-OE2 3.12Å; R90-R198 PolarHBondContact NH2-O 3.33Å; R90-C199 PolarHBondContact NH2-SG 3.1Å
91	I	91.7	Very high	82.3	Confident	9 Å²	9	59.8 Å²	59.8	5%	0.046	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-99.9	129.4	-178.2	-59.3	164.7	0	0	0	109	D88 C89 N93 Y157 P200 Q201	D88-I91 HydrophobicContact CB-CD1 4.22Å; D88-I91 PolarHBondContact O-N 2.92Å; C89-I91 VanDerWaalsContact C-N 3.32Å; I91-N93 WeakPolarHBondContact CG2-ND2 3.42Å; I91-Y157 HydrophobicContact CG1-CD1 4.17Å; I91-Y157 HydrophobicContact CG1-CE1 4.09Å; I91-P200 HydrophobicContact CD1-CG 3.69Å; I91-Q201 HydrophobicContact CD1-CB 3.61Å; I91-Q201 HydrophobicContact CG1-CB 4.38Å
92	T	91.6	Very high	84.2	Confident	75 Å²	75	58.1 Å²	58.1	46%	0.46	34%	0.335	S	S	.	.			trans	-116.3	-35.1	-177.7	-50.8	0	0	0	0	112.2	N94 L156	T92-N94 VanDerWaalsContact C-N 3.3Å; T92-N94 HydrophobicContact CG2-CB 4.21Å; T92-N94 PolarHBondContact O-N 2.81Å; T92-L156 PolarHBondContact N-O 3.49Å
93	N	93.6	Very high	86.1	Confident	29 Å²	29	58.1 Å²	58.1	16%	0.155	34%	0.335	C	S	.	.			trans	49.3	46.1	179	-70	-19.7	0	0	0	114.1	I91 V95 I124 L156 Q201	I91-N93 WeakPolarHBondContact CG2-ND2 3.42Å; N93-V95 PolarHBondContact O-N 3.34Å; N93-I124 HydrophobicContact CB-CD1 4.08Å; N93-I124 HydrophobicContact CB-CG2 4.17Å; N93-L156 PolarHBondContact N-O 3.15Å; N93-Q201 PolarHBondContact ND2-OE1 3.24Å; N93-Q201 PolarHBondContact OD1-NE2 3.39Å; N93-Q201 PolarHBondContact OD1-OE1 2.86Å
94	N	94.9	Very high	87.9	Confident	64 Å²	64	58.9 Å²	58.9	34%	0.342	34%	0.338	S	S	.	.			trans	-79.4	80.5	-178.9	-172.4	1.3	0	0	0	112.1	T92 T96 G97 L98 N155	T92-N94 VanDerWaalsContact C-N 3.3Å; T92-N94 HydrophobicContact CG2-CB 4.21Å; T92-N94 PolarHBondContact O-N 2.81Å; N94-T96 PolarHBondContact O-N 3.02Å; N94-T96 PolarHBondContact OD1-OG1 3.23Å; N94-G97 PolarHBondContact O-N 3.18Å; N94-G97 WeakPolarHBondContact OD1-CA 3.47Å; N94-G97 PolarHBondContact OD1-N 2.03Å; N94-L98 WeakPolarHBondContact O-CB 3.43Å; N94-L98 PolarHBondContact O-N 3.31Å; N94-N155 WeakPolarHBondContact CB-O 3.46Å; N94-N155 PolarHBondContact N-O 3.41Å
95	V	95.3	Very high	89.2	Confident	22 Å²	22	60.5 Å²	60.5	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-66.5	-36.4	-178	-178.5	0	0	0	0	112.6	N93 L98 A99 L117 Q121 I124	N93-V95 PolarHBondContact O-N 3.34Å; V95-L98 WeakPolarHBondContact O-CB 2.93Å; V95-L98 PolarHBondContact O-N 2.94Å; V95-A99 PolarHBondContact O-N 3.46Å; V95-L117 HydrophobicContact CG1-CD1 3.92Å; V95-Q121 HydrophobicContact CG1-CB 3.92Å; V95-Q121 HydrophobicContact CG1-CG 3.99Å; V95-I124 HydrophobicContact CG2-CD1 3.93Å
96	T	96.4	Very high	91	Very high	118 Å²	118	50.7 Å²	50.7	72%	0.724	29%	0.293	S	S	*	.	H	α-helix	trans	-67.3	-40	175.9	19.8	0	0	0	0	111.8	N94 A99 K100	N94-T96 PolarHBondContact O-N 3.02Å; N94-T96 PolarHBondContact OD1-OG1 3.23Å; T96-A99 PolarHBondContact O-N 3.1Å; T96-K100 PolarHBondContact O-N 3.17Å; T96-K100 VanDerWaalsContact O-N 3.13Å
97	G	96.7	Very high	92.7	Very high	14 Å²	14	49.2 Å²	49.2	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-46.1	170.9	0	0	0	0	0	111.8	N94 A99 K100 D101 N155	N94-G97 PolarHBondContact O-N 3.18Å; N94-G97 WeakPolarHBondContact OD1-CA 3.47Å; N94-G97 PolarHBondContact OD1-N 2.03Å; G97-A99 PolarHBondContact O-N 2.91Å; G97-K100 PolarHBondContact O-N 3.32Å; G97-D101 WeakPolarHBondContact O-CB 3.49Å; G97-D101 PolarHBondContact O-N 2.98Å; G97-N155 WeakPolarHBondContact CA-OD1 3.44Å
98	L	97.6	Very high	94	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-47.9	176.6	175.6	62.2	0	0	0	111.8	N94 V95 K100 D101 L102 L117 I120 I151 I152 N155	N94-L98 WeakPolarHBondContact O-CB 3.43Å; N94-L98 PolarHBondContact O-N 3.31Å; V95-L98 WeakPolarHBondContact O-CB 2.93Å; V95-L98 PolarHBondContact O-N 2.94Å; L98-K100 PolarHBondContact O-N 3.22Å; L98-D101 PolarHBondContact O-N 3.27Å; L98-L102 HydrophobicContact CD1-CD1 3.81Å; L98-L102 HydrophobicContact CD1-CG 3.97Å; L98-L102 HydrophobicContact CG-CD1 3.96Å; L98-L102 HydrophobicContact CG-CG 4.49Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 VanDerWaalsContact O-CG 3.28Å; L98-L102 WeakPolarHBondContact O-CG 3.45Å; L98-L102 PolarHBondContact O-N 3.47Å; L98-L117 HydrophobicContact CD2-CD1 4.42Å; L98-L117 HydrophobicContact CG-CD1 4.46Å; L98-I120 HydrophobicContact CD2-CB 4.12Å; L98-I120 HydrophobicContact CD2-CD1 3.81Å; L98-I120 HydrophobicContact CD2-CG2 3.85Å; L98-I151 HydrophobicContact CD1-CG2 3.73Å; L98-I152 HydrophobicContact CD1-CG1 4.24Å; L98-N155 HydrophobicContact CB-CB 3.95Å; L98-N155 PolarHBondContact N-OD1 3.48Å; L98-N155 VanDerWaalsContact N-OD1 3.1Å
99	A	97.4	Very high	95	Very high	31 Å²	31	45.3 Å²	45.3	26%	0.256	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-46.1	178.1	0	0	0	0	0	111.9	V95 T96 G97 Q103 L117	V95-A99 PolarHBondContact O-N 3.46Å; T96-A99 PolarHBondContact O-N 3.1Å; G97-A99 PolarHBondContact O-N 2.91Å; A99-Q103 WeakPolarHBondContact O-CB 3.49Å; A99-Q103 PolarHBondContact O-N 3.39Å; A99-L117 HydrophobicContact CB-CD1 3.79Å; A99-L117 HydrophobicContact CB-CD2 3.75Å; A99-L117 HydrophobicContact CB-CG 4.45Å
100	K	97.8	Very high	95.6	Very high	139 Å²	139	47 Å²	47	60%	0.604	25%	0.251	S	S	*	.	H	α-helix	trans	-64.4	-44.9	178.6	-177.1	-178.6	178.2	-177.1	0	111.8	T96 G97 L98 Q103 T104	T96-K100 PolarHBondContact O-N 3.17Å; T96-K100 VanDerWaalsContact O-N 3.13Å; G97-K100 PolarHBondContact O-N 3.32Å; L98-K100 PolarHBondContact O-N 3.22Å; K100-Q103 PolarHBondContact O-N 3.49Å; K100-T104 HydrophobicContact CG-CG2 4.3Å; K100-T104 WeakPolarHBondContact O-CB 3.5Å; K100-T104 WeakPolarHBondContact O-CG2 3.32Å; K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 PolarHBondContact O-OG1 3.09Å
101	D	97.3	Very high	96	Very high	30 Å²	30	45.1 Å²	45.1	16%	0.16	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-42.9	-179.5	-86.2	-9.5	0	0	0	111.7	G97 L98 T104 K105 I151 N155	G97-D101 WeakPolarHBondContact O-CB 3.49Å; G97-D101 PolarHBondContact O-N 2.98Å; L98-D101 PolarHBondContact O-N 3.27Å; D101-T104 PolarHBondContact O-N 3.33Å; D101-K105 HydrophobicContact CB-CD 4.23Å; D101-K105 WeakPolarHBondContact O-CB 3.49Å; D101-K105 PolarHBondContact O-N 3Å; D101-K105 VanDerWaalsContact OD1-CE 3.28Å; D101-K105 WeakPolarHBondContact OD1-CE 2.94Å; D101-K105 IonicContact OD1-NZ 2.71Å; D101-K105 PolarHBondContact OD1-NZ 3.39Å; D101-K105 IonicContact OD2-NZ 3.57Å; D101-K105 PolarHBondContact OD2-NZ 3.21Å; D101-I151 HydrophobicContact CB-CG2 3.78Å; D101-N155 PolarHBondContact OD2-ND2 3.25Å
102	L	97.3	Very high	96.2	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-44.9	173.7	-72.8	173.3	0	0	0	111.2	L98 L106 Q113 V116 L117 V148 I151	L98-L102 HydrophobicContact CD1-CD1 3.81Å; L98-L102 HydrophobicContact CD1-CG 3.97Å; L98-L102 HydrophobicContact CG-CD1 3.96Å; L98-L102 HydrophobicContact CG-CG 4.49Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 VanDerWaalsContact O-CG 3.28Å; L98-L102 WeakPolarHBondContact O-CG 3.45Å; L98-L102 PolarHBondContact O-N 3.47Å; L102-L106 HydrophobicContact CD2-CD2 4.09Å; L102-L106 WeakPolarHBondContact O-CB 3.06Å; L102-L106 PolarHBondContact O-N 3.21Å; L102-Q113 HydrophobicContact CB-CG 4.28Å; L102-Q113 PolarHBondContact O-NE2 3.22Å; L102-V116 HydrophobicContact CD1-CB 4.45Å; L102-V116 HydrophobicContact CD1-CG1 4.15Å; L102-L117 HydrophobicContact CD1-CB 4.48Å; L102-V148 HydrophobicContact CD2-CG1 4.17Å; L102-V148 HydrophobicContact CD2-CG2 4.43Å; L102-I151 HydrophobicContact CD2-CG2 4.2Å; L102-I151 HydrophobicContact CG-CG2 4.29Å
103	Q	96	Very high	96.4	Very high	144 Å²	144	43.7 Å²	43.7	67%	0.673	23%	0.233	S	C	*	.	H	α-helix	trans	-67.4	-38.9	-179.1	-172	179.1	24.4	0	0	113.1	A99 K100	A99-Q103 WeakPolarHBondContact O-CB 3.49Å; A99-Q103 PolarHBondContact O-N 3.39Å; K100-Q103 PolarHBondContact O-N 3.49Å
104	T	95.1	Very high	96.3	Very high	71 Å²	71	44.9 Å²	44.9	44%	0.436	24%	0.243	S	C	.	.	H	α-helix	trans	-89.6	-32.8	-171.9	54.9	0	0	0	0	113.6	K100 D101 H107	K100-T104 HydrophobicContact CG-CG2 4.3Å; K100-T104 WeakPolarHBondContact O-CB 3.5Å; K100-T104 WeakPolarHBondContact O-CG2 3.32Å; K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 PolarHBondContact O-OG1 3.09Å; D101-T104 PolarHBondContact O-N 3.33Å; T104-H107 PolarHBondContact O-CE1 2.71Å
105	K	95.7	Very high	96.4	Very high	86 Å²	86	43.1 Å²	43.1	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-104.6	-24.4	-172.8	-56.8	170.2	176.4	161.7	0	113.6	D101 F147 I151	D101-K105 HydrophobicContact CB-CD 4.23Å; D101-K105 WeakPolarHBondContact O-CB 3.49Å; D101-K105 PolarHBondContact O-N 3Å; D101-K105 VanDerWaalsContact OD1-CE 3.28Å; D101-K105 WeakPolarHBondContact OD1-CE 2.94Å; D101-K105 IonicContact OD1-NZ 2.71Å; D101-K105 PolarHBondContact OD1-NZ 3.39Å; D101-K105 IonicContact OD2-NZ 3.57Å; D101-K105 PolarHBondContact OD2-NZ 3.21Å; K105-F147 HydrophobicContact CB-CE1 3.87Å; K105-F147 HydrophobicContact CB-CZ 3.83Å; K105-F147 HydrophobicContact CD-CZ 4.47Å; K105-F147 WeakPolarHBondContact O-CE1 3.44Å; K105-I151 HydrophobicContact CB-CD1 4.34Å
106	L	97.4	Very high	96.5	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	23%	0.229	C	C	.	.			trans	-98.5	103.7	-176.2	-174.8	68.9	0	0	0	111.5	L102 Q109 V112 Q113 F147 V148	L102-L106 HydrophobicContact CD2-CD2 4.09Å; L102-L106 WeakPolarHBondContact O-CB 3.06Å; L102-L106 PolarHBondContact O-N 3.21Å; L106-Q109 HydrophobicContact CD1-CB 4.33Å; L106-Q109 HydrophobicContact CD1-CG 4Å; L106-Q109 HydrophobicContact CD2-CB 3.74Å; L106-Q109 HydrophobicContact CD2-CG 4.31Å; L106-Q109 HydrophobicContact CG-CB 3.85Å; L106-Q109 HydrophobicContact CG-CG 4.04Å; L106-V112 HydrophobicContact CD2-CB 4.09Å; L106-V112 HydrophobicContact CD2-CG1 3.89Å; L106-Q113 HydrophobicContact CD2-CG 4.05Å; L106-Q113 PolarHBondContact O-NE2 2.94Å; L106-F147 HydrophobicContact CD1-CD1 4.36Å; L106-V148 HydrophobicContact CD1-CG2 3.59Å; L106-V148 HydrophobicContact CD2-CG2 3.59Å; L106-V148 HydrophobicContact CG-CG2 4.19Å
107	H	97	Very high	96.5	Very high	29 Å²	29	38.6 Å²	38.6	13%	0.134	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	135.6	-176.7	-56	-55.6	0	0	0	113	T104 Q109 H312 L315 D319	T104-H107 PolarHBondContact O-CE1 2.71Å; H107-Q109 VanDerWaalsContact C-N 3.33Å; H107-Q109 PolarHBondContact O-N 2.87Å; H107-H312 HydrophobicContact CB-CB 4.39Å; H107-L315 HydrophobicContact CB-CB 4.36Å; H107-L315 HydrophobicContact CB-CD1 4.18Å; H107-D319 IonicContact CD2-OD2 3.93Å; H107-D319 IonicContact CE1-OD2 3.76Å; H107-D319 IonicContact NE2-OD2 3.03Å; H107-D319 PolarHBondContact NE2-OD2 3.04Å
108	G	96.2	Very high	96.5	Very high	16 Å²	16	45.1 Å²	45.1	17%	0.165	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	19	169.3	0	0	0	0	0	115.9	R265 H312	G108-R265 PolarHBondContact O-NE 3.13Å; G108-R265 PolarHBondContact O-NH2 3.35Å; G108-H312 VanDerWaalsContact CA-CD2 3.44Å; G108-H312 WeakPolarHBondContact CA-CD2 3.36Å; G108-H312 VanDerWaalsContact CA-NE2 3.27Å; G108-H312 WeakPolarHBondContact CA-NE2 3.18Å
109	Q	97.7	Very high	96.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.232	C	C	.	.			trans	-126.3	60.3	-177.3	-56.6	-60.5	-13.7	0	0	112	L106 H107 L111 V112 Q113 T143 F305 L306	L106-Q109 HydrophobicContact CD1-CB 4.33Å; L106-Q109 HydrophobicContact CD1-CG 4Å; L106-Q109 HydrophobicContact CD2-CB 3.74Å; L106-Q109 HydrophobicContact CD2-CG 4.31Å; L106-Q109 HydrophobicContact CG-CB 3.85Å; L106-Q109 HydrophobicContact CG-CG 4.04Å; H107-Q109 VanDerWaalsContact C-N 3.33Å; H107-Q109 PolarHBondContact O-N 2.87Å; Q109-L111 VanDerWaalsContact C-N 3.33Å; Q109-L111 PolarHBondContact O-N 3.1Å; Q109-V112 HydrophobicContact CB-CB 3.93Å; Q109-V112 HydrophobicContact CB-CG2 3.8Å; Q109-V112 HydrophobicContact CG-CG2 4.42Å; Q109-V112 PolarHBondContact O-N 3.17Å; Q109-Q113 WeakPolarHBondContact O-CG 3.46Å; Q109-Q113 PolarHBondContact O-N 3.25Å; Q109-Q113 VanDerWaalsContact O-N 3.14Å; Q109-T143 PolarHBondContact NE2-O 3.18Å; Q109-F305 HydrophobicContact CG-CD1 4.34Å; Q109-L306 PolarHBondContact NE2-O 2.85Å
110	H	96.6	Very high	96.4	Very high	49 Å²	49	43.9 Å²	43.9	23%	0.227	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-39.4	-177.4	62.6	-66.3	0	0	0	112.8	Q113 S114 R265 E266 I268	H110-Q113 PolarHBondContact O-N 2.93Å; H110-S114 PolarHBondContact O-N 3.42Å; H110-R265 PolarHBondContact CE1-O 2.93Å; H110-E266 PolarHBondContact NE2-O 3.45Å; H110-I268 PolarHBondContact NE2-O 3.01Å
111	L	96.2	Very high	96.3	Very high	13 Å²	13	41.2 Å²	41.2	7%	0.068	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-49.7	175.7	-65.4	177.5	0	0	0	111.5	Q109 Q113 S114 V115 I268 L273 P304 L306	Q109-L111 VanDerWaalsContact C-N 3.33Å; Q109-L111 PolarHBondContact O-N 3.1Å; L111-Q113 PolarHBondContact O-N 3.1Å; L111-S114 PolarHBondContact O-N 2.99Å; L111-S114 PolarHBondContact O-OG 3.03Å; L111-V115 WeakPolarHBondContact O-CG2 3.35Å; L111-V115 PolarHBondContact O-N 2.9Å; L111-I268 HydrophobicContact CD1-CG2 4.43Å; L111-I268 WeakPolarHBondContact CD2-O 3.35Å; L111-L273 HydrophobicContact CD1-CD1 3.57Å; L111-P304 HydrophobicContact CB-CG 4.48Å; L111-P304 HydrophobicContact CD1-CG 3.9Å; L111-L306 HydrophobicContact CD1-CD1 4.32Å
112	V	97	Very high	96.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-47.8	-179.5	-176.9	0	0	0	0	111.5	L106 Q109 S114 V115 V116 V148 V303 P304 F305	L106-V112 HydrophobicContact CD2-CB 4.09Å; L106-V112 HydrophobicContact CD2-CG1 3.89Å; Q109-V112 HydrophobicContact CB-CB 3.93Å; Q109-V112 HydrophobicContact CB-CG2 3.8Å; Q109-V112 HydrophobicContact CG-CG2 4.42Å; Q109-V112 PolarHBondContact O-N 3.17Å; V112-S114 VanDerWaalsContact C-N 3.27Å; V112-S114 PolarHBondContact O-N 3.07Å; V112-V115 PolarHBondContact O-N 3.37Å; V112-V116 HydrophobicContact CG1-CG2 3.82Å; V112-V116 VanDerWaalsContact O-CB 3.29Å; V112-V116 WeakPolarHBondContact O-CB 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.43Å; V112-V116 PolarHBondContact O-N 3.2Å; V112-V148 HydrophobicContact CG1-CG1 4.16Å; V112-V148 HydrophobicContact CG1-CG2 4.15Å; V112-V303 HydrophobicContact CB-CG1 4.14Å; V112-V303 HydrophobicContact CG1-CG1 3.92Å; V112-V303 HydrophobicContact CG2-CG1 3.92Å; V112-P304 VanDerWaalsContact CG2-O 3.25Å; V112-P304 WeakPolarHBondContact CG2-O 3.37Å; V112-F305 HydrophobicContact CB-CZ 4.46Å; V112-F305 HydrophobicContact CG1-CE1 4.07Å; V112-F305 HydrophobicContact CG1-CE2 4.22Å; V112-F305 HydrophobicContact CG1-CZ 3.68Å; V112-F305 HydrophobicContact CG2-CD1 4.01Å; V112-F305 HydrophobicContact CG2-CD2 3.99Å; V112-F305 HydrophobicContact CG2-CE1 3.96Å; V112-F305 HydrophobicContact CG2-CE2 3.91Å; V112-F305 HydrophobicContact CG2-CG 4.03Å; V112-F305 HydrophobicContact CG2-CZ 3.91Å
113	Q	94.3	Very high	96.1	Very high	54 Å²	54	42.3 Å²	42.3	25%	0.252	22%	0.224	S	C	.	.	H	α-helix	trans	-56.6	-43.9	-179.7	-66.9	178.6	10.1	0	0	111.3	L102 L106 Q109 H110 L111 L117	L102-Q113 HydrophobicContact CB-CG 4.28Å; L102-Q113 PolarHBondContact O-NE2 3.22Å; L106-Q113 HydrophobicContact CD2-CG 4.05Å; L106-Q113 PolarHBondContact O-NE2 2.94Å; Q109-Q113 WeakPolarHBondContact O-CG 3.46Å; Q109-Q113 PolarHBondContact O-N 3.25Å; Q109-Q113 VanDerWaalsContact O-N 3.14Å; H110-Q113 PolarHBondContact O-N 2.93Å; L111-Q113 PolarHBondContact O-N 3.1Å; Q113-L117 VanDerWaalsContact O-CB 3.25Å; Q113-L117 WeakPolarHBondContact O-CB 3.42Å; Q113-L117 PolarHBondContact O-N 3.24Å
114	S	92.8	Very high	96	Very high	54 Å²	54	36.7 Å²	36.7	38%	0.378	20%	0.199	S	C	.	.	H	α-helix	trans	-71.3	-42.9	-177.6	75.3	0	0	0	0	113.3	H110 L111 V112 K118	H110-S114 PolarHBondContact O-N 3.42Å; L111-S114 PolarHBondContact O-N 2.99Å; L111-S114 PolarHBondContact O-OG 3.03Å; V112-S114 VanDerWaalsContact C-N 3.27Å; V112-S114 PolarHBondContact O-N 3.07Å; S114-K118 WeakPolarHBondContact O-CB 3.47Å; S114-K118 WeakPolarHBondContact O-CD 3.38Å; S114-K118 VanDerWaalsContact O-CG 3.27Å; S114-K118 WeakPolarHBondContact O-CG 3.45Å; S114-K118 PolarHBondContact O-N 3.39Å
115	V	96	Very high	95.9	Very high	28 Å²	28	38.6 Å²	38.6	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-75	-49.5	-175.4	175.3	0	0	0	0	110.8	L111 V112 L117 K118 A119 F301 V303	L111-V115 WeakPolarHBondContact O-CG2 3.35Å; L111-V115 PolarHBondContact O-N 2.9Å; V112-V115 PolarHBondContact O-N 3.37Å; V115-L117 PolarHBondContact O-N 3.24Å; V115-K118 PolarHBondContact O-N 3.35Å; V115-A119 VanDerWaalsContact O-CB 3.25Å; V115-A119 WeakPolarHBondContact O-CB 3.41Å; V115-A119 PolarHBondContact O-N 2.89Å; V115-F301 HydrophobicContact CG1-CB 3.99Å; V115-F301 HydrophobicContact CG1-CD1 4.13Å; V115-F301 HydrophobicContact CG1-CG 4.26Å; V115-V303 HydrophobicContact CG1-CG2 3.89Å
116	V	97.4	Very high	95.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.2	-44.3	-176.5	171.1	0	0	0	0	111.2	L102 V112 A119 I120 F137 V148 I152 V303	L102-V116 HydrophobicContact CD1-CB 4.45Å; L102-V116 HydrophobicContact CD1-CG1 4.15Å; V112-V116 HydrophobicContact CG1-CG2 3.82Å; V112-V116 VanDerWaalsContact O-CB 3.29Å; V112-V116 WeakPolarHBondContact O-CB 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.43Å; V112-V116 PolarHBondContact O-N 3.2Å; V116-A119 PolarHBondContact O-N 3.16Å; V116-I120 HydrophobicContact CG1-CD1 3.67Å; V116-I120 WeakPolarHBondContact O-CB 3.24Å; V116-I120 WeakPolarHBondContact O-CG1 3.45Å; V116-I120 PolarHBondContact O-N 2.92Å; V116-F137 HydrophobicContact CG2-CE1 4.09Å; V116-F137 HydrophobicContact CG2-CZ 4.05Å; V116-V148 HydrophobicContact CG1-CG1 4.46Å; V116-V148 HydrophobicContact CG2-CG1 4.34Å; V116-I152 HydrophobicContact CG1-CD1 3.7Å; V116-I152 HydrophobicContact CG1-CG1 3.98Å; V116-V303 HydrophobicContact CG2-CG1 4.11Å
117	L	96.9	Very high	94.9	Very high	44 Å²	44	42 Å²	42	23%	0.23	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-48.5	179.9	-179.2	60.8	0	0	0	111.3	V95 L98 A99 L102 Q113 V115 Q121	V95-L117 HydrophobicContact CG1-CD1 3.92Å; L98-L117 HydrophobicContact CD2-CD1 4.42Å; L98-L117 HydrophobicContact CG-CD1 4.46Å; A99-L117 HydrophobicContact CB-CD1 3.79Å; A99-L117 HydrophobicContact CB-CD2 3.75Å; A99-L117 HydrophobicContact CB-CG 4.45Å; L102-L117 HydrophobicContact CD1-CB 4.48Å; Q113-L117 VanDerWaalsContact O-CB 3.25Å; Q113-L117 WeakPolarHBondContact O-CB 3.42Å; Q113-L117 PolarHBondContact O-N 3.24Å; V115-L117 PolarHBondContact O-N 3.24Å; L117-Q121 WeakPolarHBondContact O-CB 3.4Å; L117-Q121 PolarHBondContact O-N 3.44Å
118	K	96.5	Very high	94.2	Very high	152 Å²	152	47.3 Å²	47.3	66%	0.661	26%	0.258	S	S	*	.	H	α-helix	trans	-64.2	-43.5	179.5	-72.5	176.9	-177.9	178.1	0	112.2	S114 V115 G122	S114-K118 WeakPolarHBondContact O-CB 3.47Å; S114-K118 WeakPolarHBondContact O-CD 3.38Å; S114-K118 VanDerWaalsContact O-CG 3.27Å; S114-K118 WeakPolarHBondContact O-CG 3.45Å; S114-K118 PolarHBondContact O-N 3.39Å; V115-K118 PolarHBondContact O-N 3.35Å; K118-G122 PolarHBondContact O-N 3.49Å
119	A	96.6	Very high	93.7	Very high	5 Å²	5	47.7 Å²	47.7	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-49.2	-178.9	0	0	0	0	0	111.7	V115 V116 G122 F123 L133 L135 F301	V115-A119 VanDerWaalsContact O-CB 3.25Å; V115-A119 WeakPolarHBondContact O-CB 3.41Å; V115-A119 PolarHBondContact O-N 2.89Å; V116-A119 PolarHBondContact O-N 3.16Å; A119-G122 PolarHBondContact O-N 2.77Å; A119-F123 WeakPolarHBondContact O-CB 3.41Å; A119-F123 PolarHBondContact O-N 3.02Å; A119-L133 HydrophobicContact CB-CD1 4.36Å; A119-L135 HydrophobicContact CB-CD2 3.93Å; A119-F301 HydrophobicContact CB-CD2 3.56Å; A119-F301 HydrophobicContact CB-CE2 3.54Å; A119-F301 HydrophobicContact CB-CG 4.14Å; A119-F301 HydrophobicContact CB-CZ 4.11Å
120	I	96.7	Very high	93.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68	-44.7	-179.9	-69.9	173.7	0	0	0	111	L98 V116 G122 F123 I124 L133 L135 I152 L156	L98-I120 HydrophobicContact CD2-CB 4.12Å; L98-I120 HydrophobicContact CD2-CD1 3.81Å; L98-I120 HydrophobicContact CD2-CG2 3.85Å; V116-I120 HydrophobicContact CG1-CD1 3.67Å; V116-I120 WeakPolarHBondContact O-CB 3.24Å; V116-I120 WeakPolarHBondContact O-CG1 3.45Å; V116-I120 PolarHBondContact O-N 2.92Å; I120-G122 VanDerWaalsContact C-N 3.34Å; I120-G122 PolarHBondContact O-N 3.13Å; I120-F123 PolarHBondContact O-N 2.71Å; I120-I124 HydrophobicContact CG2-CD1 3.53Å; I120-I124 HydrophobicContact CG2-CG1 4.31Å; I120-I124 WeakPolarHBondContact O-CB 3.23Å; I120-I124 VanDerWaalsContact O-CG1 3.31Å; I120-I124 WeakPolarHBondContact O-CG1 3.31Å; I120-I124 PolarHBondContact O-N 3.44Å; I120-L133 HydrophobicContact CG1-CD2 4.17Å; I120-L135 HydrophobicContact CG1-CD1 4.48Å; I120-I152 HydrophobicContact CD1-CB 4.24Å; I120-I152 HydrophobicContact CD1-CD1 3.82Å; I120-I152 HydrophobicContact CD1-CG1 3.6Å; I120-I152 HydrophobicContact CD1-CG2 3.66Å; I120-L156 HydrophobicContact CG2-CD1 4.34Å; I120-L156 HydrophobicContact CG2-CD2 3.94Å
121	Q	95.9	Very high	92.9	Very high	83 Å²	83	50.5 Å²	50.5	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-61	-44.7	177.6	-176.7	174.3	28.6	0	0	111.4	V95 L117 F123 I124 N125	V95-Q121 HydrophobicContact CG1-CB 3.92Å; V95-Q121 HydrophobicContact CG1-CG 3.99Å; L117-Q121 WeakPolarHBondContact O-CB 3.4Å; L117-Q121 PolarHBondContact O-N 3.44Å; Q121-F123 PolarHBondContact O-N 3.24Å; Q121-I124 PolarHBondContact O-N 3.16Å; Q121-N125 VanDerWaalsContact O-CB 3.24Å; Q121-N125 WeakPolarHBondContact O-CB 3.47Å; Q121-N125 PolarHBondContact O-N 3.12Å; Q121-N125 PolarHBondContact O-ND2 3.2Å
122	G	95.3	Very high	92.8	Very high	42 Å²	42	50 Å²	50	43%	0.433	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-42.9	177	0	0	0	0	0	112.5	K118 A119 I120 N126	K118-G122 PolarHBondContact O-N 3.49Å; A119-G122 PolarHBondContact O-N 2.77Å; I120-G122 VanDerWaalsContact C-N 3.34Å; I120-G122 PolarHBondContact O-N 3.13Å; G122-N126 WeakPolarHBondContact O-CB 3.48Å; G122-N126 PolarHBondContact O-N 2.87Å; G122-N126 VanDerWaalsContact O-N 3.16Å
123	F	95.1	Very high	92.8	Very high	12 Å²	12	50.3 Å²	50.3	5%	0.053	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-42.6	178.2	-178.7	-106.8	0	0	0	113.1	A119 I120 Q121 N126 L133 R236 A238 I239	A119-F123 WeakPolarHBondContact O-CB 3.41Å; A119-F123 PolarHBondContact O-N 3.02Å; I120-F123 PolarHBondContact O-N 2.71Å; Q121-F123 PolarHBondContact O-N 3.24Å; F123-N126 PolarHBondContact O-N 2.87Å; F123-L133 HydrophobicContact CB-CB 4.24Å; F123-L133 HydrophobicContact CB-CD2 3.88Å; F123-L133 HydrophobicContact CB-CG 4.47Å; F123-L133 HydrophobicContact CD1-CB 4.05Å; F123-L133 HydrophobicContact CD1-CD2 4.26Å; F123-L133 HydrophobicContact CD2-CB 3.6Å; F123-L133 HydrophobicContact CE1-CB 4.27Å; F123-L133 HydrophobicContact CE2-CB 3.82Å; F123-L133 HydrophobicContact CG-CB 3.69Å; F123-L133 HydrophobicContact CG-CD2 4.07Å; F123-L133 HydrophobicContact CG-CG 4.41Å; F123-L133 HydrophobicContact CZ-CB 4.14Å; F123-R236 WeakPolarHBondContact CE2-O 3.3Å; F123-R236 WeakPolarHBondContact CZ-O 3.33Å; F123-A238 WeakPolarHBondContact CZ-O 3.3Å; F123-I239 HydrophobicContact CD1-CD1 4.07Å; F123-I239 HydrophobicContact CD1-CG1 3.96Å; F123-I239 HydrophobicContact CE1-CD1 3.9Å; F123-I239 HydrophobicContact CE1-CG1 3.47Å; F123-I239 VanDerWaalsContact CE1-CG1 3.47Å; F123-I239 HydrophobicContact CZ-CG1 4.19Å
124	I	93.2	Very high	92.9	Very high	26 Å²	26	47.7 Å²	47.7	13%	0.133	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-41.3	178.6	-69.6	169.1	0	0	0	110.9	N93 V95 I120 Q121 N126 L156	N93-I124 HydrophobicContact CB-CD1 4.08Å; N93-I124 HydrophobicContact CB-CG2 4.17Å; V95-I124 HydrophobicContact CG2-CD1 3.93Å; I120-I124 HydrophobicContact CG2-CD1 3.53Å; I120-I124 HydrophobicContact CG2-CG1 4.31Å; I120-I124 WeakPolarHBondContact O-CB 3.23Å; I120-I124 VanDerWaalsContact O-CG1 3.31Å; I120-I124 WeakPolarHBondContact O-CG1 3.31Å; I120-I124 PolarHBondContact O-N 3.44Å; Q121-I124 PolarHBondContact O-N 3.16Å; I124-N126 PolarHBondContact O-N 3.32Å; I124-L156 HydrophobicContact CD1-CD2 3.51Å
125	N	92.8	Very high	93	Very high	111 Å²	111	45.1 Å²	45.1	59%	0.594	24%	0.244	S	C	*	.	H	α-helix	trans	-74.7	-12.3	-178.7	-68.2	-8.2	0	0	0	113.4	Q121 P127	Q121-N125 VanDerWaalsContact O-CB 3.24Å; Q121-N125 WeakPolarHBondContact O-CB 3.47Å; Q121-N125 PolarHBondContact O-N 3.12Å; Q121-N125 PolarHBondContact O-ND2 3.2Å; N125-P127 VanDerWaalsContact O-CD 3.29Å; N125-P127 WeakPolarHBondContact O-CD 3.41Å
126	N	91.6	Very high	92.9	Very high	77 Å²	77	43.9 Å²	43.9	41%	0.412	24%	0.236	S	C	.	.			trans	-113.1	84.7	177.4	-173.6	14.1	0	0	0	111	G122 F123 I124 E128 S129	G122-N126 WeakPolarHBondContact O-CB 3.48Å; G122-N126 PolarHBondContact O-N 2.87Å; G122-N126 VanDerWaalsContact O-N 3.16Å; F123-N126 PolarHBondContact O-N 2.87Å; I124-N126 PolarHBondContact O-N 3.32Å; N126-E128 PolarHBondContact O-N 3.01Å; N126-E128 PolarHBondContact OD1-N 3.01Å; N126-S129 PolarHBondContact O-N 2.98Å
127	P	81	Confident	92.9	Very high	87 Å²	87	43.9 Å²	43.9	57%	0.565	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.3	179.5	26.4	-33.8	0	0	0	113	N125 S129	N125-P127 VanDerWaalsContact O-CD 3.29Å; N125-P127 WeakPolarHBondContact O-CD 3.41Å; P127-S129 PolarHBondContact O-N 2.93Å
128	E	82.9	Confident	92.7	Very high	140 Å²	140	42 Å²	42	65%	0.654	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	25.9	179.3	-62.4	-61.4	148.5	0	0	112.7	N126 N130	N126-E128 PolarHBondContact O-N 3.01Å; N126-E128 PolarHBondContact OD1-N 3.01Å; E128-N130 PolarHBondContact O-N 2.96Å
129	S	85.6	Confident	92.5	Very high	23 Å²	23	34.8 Å²	34.8	16%	0.161	19%	0.194	C	C	.	.			trans	-59.1	127.2	175.9	-171.2	0	0	0	0	110.4	N126 P127 K131 R236	N126-S129 PolarHBondContact O-N 2.98Å; P127-S129 PolarHBondContact O-N 2.93Å; S129-K131 PolarHBondContact O-N 3.4Å; S129-K131 PolarHBondContact OG-O 3.2Å; S129-R236 WeakPolarHBondContact O-CB 3.5Å; S129-R236 WeakPolarHBondContact O-CD 3.41Å
130	N	86.1	Confident	92.3	Very high	96 Å²	96	38.3 Å²	38.3	51%	0.513	21%	0.207	S	C	.	.	S	Bend	trans	-79.2	-3.1	178.3	-67.3	-32.7	0	0	0	113.2	E128 R236	E128-N130 PolarHBondContact O-N 2.96Å; N130-R236 PolarHBondContact OD1-NH1 3.39Å
131	K	91.3	Very high	92.1	Very high	13 Å²	13	40.6 Å²	40.6	6%	0.057	22%	0.221	C	C	.	.	S	Bend	trans	-143.8	143.4	-177.3	-167.7	-165.2	-179.8	-172.8	0	110.4	S129 M224 H297 L298 D300	S129-K131 PolarHBondContact O-N 3.4Å; S129-K131 PolarHBondContact OG-O 3.2Å; K131-M224 WeakPolarHBondContact CE-O 3.46Å; K131-H297 PolarHBondContact NZ-O 3.29Å; K131-L298 WeakPolarHBondContact CE-O 3.36Å; K131-L298 VanDerWaalsContact NZ-C 3.32Å; K131-L298 PolarHBondContact NZ-O 3.2Å; K131-D300 WeakPolarHBondContact CD-OD1 3.28Å; K131-D300 WeakPolarHBondContact CE-OD1 3.3Å; K131-D300 IonicContact NZ-OD1 3.38Å; K131-D300 PolarHBondContact NZ-OD1 3.18Å
132	P	94.6	Very high	92.1	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.013	21%	0.214	C	C	.	.			trans	-59.6	148.6	165.8	24.9	-35.6	0	0	0	112.3	T134 Y223 Y235 A238 F240	P132-T134 PolarHBondContact O-N 2.75Å; P132-Y223 WeakPolarHBondContact CG-O 3.25Å; P132-Y235 WeakPolarHBondContact CB-O 3.31Å; P132-A238 WeakPolarHBondContact CA-O 3.28Å; P132-A238 HydrophobicContact CB-CB 4.26Å; P132-A238 WeakPolarHBondContact CB-O 3.38Å; P132-F240 HydrophobicContact CB-CD2 3.98Å; P132-F240 HydrophobicContact CB-CE2 3.86Å; P132-F240 HydrophobicContact CG-CD2 4.44Å; P132-F240 HydrophobicContact CG-CE2 4.17Å
133	L	96.2	Very high	92.2	Very high	7 Å²	7	36 Å²	36	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	121.7	174.9	176.3	64.4	0	0	0	110.3	A119 I120 F123 L135 A238 I239 F240 F301	A119-L133 HydrophobicContact CB-CD1 4.36Å; I120-L133 HydrophobicContact CG1-CD2 4.17Å; F123-L133 HydrophobicContact CB-CB 4.24Å; F123-L133 HydrophobicContact CB-CD2 3.88Å; F123-L133 HydrophobicContact CB-CG 4.47Å; F123-L133 HydrophobicContact CD1-CB 4.05Å; F123-L133 HydrophobicContact CD1-CD2 4.26Å; F123-L133 HydrophobicContact CD2-CB 3.6Å; F123-L133 HydrophobicContact CE1-CB 4.27Å; F123-L133 HydrophobicContact CE2-CB 3.82Å; F123-L133 HydrophobicContact CG-CB 3.69Å; F123-L133 HydrophobicContact CG-CD2 4.07Å; F123-L133 HydrophobicContact CG-CG 4.41Å; F123-L133 HydrophobicContact CZ-CB 4.14Å; L133-L135 HydrophobicContact CD1-CD2 3.98Å; L133-L135 HydrophobicContact CD1-CG 4.43Å; L133-L135 HydrophobicContact CD2-CD1 4.39Å; L133-L135 HydrophobicContact CD2-CG 4.36Å; L133-L135 HydrophobicContact CG-CD2 4.27Å; L133-L135 HydrophobicContact CG-CG 4.18Å; L133-A238 PolarHBondContact N-O 2.84Å; L133-A238 VanDerWaalsContact N-O 3.11Å; L133-I239 HydrophobicContact CB-CG1 4.38Å; L133-I239 HydrophobicContact CB-CG2 4.41Å; L133-I239 HydrophobicContact CD2-CG2 4.15Å; L133-I239 HydrophobicContact CG-CG2 4.38Å; L133-I239 CarbonylContact O-C 3.37Å; L133-I239 WeakPolarHBondContact O-CA 3.32Å; L133-F240 PolarHBondContact O-N 2.99Å; L133-F301 HydrophobicContact CD1-CD2 3.98Å; L133-F301 HydrophobicContact CD1-CE2 3.97Å
134	T	95.8	Very high	92.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	114	176.1	-59.7	0	0	0	0	111.3	P132 M224 F240 F242 L298 I299 D300 F301	P132-T134 PolarHBondContact O-N 2.75Å; T134-M224 HydrophobicContact CG2-CE 3.32Å; T134-F240 WeakPolarHBondContact CA-O 3.28Å; T134-F240 HydrophobicContact CG2-CB 4.39Å; T134-F242 HydrophobicContact CG2-CD2 4.12Å; T134-F242 HydrophobicContact CG2-CE2 3.89Å; T134-L298 VanDerWaalsContact CB-O 3.28Å; T134-L298 WeakPolarHBondContact CB-O 3.43Å; T134-L298 PolarHBondContact OG1-O 3.1Å; T134-I299 HydrophobicContact CG2-CB 4.27Å; T134-I299 HydrophobicContact CG2-CG1 3.92Å; T134-D300 PolarHBondContact N-OD2 3.5Å; T134-D300 PolarHBondContact O-N 2.94Å; T134-F301 PolarHBondContact O-N 2.91Å
135	L	96.1	Very high	92.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.9	174.6	-56.4	179.1	0	0	0	110.4	A119 I120 L133 F137 F240 I241 F242 F301	A119-L135 HydrophobicContact CB-CD2 3.93Å; I120-L135 HydrophobicContact CG1-CD1 4.48Å; L133-L135 HydrophobicContact CD1-CD2 3.98Å; L133-L135 HydrophobicContact CD1-CG 4.43Å; L133-L135 HydrophobicContact CD2-CD1 4.39Å; L133-L135 HydrophobicContact CD2-CG 4.36Å; L133-L135 HydrophobicContact CG-CD2 4.27Å; L133-L135 HydrophobicContact CG-CG 4.18Å; L135-F137 HydrophobicContact CB-CD1 4.34Å; L135-F137 HydrophobicContact CB-CE1 3.81Å; L135-F137 HydrophobicContact CD1-CE1 4.13Å; L135-F137 HydrophobicContact CD1-CZ 4.35Å; L135-F240 PolarHBondContact N-O 2.74Å; L135-I241 HydrophobicContact CB-CG1 4.43Å; L135-I241 HydrophobicContact CD1-CG1 4.44Å; L135-I241 CarbonylContact O-C 3.53Å; L135-I241 WeakPolarHBondContact O-CA 3.22Å; L135-F242 PolarHBondContact O-N 2.89Å; L135-F301 HydrophobicContact CD2-CB 3.76Å; L135-F301 HydrophobicContact CD2-CD2 3.73Å; L135-F301 HydrophobicContact CD2-CG 4.15Å
136	S	94.1	Very high	92.6	Very high	1 Å²	1	34 Å²	34	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.4	173.5	-160.8	0	0	0	0	110.8	H138 F301 V303	S136-H138 WeakPolarHBondContact CB-NE2 3.34Å; S136-H138 PolarHBondContact O-CD2 3.22Å; S136-H138 PolarHBondContact OG-CD2 3.19Å; S136-H138 PolarHBondContact OG-NE2 3.28Å; S136-F301 PolarHBondContact N-O 3.07Å; S136-V303 PolarHBondContact O-N 2.81Å
137	F	96.1	Very high	92.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.8	-175.5	-66.9	2.3	0	0	0	109.9	V116 L135 K145 V148 I152 I241 F242 L243 S244 V303 F305	V116-F137 HydrophobicContact CG2-CE1 4.09Å; V116-F137 HydrophobicContact CG2-CZ 4.05Å; L135-F137 HydrophobicContact CB-CD1 4.34Å; L135-F137 HydrophobicContact CB-CE1 3.81Å; L135-F137 HydrophobicContact CD1-CE1 4.13Å; L135-F137 HydrophobicContact CD1-CZ 4.35Å; F137-K145 HydrophobicContact CB-CB 4.46Å; F137-K145 HydrophobicContact CB-CD 4.26Å; F137-K145 HydrophobicContact CB-CG 4.29Å; F137-V148 HydrophobicContact CE2-CB 4.06Å; F137-V148 HydrophobicContact CE2-CG1 3.73Å; F137-V148 HydrophobicContact CZ-CG1 3.96Å; F137-I152 HydrophobicContact CE2-CD1 4.29Å; F137-I152 HydrophobicContact CZ-CD1 3.8Å; F137-I241 HydrophobicContact CD2-CG2 4.09Å; F137-I241 HydrophobicContact CE1-CG2 4.37Å; F137-I241 HydrophobicContact CE2-CG2 3.88Å; F137-I241 HydrophobicContact CG-CG2 4.39Å; F137-I241 HydrophobicContact CZ-CG2 4.04Å; F137-F242 PolarHBondContact N-O 3.36Å; F137-L243 HydrophobicContact CB-CD2 3.8Å; F137-L243 HydrophobicContact CD2-CD2 3.31Å; F137-L243 HydrophobicContact CE2-CD2 4.11Å; F137-L243 HydrophobicContact CG-CD2 3.82Å; F137-S244 PolarHBondContact O-N 3.12Å; F137-V303 WeakPolarHBondContact CA-O 3.42Å; F137-V303 HydrophobicContact CD1-CB 3.62Å; F137-V303 HydrophobicContact CD1-CG1 4.11Å; F137-V303 HydrophobicContact CD1-CG2 3.85Å; F137-V303 HydrophobicContact CE1-CB 4Å; F137-V303 HydrophobicContact CE1-CG1 4.22Å; F137-V303 HydrophobicContact CE1-CG2 3.84Å; F137-F305 HydrophobicContact CB-CD2 4.23Å; F137-F305 HydrophobicContact CB-CE2 3.58Å; F137-F305 HydrophobicContact CB-CZ 4.37Å; F137-F305 HydrophobicContact CD1-CE2 4.2Å; F137-F305 AromaticContact CD2-CE2 3.82Å; F137-F305 HydrophobicContact CD2-CE2 3.82Å; F137-F305 AromaticContact CD2-CZ 3.8Å; F137-F305 HydrophobicContact CD2-CZ 3.8Å; F137-F305 HydrophobicContact CE2-CZ 4.29Å; F137-F305 AromaticContact CG-CE2 3.61Å; F137-F305 HydrophobicContact CG-CE2 3.61Å; F137-F305 HydrophobicContact CG-CZ 4.08Å
138	H	93.2	Very high	93.7	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.023	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.3	-173.5	-68.1	-95.9	0	0	0	111.4	S136 S244 I246 I251 F302 V303 P304 F305	S136-H138 WeakPolarHBondContact CB-NE2 3.34Å; S136-H138 PolarHBondContact O-CD2 3.22Å; S136-H138 PolarHBondContact OG-CD2 3.19Å; S136-H138 PolarHBondContact OG-NE2 3.28Å; H138-S244 WeakPolarHBondContact CA-O 3.48Å; H138-I246 PolarHBondContact ND1-O 3.25Å; H138-I246 VanDerWaalsContact ND1-O 3.08Å; H138-I251 HydrophobicContact CB-CD1 4.24Å; H138-F302 HydrophobicContact CB-CE1 3.73Å; H138-F302 HydrophobicContact CB-CE2 4.04Å; H138-F302 HydrophobicContact CB-CZ 3.32Å; H138-F302 AromaticContact CD2-CD2 3.47Å; H138-F302 VanDerWaalsContact CD2-CD2 3.47Å; H138-F302 WeakPolarHBondContact CD2-CD2 3.16Å; H138-F302 AromaticContact CD2-CE1 3.87Å; H138-F302 AromaticContact CD2-CE2 3.03Å; H138-F302 WeakPolarHBondContact CD2-CE2 3.26Å; H138-F302 AromaticContact CD2-CZ 3.26Å; H138-F302 WeakPolarHBondContact CD2-CZ 2.94Å; H138-F302 AromaticContact CE1-CE2 3.62Å; H138-F302 AromaticContact CG-CE1 3.94Å; H138-F302 AromaticContact CG-CE2 3.35Å; H138-F302 AromaticContact CG-CZ 3.17Å; H138-F302 AromaticContact ND1-CE2 3.71Å; H138-F302 AromaticContact ND1-CZ 3.8Å; H138-F302 AromaticContact NE2-CD2 3.61Å; H138-F302 AromaticContact NE2-CE2 3.24Å; H138-F302 WeakPolarHBondContact NE2-CE2 3.44Å; H138-F302 AromaticContact NE2-CZ 3.93Å; H138-V303 PolarHBondContact N-O 3.41Å; H138-P304 CarbonylContact O-C 3.48Å; H138-P304 WeakPolarHBondContact O-CA 3.31Å; H138-F305 WeakPolarHBondContact O-CB 3.34Å; H138-F305 PolarHBondContact O-N 3.18Å
139	G	93.3	Very high	94.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-176.4	173.8	0	0	0	0	0	112.9	K145 S244 N245	G139-K145 PolarHBondContact O-NZ 2.8Å; G139-S244 PolarHBondContact N-O 3.29Å; G139-N245 WeakPolarHBondContact O-CA 3.38Å; G139-N245 PolarHBondContact O-OD1 3.37Å
140	W	91.8	Very high	95.1	Very high	79 Å²	79	30.1 Å²	30.1	30%	0.299	15%	0.149	S	C	.	.	S	Bend	trans	-64.9	163	-177	-154.8	-76.4	0	0	0	113.1	T143 K145 N252 V343 A352	W140-T143 HydrophobicContact CB-CG2 3.95Å; W140-T143 PolarHBondContact O-OG1 2.88Å; W140-K145 PolarHBondContact O-NZ 3.19Å; W140-N252 HydrophobicContact CE3-CB 4.05Å; W140-N252 HydrophobicContact CZ3-CB 3.96Å; W140-N252 WeakPolarHBondContact CZ3-ND2 3.44Å; W140-V343 HydrophobicContact CH2-CG2 4.38Å; W140-V343 HydrophobicContact CZ2-CG2 4.37Å; W140-A352 PolarHBondContact NE1-O 2.71Å
141	T	93.3	Very high	95.6	Very high	48 Å²	48	25.8 Å²	25.8	29%	0.294	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	139	173.2	173	0	0	0	0	112	T143 Q353	T141-T143 VanDerWaalsContact C-N 3.32Å; T141-T143 PolarHBondContact O-N 3.48Å; T141-Q353 CarbonylContact O-C 3.44Å
142	G	94.5	Very high	96	Very high	23 Å²	23	25.2 Å²	25.2	24%	0.237	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	12.2	172.4	0	0	0	0	0	115.8	Q353 G354 C355	G142-Q353 WeakPolarHBondContact CA-O 3.25Å; G142-G354 WeakPolarHBondContact O-CA 3.35Å; G142-C355 PolarHBondContact O-N 3.29Å
143	T	96.9	Very high	96.1	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.031	12%	0.123	C	C	.	.	S	Bend	trans	-83.6	-13.1	176.9	53.9	0	0	0	0	114.4	Q109 W140 T141 F305 L306 L308	Q109-T143 PolarHBondContact NE2-O 3.18Å; W140-T143 HydrophobicContact CB-CG2 3.95Å; W140-T143 PolarHBondContact O-OG1 2.88Å; T141-T143 VanDerWaalsContact C-N 3.32Å; T141-T143 PolarHBondContact O-N 3.48Å; T143-F305 WeakPolarHBondContact OG1-CB 3.37Å; T143-L306 WeakPolarHBondContact CG2-O 3.48Å; T143-L308 HydrophobicContact CG2-CG 4.44Å
144	G	96.6	Very high	96.2	Very high	14 Å²	14	28.3 Å²	28.3	14%	0.144	14%	0.14	C	C	.	.	S	Bend	trans	124	3.5	173.6	0	0	0	0	0	116.8	N146 F147 V148 F305	G144-N146 PolarHBondContact O-N 3.45Å; G144-F147 CarbonylContact O-C 3.56Å; G144-F147 WeakPolarHBondContact O-CA 3.37Å; G144-F147 WeakPolarHBondContact O-CB 3.36Å; G144-F147 PolarHBondContact O-N 3.25Å; G144-V148 WeakPolarHBondContact O-CG2 3.02Å; G144-V148 PolarHBondContact O-N 2.96Å; G144-F305 VanDerWaalsContact C-CE1 3.49Å
145	K	97.4	Very high	96.3	Very high	14 Å²	14	28.8 Å²	28.8	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-48.3	-59.4	-177.9	-61.9	-169.4	-66.7	-85.6	0	114.3	F137 G139 W140 F147 V148 A149 L243 S244 N245 F305	F137-K145 HydrophobicContact CB-CB 4.46Å; F137-K145 HydrophobicContact CB-CD 4.26Å; F137-K145 HydrophobicContact CB-CG 4.29Å; G139-K145 PolarHBondContact O-NZ 2.8Å; W140-K145 PolarHBondContact O-NZ 3.19Å; K145-F147 VanDerWaalsContact C-N 3.25Å; K145-F147 PolarHBondContact O-N 3.29Å; K145-V148 PolarHBondContact O-N 2.94Å; K145-A149 PolarHBondContact O-N 2.85Å; K145-A149 VanDerWaalsContact O-N 3.11Å; K145-L243 HydrophobicContact CB-CD2 4.35Å; K145-S244 VanDerWaalsContact CD-O 3.29Å; K145-S244 WeakPolarHBondContact CD-O 3.28Å; K145-S244 WeakPolarHBondContact CE-O 3.42Å; K145-S244 PolarHBondContact NZ-O 3.14Å; K145-N245 PolarHBondContact NZ-OD1 3.41Å; K145-F305 HydrophobicContact CB-CZ 4.46Å; K145-F305 HydrophobicContact CD-CD2 4.46Å; K145-F305 HydrophobicContact CG-CB 4.4Å; K145-F305 HydrophobicContact CG-CD1 4.01Å; K145-F305 HydrophobicContact CG-CD2 3.77Å; K145-F305 HydrophobicContact CG-CE1 4.2Å; K145-F305 HydrophobicContact CG-CE2 3.99Å; K145-F305 HydrophobicContact CG-CG 3.79Å; K145-F305 HydrophobicContact CG-CZ 4.19Å
146	N	97.1	Very high	96.3	Very high	79 Å²	79	28.8 Å²	28.8	42%	0.422	14%	0.143	S	C	.	.	H	α-helix	trans	-62.2	-32	176.4	-89.3	-56.3	0	0	0	112.9	G144 R150 D207 L243	G144-N146 PolarHBondContact O-N 3.45Å; N146-R150 PolarHBondContact O-N 3.17Å; N146-R150 VanDerWaalsContact O-N 3.12Å; N146-D207 PolarHBondContact ND2-OD1 2.74Å; N146-D207 PolarHBondContact ND2-OD2 2.99Å; N146-D207 PolarHBondContact OD1-OD2 2.97Å; N146-L243 HydrophobicContact CB-CD1 4.45Å; N146-L243 WeakPolarHBondContact OD1-CD1 3.4Å
147	F	97.6	Very high	96.3	Very high	93 Å²	93	28.8 Å²	28.8	41%	0.408	14%	0.143	S	C	.	.	H	α-helix	trans	-69.8	-42.5	179.1	-177.1	-117	0	0	0	111.8	K105 L106 G144 K145 R150 I151	K105-F147 HydrophobicContact CB-CE1 3.87Å; K105-F147 HydrophobicContact CB-CZ 3.83Å; K105-F147 HydrophobicContact CD-CZ 4.47Å; K105-F147 WeakPolarHBondContact O-CE1 3.44Å; L106-F147 HydrophobicContact CD1-CD1 4.36Å; G144-F147 CarbonylContact O-C 3.56Å; G144-F147 WeakPolarHBondContact O-CA 3.37Å; G144-F147 WeakPolarHBondContact O-CB 3.36Å; G144-F147 PolarHBondContact O-N 3.25Å; K145-F147 VanDerWaalsContact C-N 3.25Å; K145-F147 PolarHBondContact O-N 3.29Å; F147-R150 WeakPolarHBondContact O-CB 3.46Å; F147-R150 PolarHBondContact O-N 3.3Å; F147-I151 HydrophobicContact CD1-CD1 3.83Å; F147-I151 HydrophobicContact CE1-CD1 3.5Å; F147-I151 VanDerWaalsContact CE1-CD1 3.5Å; F147-I151 HydrophobicContact CE1-CG1 4.44Å; F147-I151 HydrophobicContact CE2-CD1 4.5Å; F147-I151 HydrophobicContact CG-CD1 4.47Å; F147-I151 HydrophobicContact CZ-CD1 3.88Å; F147-I151 HydrophobicContact CZ-CG1 4.44Å; F147-I151 WeakPolarHBondContact O-CG1 3.27Å; F147-I151 PolarHBondContact O-N 3.14Å
148	V	98.3	Very high	96.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.1	-42.9	175.3	174.3	0	0	0	0	111.2	L102 L106 V112 V116 F137 G144 K145 R150 I151 I152 F305	L102-V148 HydrophobicContact CD2-CG1 4.17Å; L102-V148 HydrophobicContact CD2-CG2 4.43Å; L106-V148 HydrophobicContact CD1-CG2 3.59Å; L106-V148 HydrophobicContact CD2-CG2 3.59Å; L106-V148 HydrophobicContact CG-CG2 4.19Å; V112-V148 HydrophobicContact CG1-CG1 4.16Å; V112-V148 HydrophobicContact CG1-CG2 4.15Å; V116-V148 HydrophobicContact CG1-CG1 4.46Å; V116-V148 HydrophobicContact CG2-CG1 4.34Å; F137-V148 HydrophobicContact CE2-CB 4.06Å; F137-V148 HydrophobicContact CE2-CG1 3.73Å; F137-V148 HydrophobicContact CZ-CG1 3.96Å; G144-V148 WeakPolarHBondContact O-CG2 3.02Å; G144-V148 PolarHBondContact O-N 2.96Å; K145-V148 PolarHBondContact O-N 2.94Å; V148-R150 PolarHBondContact O-N 2.51Å; V148-I151 PolarHBondContact O-N 3.44Å; V148-I151 VanDerWaalsContact O-N 3.12Å; V148-I152 HydrophobicContact CG1-CD1 3.96Å; V148-I152 HydrophobicContact CG1-CG1 4.42Å; V148-I152 VanDerWaalsContact O-CG1 3.3Å; V148-I152 WeakPolarHBondContact O-CG1 3.4Å; V148-I152 PolarHBondContact O-N 3.01Å; V148-F305 HydrophobicContact CB-CE1 4.35Å; V148-F305 HydrophobicContact CB-CZ 4.12Å; V148-F305 HydrophobicContact CG2-CE1 3.79Å; V148-F305 HydrophobicContact CG2-CZ 3.99Å
149	A	98.2	Very high	96.2	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-38.8	174.8	0	0	0	0	0	112.1	K145 I152 A153 I205 L243	K145-A149 PolarHBondContact O-N 2.85Å; K145-A149 VanDerWaalsContact O-N 3.11Å; A149-I152 PolarHBondContact O-N 3.5Å; A149-A153 PolarHBondContact O-N 2.83Å; A149-I205 HydrophobicContact CB-CD1 4.3Å; A149-I205 HydrophobicContact CB-CG2 4.39Å; A149-L243 HydrophobicContact CB-CD1 4.31Å; A149-L243 HydrophobicContact CB-CD2 4.27Å
150	R	97.9	Very high	96.2	Very high	152 Å²	152	41 Å²	41	57%	0.574	20%	0.196	S	C	*	.	H	α-helix	trans	-67.6	-44.3	173.1	179.9	171.3	-179.3	173.8	1.1	112.9	N146 F147 V148 I152 A153 D154 V161	N146-R150 PolarHBondContact O-N 3.17Å; N146-R150 VanDerWaalsContact O-N 3.12Å; F147-R150 WeakPolarHBondContact O-CB 3.46Å; F147-R150 PolarHBondContact O-N 3.3Å; V148-R150 PolarHBondContact O-N 2.51Å; R150-I152 VanDerWaalsContact C-N 3.25Å; R150-I152 PolarHBondContact O-N 3.22Å; R150-A153 PolarHBondContact O-N 2.93Å; R150-D154 WeakPolarHBondContact CG-OD2 3.37Å; R150-D154 IonicContact NE-OD2 3.19Å; R150-D154 WeakPolarHBondContact O-CB 3.38Å; R150-D154 PolarHBondContact O-N 3.39Å; R150-V161 HydrophobicContact CB-CG2 4.2Å; R150-V161 HydrophobicContact CG-CG2 3.93Å
151	I	98.1	Very high	96.3	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-41.8	175.1	-72.7	169.6	0	0	0	110.8	L98 D101 L102 K105 F147 V148 N155	L98-I151 HydrophobicContact CD1-CG2 3.73Å; D101-I151 HydrophobicContact CB-CG2 3.78Å; L102-I151 HydrophobicContact CD2-CG2 4.2Å; L102-I151 HydrophobicContact CG-CG2 4.29Å; K105-I151 HydrophobicContact CB-CD1 4.34Å; F147-I151 HydrophobicContact CD1-CD1 3.83Å; F147-I151 HydrophobicContact CE1-CD1 3.5Å; F147-I151 VanDerWaalsContact CE1-CD1 3.5Å; F147-I151 HydrophobicContact CE1-CG1 4.44Å; F147-I151 HydrophobicContact CE2-CD1 4.5Å; F147-I151 HydrophobicContact CG-CD1 4.47Å; F147-I151 HydrophobicContact CZ-CD1 3.88Å; F147-I151 HydrophobicContact CZ-CG1 4.44Å; F147-I151 WeakPolarHBondContact O-CG1 3.27Å; F147-I151 PolarHBondContact O-N 3.14Å; V148-I151 PolarHBondContact O-N 3.44Å; V148-I151 VanDerWaalsContact O-N 3.12Å; I151-N155 WeakPolarHBondContact O-CB 3.13Å; I151-N155 PolarHBondContact O-N 3Å; I151-N155 VanDerWaalsContact O-N 3.13Å; I151-N155 PolarHBondContact O-ND2 2.96Å
152	I	98.4	Very high	96.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-53	175.5	-67.1	164.5	0	0	0	109.7	L98 V116 I120 F137 V148 A149 R150 D154 N155 L156 I241	L98-I152 HydrophobicContact CD1-CG1 4.24Å; V116-I152 HydrophobicContact CG1-CD1 3.7Å; V116-I152 HydrophobicContact CG1-CG1 3.98Å; I120-I152 HydrophobicContact CD1-CB 4.24Å; I120-I152 HydrophobicContact CD1-CD1 3.82Å; I120-I152 HydrophobicContact CD1-CG1 3.6Å; I120-I152 HydrophobicContact CD1-CG2 3.66Å; F137-I152 HydrophobicContact CE2-CD1 4.29Å; F137-I152 HydrophobicContact CZ-CD1 3.8Å; V148-I152 HydrophobicContact CG1-CD1 3.96Å; V148-I152 HydrophobicContact CG1-CG1 4.42Å; V148-I152 VanDerWaalsContact O-CG1 3.3Å; V148-I152 WeakPolarHBondContact O-CG1 3.4Å; V148-I152 PolarHBondContact O-N 3.01Å; A149-I152 PolarHBondContact O-N 3.5Å; R150-I152 VanDerWaalsContact C-N 3.25Å; R150-I152 PolarHBondContact O-N 3.22Å; I152-D154 PolarHBondContact O-N 2.79Å; I152-N155 PolarHBondContact O-N 3.43Å; I152-L156 HydrophobicContact CG2-CD1 3.62Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.44Å; I152-L156 VanDerWaalsContact O-CG 3.28Å; I152-L156 WeakPolarHBondContact O-CG 3.37Å; I152-L156 PolarHBondContact O-N 2.83Å; I152-I241 HydrophobicContact CD1-CD1 3.81Å; I152-I241 HydrophobicContact CG2-CD1 4.19Å
153	A	98	Very high	96.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58	-47.7	179.8	0	0	0	0	0	112.1	A149 R150 N155 L156 Y157 G160 V161 L203	A149-A153 PolarHBondContact O-N 2.83Å; R150-A153 PolarHBondContact O-N 2.93Å; A153-N155 PolarHBondContact O-N 3.36Å; A153-L156 PolarHBondContact O-N 3.28Å; A153-Y157 PolarHBondContact O-N 3.46Å; A153-G160 WeakPolarHBondContact O-CA 3.38Å; A153-V161 HydrophobicContact CB-CG2 3.71Å; A153-L203 HydrophobicContact CB-CD2 3.86Å
154	D	97.1	Very high	96.2	Very high	75 Å²	75	51.9 Å²	51.9	40%	0.401	24%	0.241	S	C	.	.	H	α-helix	trans	-63.8	-23.9	-178	-68.1	-8.8	0	0	0	112.9	R150 I152 G160	R150-D154 WeakPolarHBondContact CG-OD2 3.37Å; R150-D154 IonicContact NE-OD2 3.19Å; R150-D154 WeakPolarHBondContact O-CB 3.38Å; R150-D154 PolarHBondContact O-N 3.39Å; I152-D154 PolarHBondContact O-N 2.79Å; D154-G160 WeakPolarHBondContact OD1-CA 3.17Å
155	N	97.5	Very high	96.1	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.053	24%	0.235	C	C	.	.	H	α-helix	trans	-97	-25.3	176.9	-77.5	-82.6	0	0	0	113.6	N94 G97 L98 D101 I151 I152 A153	N94-N155 WeakPolarHBondContact CB-O 3.46Å; N94-N155 PolarHBondContact N-O 3.41Å; G97-N155 WeakPolarHBondContact CA-OD1 3.44Å; L98-N155 HydrophobicContact CB-CB 3.95Å; L98-N155 PolarHBondContact N-OD1 3.48Å; L98-N155 VanDerWaalsContact N-OD1 3.1Å; D101-N155 PolarHBondContact OD2-ND2 3.25Å; I151-N155 WeakPolarHBondContact O-CB 3.13Å; I151-N155 PolarHBondContact O-N 3Å; I151-N155 VanDerWaalsContact O-N 3.13Å; I151-N155 PolarHBondContact O-ND2 2.96Å; I152-N155 PolarHBondContact O-N 3.43Å; A153-N155 PolarHBondContact O-N 3.36Å
156	L	96.2	Very high	96.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-87.5	-29.6	178.4	-64.6	-171.3	0	0	0	113.1	T92 N93 I120 I124 I152 A153 I239	T92-L156 PolarHBondContact N-O 3.49Å; N93-L156 PolarHBondContact N-O 3.15Å; I120-L156 HydrophobicContact CG2-CD1 4.34Å; I120-L156 HydrophobicContact CG2-CD2 3.94Å; I124-L156 HydrophobicContact CD1-CD2 3.51Å; I152-L156 HydrophobicContact CG2-CD1 3.62Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.44Å; I152-L156 VanDerWaalsContact O-CG 3.28Å; I152-L156 WeakPolarHBondContact O-CG 3.37Å; I152-L156 PolarHBondContact O-N 2.83Å; A153-L156 PolarHBondContact O-N 3.28Å; L156-I239 HydrophobicContact CD1-CD1 3.77Å
157	Y	95.9	Very high	96.2	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-128.6	142.2	-175	-54.8	-84.1	0	0	0	111.5	R90 I91 A153 D159 G160 C165 V166 Q201 T202 L203	R90-Y157 VanDerWaalsContact O-CA 3.29Å; R90-Y157 WeakPolarHBondContact O-CA 3.38Å; I91-Y157 HydrophobicContact CG1-CD1 4.17Å; I91-Y157 HydrophobicContact CG1-CE1 4.09Å; A153-Y157 PolarHBondContact O-N 3.46Å; Y157-D159 VanDerWaalsContact C-N 3.34Å; Y157-D159 PolarHBondContact O-N 3.13Å; Y157-G160 PolarHBondContact O-N 2.87Å; Y157-C165 HydrophobicContact CD1-CB 4.07Å; Y157-C165 HydrophobicContact CE1-CB 3.78Å; Y157-V166 HydrophobicContact CD1-CG2 4.33Å; Y157-V166 HydrophobicContact CD2-CG2 3.41Å; Y157-V166 VanDerWaalsContact CD2-CG2 3.41Å; Y157-V166 HydrophobicContact CE2-CG2 3.67Å; Y157-V166 HydrophobicContact CG-CG2 3.78Å; Y157-Q201 PolarHBondContact OH-NE2 2.87Å; Y157-T202 VanDerWaalsContact OH-C 3.27Å; Y157-L203 HydrophobicContact CD2-CD2 4.36Å; Y157-L203 HydrophobicContact CE2-CB 3.55Å; Y157-L203 HydrophobicContact CE2-CD2 3.78Å; Y157-L203 HydrophobicContact CE2-CG 4.31Å; Y157-L203 WeakPolarHBondContact OH-CB 2.98Å; Y157-L203 PolarHBondContact OH-N 2.91Å
158	R	92.1	Very high	96.2	Very high	161 Å²	161	51.6 Å²	51.6	61%	0.608	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-45.2	-176.1	-178.4	-178.5	175.8	-176.5	-0.6	113.4	R90 G160	R90-R158 PolarHBondContact O-N 3.45Å; R158-G160 VanDerWaalsContact C-N 3.33Å
159	D	93.3	Very high	96.1	Very high	98 Å²	98	52 Å²	52	52%	0.524	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	12.9	-179.8	-61.6	-45.2	0	0	0	112.7	Y157 V161 K162	Y157-D159 VanDerWaalsContact C-N 3.34Å; Y157-D159 PolarHBondContact O-N 3.13Å; D159-V161 PolarHBondContact O-N 3.47Å; D159-K162 HydrophobicContact CB-CB 4.41Å; D159-K162 WeakPolarHBondContact O-CB 3.38Å; D159-K162 PolarHBondContact O-N 2.89Å
160	G	94.6	Very high	96	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.01	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	54.7	-131.5	179.6	0	0	0	0	0	112.8	A153 D154 Y157 R158 K162 S163 V166	A153-G160 WeakPolarHBondContact O-CA 3.38Å; D154-G160 WeakPolarHBondContact OD1-CA 3.17Å; Y157-G160 PolarHBondContact O-N 2.87Å; R158-G160 VanDerWaalsContact C-N 3.33Å; G160-K162 PolarHBondContact O-N 3.03Å; G160-K162 VanDerWaalsContact O-N 3.11Å; G160-S163 WeakPolarHBondContact O-CB 3.13Å; G160-S163 PolarHBondContact O-N 3.46Å; G160-V166 WeakPolarHBondContact O-CG2 3.37Å
161	V	93	Very high	95.8	Very high	53 Å²	53	47.3 Å²	47.3	32%	0.321	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-61.1	-19.7	178.2	-175.3	0	0	0	0	113.2	R150 A153 D159	R150-V161 HydrophobicContact CB-CG2 4.2Å; R150-V161 HydrophobicContact CG-CG2 3.93Å; A153-V161 HydrophobicContact CB-CG2 3.71Å; D159-V161 PolarHBondContact O-N 3.47Å
162	K	94.1	Very high	95.5	Very high	193 Å²	193	49.9 Å²	49.9	84%	0.839	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-88.1	-5.3	178.1	-60.1	179.3	-178.9	177.1	0	113.3	D159 G160	D159-K162 HydrophobicContact CB-CB 4.41Å; D159-K162 WeakPolarHBondContact O-CB 3.38Å; D159-K162 PolarHBondContact O-N 2.89Å; G160-K162 PolarHBondContact O-N 3.03Å; G160-K162 VanDerWaalsContact O-N 3.11Å
163	S	94.8	Very high	95.4	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.028	27%	0.27	C	S	.	.	S	Bend	trans	-58.8	142.1	176.8	173.5	0	0	0	0	110.8	G160 C165 V166	G160-S163 WeakPolarHBondContact O-CB 3.13Å; G160-S163 PolarHBondContact O-N 3.46Å; S163-C165 PolarHBondContact O-N 3.37Å; S163-C165 VanDerWaalsContact O-N 3.14Å; S163-C165 PolarHBondContact OG-N 3.39Å; S163-V166 PolarHBondContact O-N 3.08Å
164	E	93.4	Very high	95.3	Very high	135 Å²	135	60 Å²	60	63%	0.631	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.4	176.1	-63.3	-176.9	156.9	0	0	113.2	R90 L195	R90-E164 IonicContact NH1-OE2 2.77Å; R90-E164 PolarHBondContact NH1-OE2 3.12Å; E164-L195 WeakPolarHBondContact O-CD1 3.48Å
165	C	96.1	Very high	95.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1	178.3	-56.6	0	0	0	0	113.6	Y157 S163 C199 T202 L203	Y157-C165 HydrophobicContact CD1-CB 4.07Å; Y157-C165 HydrophobicContact CE1-CB 3.78Å; S163-C165 PolarHBondContact O-N 3.37Å; S163-C165 VanDerWaalsContact O-N 3.14Å; S163-C165 PolarHBondContact OG-N 3.39Å; C165-C199 WeakPolarHBondContact CA-SG 3.29Å; C165-C199 HydrophobicContact CB-CB 3.63Å; C165-C199 WeakPolarHBondContact CB-SG 3.5Å; C165-C199 WeakPolarHBondContact SG-CB 3.48Å; C165-C199 CovalentContact SG-SG 2.04Å; C165-C199 PolarHBondContact SG-SG 3.45Å; C165-T202 WeakPolarHBondContact O-CA 3.43Å; C165-L203 PolarHBondContact O-N 3.08Å
166	V	97.4	Very high	95.1	Very high	14 Å²	14	60.5 Å²	60.5	9%	0.085	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.2	179.9	-176.5	0	0	0	0	109.5	Y157 G160 S163 L203 I205	Y157-V166 HydrophobicContact CD1-CG2 4.33Å; Y157-V166 HydrophobicContact CD2-CG2 3.41Å; Y157-V166 VanDerWaalsContact CD2-CG2 3.41Å; Y157-V166 HydrophobicContact CE2-CG2 3.67Å; Y157-V166 HydrophobicContact CG-CG2 3.78Å; G160-V166 WeakPolarHBondContact O-CG2 3.37Å; S163-V166 PolarHBondContact O-N 3.08Å; V166-L203 CarbonylContact C-O 3.59Å; V166-L203 WeakPolarHBondContact CA-O 3.45Å; V166-L203 HydrophobicContact CG1-CB 4.37Å; V166-L203 HydrophobicContact CG1-CD2 4.07Å; V166-L203 HydrophobicContact CG1-CG 4.19Å; V166-L203 HydrophobicContact CG2-CB 4.16Å; V166-L203 HydrophobicContact CG2-CD2 4.24Å; V166-I205 HydrophobicContact CG1-CD1 4.29Å
167	R	97.6	Very high	95	Very high	119 Å²	119	64.8 Å²	64.8	45%	0.449	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121.2	176.8	-170.4	68.4	176.7	-168.6	-1.3	111.1	F169 L195 L203 F204 I205	R167-F169 HydrophobicContact CB-CE2 4.27Å; R167-F169 HydrophobicContact CG-CD2 4.14Å; R167-F169 HydrophobicContact CG-CE1 4.13Å; R167-F169 HydrophobicContact CG-CE2 3.47Å; R167-F169 VanDerWaalsContact CG-CE2 3.47Å; R167-F169 HydrophobicContact CG-CZ 3.46Å; R167-F169 VanDerWaalsContact CG-CZ 3.46Å; R167-L195 HydrophobicContact CB-CD2 3.73Å; R167-L203 PolarHBondContact N-O 3.1Å; R167-F204 HydrophobicContact CB-CD1 3.98Å; R167-F204 HydrophobicContact CB-CE1 4.27Å; R167-F204 WeakPolarHBondContact O-CA 3.3Å; R167-I205 PolarHBondContact O-N 2.88Å
168	L	97.3	Very high	94.7	Very high	60 Å²	60	68.1 Å²	68.1	31%	0.314	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127	174.9	176.4	65.6	0	0	0	110.5	I170 I205 D207	L168-I170 HydrophobicContact CD1-CG1 4.47Å; L168-I170 HydrophobicContact CD2-CD1 4.3Å; L168-I170 HydrophobicContact CD2-CG1 4.23Å; L168-I170 HydrophobicContact CG-CG1 4.19Å; L168-I205 CarbonylContact C-O 3.53Å; L168-I205 WeakPolarHBondContact CA-O 3.23Å; L168-I205 HydrophobicContact CD1-CB 3.79Å; L168-I205 HydrophobicContact CD1-CG2 3.62Å; L168-D207 HydrophobicContact CD1-CB 4.2Å
169	F	96.9	Very high	94.9	Very high	9 Å²	9	70.6 Å²	70.6	4%	0.039	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	105.8	171.3	-64.2	-73.6	0	0	0	109.6	R167 F175 L188 A191 F204 I205 F206 D207	R167-F169 HydrophobicContact CB-CE2 4.27Å; R167-F169 HydrophobicContact CG-CD2 4.14Å; R167-F169 HydrophobicContact CG-CE1 4.13Å; R167-F169 HydrophobicContact CG-CE2 3.47Å; R167-F169 VanDerWaalsContact CG-CE2 3.47Å; R167-F169 HydrophobicContact CG-CZ 3.46Å; R167-F169 VanDerWaalsContact CG-CZ 3.46Å; F169-F175 HydrophobicContact CB-CE2 4.32Å; F169-F175 HydrophobicContact CD1-CE2 4.42Å; F169-F175 HydrophobicContact CD1-CZ 4Å; F169-L188 HydrophobicContact CD1-CD1 4.48Å; F169-L188 HydrophobicContact CD2-CD1 4.35Å; F169-L188 HydrophobicContact CE1-CD1 4.06Å; F169-L188 HydrophobicContact CE2-CD1 3.9Å; F169-L188 HydrophobicContact CZ-CD1 3.74Å; F169-A191 HydrophobicContact CZ-CB 4.17Å; F169-F204 HydrophobicContact CE2-CD1 4.09Å; F169-I205 PolarHBondContact N-O 2.84Å; F169-F206 HydrophobicContact CB-CD1 3.83Å; F169-F206 HydrophobicContact CB-CE1 4.05Å; F169-F206 HydrophobicContact CD2-CD1 4.17Å; F169-F206 AromaticContact CD2-CE1 3.66Å; F169-F206 HydrophobicContact CD2-CE1 3.66Å; F169-F206 HydrophobicContact CD2-CE2 4.46Å; F169-F206 AromaticContact CD2-CZ 3.83Å; F169-F206 HydrophobicContact CD2-CZ 3.83Å; F169-F206 HydrophobicContact CE2-CE1 4.37Å; F169-F206 HydrophobicContact CE2-CZ 4.24Å; F169-F206 HydrophobicContact CG-CD1 4.35Å; F169-F206 HydrophobicContact CG-CE1 4.07Å; F169-F206 CarbonylContact O-C 3.24Å; F169-F206 WeakPolarHBondContact O-CA 3.25Å; F169-D207 PolarHBondContact O-N 3.05Å
170	I	96.3	Very high	95	Very high	53 Å²	53	68.9 Å²	68.9	27%	0.272	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.8	168	-57.6	167.7	0	0	0	108.1	L168 P172 F173 H174 D207	L168-I170 HydrophobicContact CD1-CG1 4.47Å; L168-I170 HydrophobicContact CD2-CD1 4.3Å; L168-I170 HydrophobicContact CD2-CG1 4.23Å; L168-I170 HydrophobicContact CG-CG1 4.19Å; I170-P172 HydrophobicContact CG2-CG 4.07Å; I170-F173 HydrophobicContact CB-CB 4.01Å; I170-F173 HydrophobicContact CG2-CB 3.95Å; I170-F173 PolarHBondContact O-N 3.37Å; I170-F173 VanDerWaalsContact O-N 3.13Å; I170-H174 PolarHBondContact N-CE1 3.34Å; I170-H174 PolarHBondContact N-ND1 3.24Å; I170-H174 PolarHBondContact O-N 3.21Å; I170-H174 PolarHBondContact O-ND1 2.82Å; I170-D207 HydrophobicContact CG1-CB 4.16Å
171	A	93.2	Very high	95	Very high	2 Å²	2	70.1 Å²	70.1	2%	0.017	34%	0.341	C	S	.	.	H	α-helix	trans	-53	-55.4	-171.9	0	0	0	0	0	114.5	F173 F175 D207 E208 K211 L212	A171-F173 PolarHBondContact O-N 2.99Å; A171-F175 CarbonylContact O-C 3.58Å; A171-F175 WeakPolarHBondContact O-CA 3.42Å; A171-F175 WeakPolarHBondContact O-CB 3.34Å; A171-F175 PolarHBondContact O-N 2.82Å; A171-D207 PolarHBondContact N-O 3.23Å; A171-E208 VanDerWaalsContact CB-O 3.3Å; A171-E208 WeakPolarHBondContact CB-O 3.19Å; A171-K211 HydrophobicContact CB-CB 4.28Å; A171-L212 HydrophobicContact CB-CD2 3.54Å; A171-L212 HydrophobicContact CB-CG 3.71Å
172	P	93.1	Very high	95.1	Very high	60 Å²	60	73.4 Å²	73.4	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-68.2	-18.5	-178.7	27	-36.4	0	0	0	114	I170 E208 K211	I170-P172 HydrophobicContact CG2-CG 4.07Å; P172-E208 HydrophobicContact CG-CB 4.42Å; P172-K211 HydrophobicContact CB-CD 4.47Å; P172-K211 HydrophobicContact CG-CD 4.31Å
173	F	95.5	Very high	95.3	Very high	154 Å²	154	67.9 Å²	67.9	68%	0.675	34%	0.34	S	S	*	.	H	α-helix	trans	-88.2	-46.1	179.8	178.6	-98	0	0	0	111.9	I170 A171	I170-F173 HydrophobicContact CB-CB 4.01Å; I170-F173 HydrophobicContact CG2-CB 3.95Å; I170-F173 PolarHBondContact O-N 3.37Å; I170-F173 VanDerWaalsContact O-N 3.13Å; A171-F173 PolarHBondContact O-N 2.99Å
174	H	96	Very high	95.4	Very high	58 Å²	58	68.8 Å²	68.8	27%	0.269	34%	0.342	S	S	.	.	H	α-helix	trans	-84.8	-29.4	-177.3	-63.2	95.3	0	0	0	112.6	I170 P176	I170-H174 PolarHBondContact N-CE1 3.34Å; I170-H174 PolarHBondContact N-ND1 3.24Å; I170-H174 PolarHBondContact O-N 3.21Å; I170-H174 PolarHBondContact O-ND1 2.82Å; H174-P176 WeakPolarHBondContact O-CD 3.38Å
175	F	95.2	Very high	95.5	Very high	29 Å²	29	65.2 Å²	65.2	13%	0.127	33%	0.325	C	S	.	.	S	Bend	trans	-126.1	54.2	-175.6	-44.4	-59.7	0	0	0	112.3	F169 A171 H177 Y184 L188 L212 L216	F169-F175 HydrophobicContact CB-CE2 4.32Å; F169-F175 HydrophobicContact CD1-CE2 4.42Å; F169-F175 HydrophobicContact CD1-CZ 4Å; A171-F175 CarbonylContact O-C 3.58Å; A171-F175 WeakPolarHBondContact O-CA 3.42Å; A171-F175 WeakPolarHBondContact O-CB 3.34Å; A171-F175 PolarHBondContact O-N 2.82Å; F175-H177 VanDerWaalsContact C-N 3.32Å; F175-H177 PolarHBondContact O-N 2.81Å; F175-Y184 HydrophobicContact CB-CD2 4.03Å; F175-Y184 HydrophobicContact CB-CE2 4.24Å; F175-Y184 HydrophobicContact CD1-CD1 4.14Å; F175-Y184 HydrophobicContact CD1-CD2 4.04Å; F175-Y184 AromaticContact CD1-CG 3.74Å; F175-Y184 HydrophobicContact CD1-CG 3.74Å; F175-L188 HydrophobicContact CZ-CD1 4.26Å; F175-L188 HydrophobicContact CZ-CD2 4.39Å; F175-L212 HydrophobicContact CD2-CD2 3.56Å; F175-L212 HydrophobicContact CE2-CD2 3.9Å; F175-L216 HydrophobicContact CB-CD1 3.73Å; F175-L216 HydrophobicContact CD1-CD1 4.01Å; F175-L216 HydrophobicContact CD2-CD1 3.82Å; F175-L216 HydrophobicContact CE2-CD1 4.45Å; F175-L216 HydrophobicContact CG-CD1 3.57Å
176	P	95.1	Very high	95.5	Very high	67 Å²	67	67 Å²	67	44%	0.435	34%	0.343	S	S	.	.			trans	-70.5	-22.9	-171.8	28	-36.8	0	0	0	114.4	H174 Y184	H174-P176 WeakPolarHBondContact O-CD 3.38Å; P176-Y184 WeakPolarHBondContact CD-OH 3.46Å
177	H	94.2	Very high	95.5	Very high	90 Å²	90	71.3 Å²	71.3	42%	0.417	36%	0.362	S	S	.	.			trans	-123.8	110	-167.1	-60.4	-45.3	0	0	0	112.8	F175 R179 L180 Y184	F175-H177 VanDerWaalsContact C-N 3.32Å; F175-H177 PolarHBondContact O-N 2.81Å; H177-R179 HydrophobicContact CB-CG 4.18Å; H177-R179 PolarHBondContact O-N 2.83Å; H177-R179 VanDerWaalsContact O-N 3.07Å; H177-L180 HydrophobicContact CB-CD1 4.43Å; H177-L180 HydrophobicContact CB-CG 4.44Å; H177-L180 PolarHBondContact O-N 2.7Å; H177-Y184 VanDerWaalsContact O-CE2 3.23Å; H177-Y184 WeakPolarHBondContact O-CE2 3.47Å
178	A	90.3	Very high	95.4	Very high	71 Å²	71	65.8 Å²	65.8	59%	0.587	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-56.2	-29	178	0	0	0	0	0	114	L180 L181	A178-L180 PolarHBondContact O-N 2.96Å; A178-L181 VanDerWaalsContact O-CB 3.24Å; A178-L181 WeakPolarHBondContact O-CB 3.42Å; A178-L181 PolarHBondContact O-N 2.76Å
179	R	94.8	Very high	95.4	Very high	212 Å²	212	68.3 Å²	68.3	80%	0.8	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.9	176.7	70.2	-177.7	177	150.3	-1.1	114.5	H177	H177-R179 HydrophobicContact CB-CG 4.18Å; H177-R179 PolarHBondContact O-N 2.83Å; H177-R179 VanDerWaalsContact O-N 3.07Å
180	L	96.1	Very high	95.3	Very high	63 Å²	63	73.8 Å²	73.8	33%	0.33	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-100.3	16.2	179.9	-63.7	-180	0	0	0	111.9	H177 A178 D182 T183 Y184	H177-L180 HydrophobicContact CB-CD1 4.43Å; H177-L180 HydrophobicContact CB-CG 4.44Å; H177-L180 PolarHBondContact O-N 2.7Å; A178-L180 PolarHBondContact O-N 2.96Å; L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 2.8Å; L180-T183 WeakPolarHBondContact O-CB 3.49Å; L180-T183 PolarHBondContact O-N 3.44Å; L180-T183 VanDerWaalsContact O-N 3.1Å; L180-Y184 HydrophobicContact CB-CD1 4.42Å; L180-Y184 HydrophobicContact CB-CD2 4.13Å; L180-Y184 HydrophobicContact CB-CE1 3.97Å; L180-Y184 HydrophobicContact CB-CE2 3.67Å; L180-Y184 HydrophobicContact CB-CG 4.49Å; L180-Y184 HydrophobicContact CD1-CE1 4.3Å; L180-Y184 WeakPolarHBondContact CD1-OH 3.49Å; L180-Y184 WeakPolarHBondContact O-CD2 3.49Å; L180-Y184 VanDerWaalsContact O-CG 3.32Å; L180-Y184 PolarHBondContact O-N 2.83Å
181	L	94.3	Very high	95.3	Very high	26 Å²	26	72.4 Å²	72.4	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-50.9	-47.8	-174.7	177.4	62.8	0	0	0	113	A178 T183 Y184 K185 H213 L216	A178-L181 VanDerWaalsContact O-CB 3.24Å; A178-L181 WeakPolarHBondContact O-CB 3.42Å; A178-L181 PolarHBondContact O-N 2.76Å; L181-T183 VanDerWaalsContact C-N 3.34Å; L181-T183 PolarHBondContact O-N 3.39Å; L181-Y184 PolarHBondContact O-N 3.11Å; L181-K185 HydrophobicContact CD1-CG 4.42Å; L181-K185 HydrophobicContact CG-CD 4.47Å; L181-K185 WeakPolarHBondContact O-CG 3.48Å; L181-K185 PolarHBondContact O-N 3.34Å; L181-H213 HydrophobicContact CD1-CB 4.02Å; L181-H213 VanDerWaalsContact CD2-CE1 3.46Å; L181-H213 WeakPolarHBondContact CD2-CE1 3.24Å; L181-L216 HydrophobicContact CD1-CD1 4.46Å; L181-L216 HydrophobicContact CD1-CD2 3.96Å; L181-L216 HydrophobicContact CD1-CG 3.67Å
182	D	96.2	Very high	95.4	Very high	123 Å²	123	72.3 Å²	72.3	66%	0.658	37%	0.369	S	S	*	.	H	α-helix	trans	-67.4	-35.9	-177.4	-63.3	-39.7	0	0	0	112.3	L180 K185 G186	L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 2.8Å; D182-K185 PolarHBondContact O-N 3.34Å; D182-K185 IonicContact OD1-NZ 2.85Å; D182-G186 PolarHBondContact O-N 2.85Å; D182-G186 VanDerWaalsContact O-N 3.15Å
183	T	97.4	Very high	95.5	Very high	77 Å²	77	75 Å²	75	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-45	171.8	-52.3	0	0	0	0	110.9	L180 L181 K185 G186 Q187	L180-T183 WeakPolarHBondContact O-CB 3.49Å; L180-T183 PolarHBondContact O-N 3.44Å; L180-T183 VanDerWaalsContact O-N 3.1Å; L181-T183 VanDerWaalsContact C-N 3.34Å; L181-T183 PolarHBondContact O-N 3.39Å; T183-K185 PolarHBondContact O-N 2.98Å; T183-G186 PolarHBondContact O-N 3.05Å; T183-Q187 WeakPolarHBondContact O-CG 3.32Å; T183-Q187 PolarHBondContact O-N 3.4Å
184	Y	97.4	Very high	95.5	Very high	22 Å²	22	71 Å²	71	9%	0.086	36%	0.357	C	S	.	.	H	α-helix	trans	-65.3	-37.2	178.7	-63.4	-27.9	0	0	0	112.7	F175 P176 H177 L180 L181 Q187 L188	F175-Y184 HydrophobicContact CB-CD2 4.03Å; F175-Y184 HydrophobicContact CB-CE2 4.24Å; F175-Y184 HydrophobicContact CD1-CD1 4.14Å; F175-Y184 HydrophobicContact CD1-CD2 4.04Å; F175-Y184 AromaticContact CD1-CG 3.74Å; F175-Y184 HydrophobicContact CD1-CG 3.74Å; P176-Y184 WeakPolarHBondContact CD-OH 3.46Å; H177-Y184 VanDerWaalsContact O-CE2 3.23Å; H177-Y184 WeakPolarHBondContact O-CE2 3.47Å; L180-Y184 HydrophobicContact CB-CD1 4.42Å; L180-Y184 HydrophobicContact CB-CD2 4.13Å; L180-Y184 HydrophobicContact CB-CE1 3.97Å; L180-Y184 HydrophobicContact CB-CE2 3.67Å; L180-Y184 HydrophobicContact CB-CG 4.49Å; L180-Y184 HydrophobicContact CD1-CE1 4.3Å; L180-Y184 WeakPolarHBondContact CD1-OH 3.49Å; L180-Y184 WeakPolarHBondContact O-CD2 3.49Å; L180-Y184 VanDerWaalsContact O-CG 3.32Å; L180-Y184 PolarHBondContact O-N 2.83Å; L181-Y184 PolarHBondContact O-N 3.11Å; Y184-Q187 PolarHBondContact O-N 2.84Å; Y184-L188 WeakPolarHBondContact O-CB 3.42Å; Y184-L188 PolarHBondContact O-N 3.24Å
185	K	96.1	Very high	95.5	Very high	60 Å²	60	68.6 Å²	68.6	26%	0.261	35%	0.346	S	S	.	.	H	α-helix	trans	-58.2	-48.1	172	-73.9	175.5	174.8	171.1	0	111	L181 D182 T183 L188 R189 G215 L216 A219	L181-K185 HydrophobicContact CD1-CG 4.42Å; L181-K185 HydrophobicContact CG-CD 4.47Å; L181-K185 WeakPolarHBondContact O-CG 3.48Å; L181-K185 PolarHBondContact O-N 3.34Å; D182-K185 PolarHBondContact O-N 3.34Å; D182-K185 IonicContact OD1-NZ 2.85Å; T183-K185 PolarHBondContact O-N 2.98Å; K185-L188 PolarHBondContact O-N 3.29Å; K185-R189 VanDerWaalsContact O-CG 3.29Å; K185-R189 WeakPolarHBondContact O-CG 3.44Å; K185-R189 PolarHBondContact O-N 3.12Å; K185-G215 WeakPolarHBondContact CE-O 3.49Å; K185-L216 HydrophobicContact CG-CD2 3.92Å; K185-A219 HydrophobicContact CB-CB 4.24Å; K185-A219 HydrophobicContact CD-CB 4.49Å; K185-A219 HydrophobicContact CG-CB 3.93Å
186	G	96.3	Very high	95.5	Very high	38 Å²	38	68.1 Å²	68.1	39%	0.392	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-51.8	177.7	0	0	0	0	0	112.2	D182 T183 L188 R189 E190	D182-G186 PolarHBondContact O-N 2.85Å; D182-G186 VanDerWaalsContact O-N 3.15Å; T183-G186 PolarHBondContact O-N 3.05Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 3.29Å; G186-R189 PolarHBondContact O-N 2.93Å; G186-E190 WeakPolarHBondContact O-CB 3.43Å; G186-E190 PolarHBondContact O-N 2.9Å
187	Q	96.1	Very high	95.4	Very high	104 Å²	104	70 Å²	70	49%	0.486	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-39.2	179	-71.8	176.2	-15.3	0	0	112.8	T183 Y184 A191	T183-Q187 WeakPolarHBondContact O-CG 3.32Å; T183-Q187 PolarHBondContact O-N 3.4Å; Y184-Q187 PolarHBondContact O-N 2.84Å; Q187-A191 WeakPolarHBondContact O-CB 3.2Å; Q187-A191 PolarHBondContact O-N 3.02Å
188	L	96.4	Very high	95.3	Very high	3 Å²	3	73.1 Å²	73.1	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-67.8	-44.9	179.4	-178.7	55.9	0	0	0	111.5	F169 F175 Y184 K185 G186 A191 I192 F206 L216 I220	F169-L188 HydrophobicContact CD1-CD1 4.48Å; F169-L188 HydrophobicContact CD2-CD1 4.35Å; F169-L188 HydrophobicContact CE1-CD1 4.06Å; F169-L188 HydrophobicContact CE2-CD1 3.9Å; F169-L188 HydrophobicContact CZ-CD1 3.74Å; F175-L188 HydrophobicContact CZ-CD1 4.26Å; F175-L188 HydrophobicContact CZ-CD2 4.39Å; Y184-L188 WeakPolarHBondContact O-CB 3.42Å; Y184-L188 PolarHBondContact O-N 3.24Å; K185-L188 PolarHBondContact O-N 3.29Å; G186-L188 VanDerWaalsContact C-N 3.31Å; G186-L188 PolarHBondContact O-N 3.29Å; L188-A191 PolarHBondContact O-N 3.11Å; L188-I192 HydrophobicContact CD1-CD1 3.81Å; L188-I192 HydrophobicContact CD1-CG1 4.19Å; L188-I192 HydrophobicContact CG-CD1 3.98Å; L188-I192 WeakPolarHBondContact O-CB 3.41Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.34Å; L188-I192 PolarHBondContact O-N 3Å; L188-F206 HydrophobicContact CD1-CE1 4.09Å; L188-F206 HydrophobicContact CD1-CZ 4.26Å; L188-L216 HydrophobicContact CD2-CB 4.45Å; L188-L216 HydrophobicContact CD2-CD2 4.33Å; L188-I220 HydrophobicContact CD1-CG2 4.45Å; L188-I220 HydrophobicContact CD2-CG2 3.44Å; L188-I220 VanDerWaalsContact CD2-CG2 3.44Å; L188-I220 HydrophobicContact CG-CG2 3.76Å
189	R	95.8	Very high	95.4	Very high	114 Å²	114	69.9 Å²	69.9	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-45.8	176.5	-71.5	178	67.7	164.9	0.6	111.8	K185 G186 I192 R193 Y223 D231	K185-R189 VanDerWaalsContact O-CG 3.29Å; K185-R189 WeakPolarHBondContact O-CG 3.44Å; K185-R189 PolarHBondContact O-N 3.12Å; G186-R189 PolarHBondContact O-N 2.93Å; R189-I192 PolarHBondContact O-N 3.39Å; R189-R193 VanDerWaalsContact O-CB 3.31Å; R189-R193 WeakPolarHBondContact O-CB 3.48Å; R189-R193 PolarHBondContact O-N 2.84Å; R189-Y223 HydrophobicContact CG-CE2 4.16Å; R189-Y223 PolarHBondContact NE-OH 3.19Å; R189-D231 IonicContact NH2-OD2 2.84Å; R189-D231 PolarHBondContact NH2-OD2 3.21Å
190	E	95.5	Very high	95	Very high	123 Å²	123	63.5 Å²	63.5	58%	0.575	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-48.5	177.7	-169.3	174.4	-162.3	0	0	111	G186 I192 R193 D194	G186-E190 WeakPolarHBondContact O-CB 3.43Å; G186-E190 PolarHBondContact O-N 2.9Å; E190-I192 VanDerWaalsContact C-N 3.34Å; E190-I192 PolarHBondContact O-N 2.77Å; E190-R193 PolarHBondContact O-N 2.92Å; E190-D194 VanDerWaalsContact O-CB 3.31Å; E190-D194 WeakPolarHBondContact O-CB 3.22Å; E190-D194 PolarHBondContact O-N 3.5Å
191	A	95.8	Very high	95	Very high	25 Å²	25	60.5 Å²	60.5	21%	0.207	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-38.8	178.9	0	0	0	0	0	113.5	F169 Q187 L188 L195	F169-A191 HydrophobicContact CZ-CB 4.17Å; Q187-A191 WeakPolarHBondContact O-CB 3.2Å; Q187-A191 PolarHBondContact O-N 3.02Å; L188-A191 PolarHBondContact O-N 3.11Å; A191-L195 WeakPolarHBondContact O-CB 3.35Å; A191-L195 PolarHBondContact O-N 3.07Å
192	I	96.4	Very high	95.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-51	176.2	-73.5	169.5	0	0	0	110.1	L188 R189 E190 D194 L195 V196 F204 I220 Y223 Y235	L188-I192 HydrophobicContact CD1-CD1 3.81Å; L188-I192 HydrophobicContact CD1-CG1 4.19Å; L188-I192 HydrophobicContact CG-CD1 3.98Å; L188-I192 WeakPolarHBondContact O-CB 3.41Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.34Å; L188-I192 PolarHBondContact O-N 3Å; R189-I192 PolarHBondContact O-N 3.39Å; E190-I192 VanDerWaalsContact C-N 3.34Å; E190-I192 PolarHBondContact O-N 2.77Å; I192-D194 PolarHBondContact O-N 3.43Å; I192-L195 PolarHBondContact O-N 3.13Å; I192-V196 WeakPolarHBondContact O-CG2 3.22Å; I192-V196 PolarHBondContact O-N 2.88Å; I192-V196 VanDerWaalsContact O-N 3.11Å; I192-F204 HydrophobicContact CB-CE1 4.21Å; I192-F204 HydrophobicContact CB-CZ 4.16Å; I192-F204 HydrophobicContact CG1-CD1 4.21Å; I192-F204 HydrophobicContact CG1-CE1 3.79Å; I192-F204 HydrophobicContact CG1-CZ 4.13Å; I192-F204 HydrophobicContact CG2-CE1 4.42Å; I192-F204 HydrophobicContact CG2-CE2 4.32Å; I192-F204 HydrophobicContact CG2-CZ 3.9Å; I192-I220 HydrophobicContact CD1-CB 4.39Å; I192-I220 HydrophobicContact CD1-CG2 3.56Å; I192-Y223 HydrophobicContact CD1-CD2 4.08Å; I192-Y223 HydrophobicContact CD1-CE2 4.4Å; I192-Y223 HydrophobicContact CG2-CD2 4.02Å; I192-Y223 HydrophobicContact CG2-CE2 4.38Å; I192-Y223 HydrophobicContact CG2-CG 4.2Å; I192-Y235 HydrophobicContact CG2-CD1 4.28Å; I192-Y235 HydrophobicContact CG2-CE1 3.72Å
193	R	95.5	Very high	95.1	Very high	117 Å²	117	53.5 Å²	53.5	44%	0.442	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-48.6	179.8	-178.7	-177.1	175.1	-172.2	-0.8	111.7	R189 E190 L195 V196 L197 V233	R189-R193 VanDerWaalsContact O-CB 3.31Å; R189-R193 WeakPolarHBondContact O-CB 3.48Å; R189-R193 PolarHBondContact O-N 2.84Å; E190-R193 PolarHBondContact O-N 2.92Å; R193-L195 PolarHBondContact O-N 3.44Å; R193-V196 PolarHBondContact O-N 3.05Å; R193-L197 HydrophobicContact CG-CD1 4.04Å; R193-L197 HydrophobicContact CG-CG 4.49Å; R193-L197 WeakPolarHBondContact O-CG 3.28Å; R193-L197 PolarHBondContact O-N 3.48Å; R193-V233 HydrophobicContact CG-CG2 4.49Å
194	D	95.1	Very high	95.2	Very high	69 Å²	69	49.8 Å²	49.8	37%	0.369	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-33.5	-178.8	-75.7	-5.4	0	0	0	112.6	E190 I192 R198	E190-D194 VanDerWaalsContact O-CB 3.31Å; E190-D194 WeakPolarHBondContact O-CB 3.22Å; E190-D194 PolarHBondContact O-N 3.5Å; I192-D194 PolarHBondContact O-N 3.43Å; D194-R198 WeakPolarHBondContact O-CG 3.45Å; D194-R198 PolarHBondContact O-NE 3.12Å
195	L	95.3	Very high	95.2	Very high	7 Å²	7	49 Å²	49	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-73.3	-46.1	178.4	-171	65.3	0	0	0	111.3	E164 R167 A191 I192 R193 L197 R198 C199 T202 F204	E164-L195 WeakPolarHBondContact O-CD1 3.48Å; R167-L195 HydrophobicContact CB-CD2 3.73Å; A191-L195 WeakPolarHBondContact O-CB 3.35Å; A191-L195 PolarHBondContact O-N 3.07Å; I192-L195 PolarHBondContact O-N 3.13Å; R193-L195 PolarHBondContact O-N 3.44Å; L195-L197 VanDerWaalsContact C-N 3.28Å; L195-L197 PolarHBondContact O-N 2.99Å; L195-R198 PolarHBondContact O-N 3.21Å; L195-C199 PolarHBondContact O-N 2.74Å; L195-T202 HydrophobicContact CB-CG2 4.48Å; L195-T202 HydrophobicContact CD2-CG2 4.12Å; L195-T202 HydrophobicContact CG-CG2 3.74Å; L195-F204 HydrophobicContact CB-CE1 4.14Å; L195-F204 HydrophobicContact CB-CZ 4.04Å; L195-F204 HydrophobicContact CD2-CD1 4.03Å; L195-F204 HydrophobicContact CD2-CE1 3.31Å; L195-F204 HydrophobicContact CD2-CE2 4.46Å; L195-F204 HydrophobicContact CD2-CZ 3.58Å; L195-F204 HydrophobicContact CG-CE1 4.3Å; L195-F204 HydrophobicContact CG-CZ 4.24Å
196	V	94.8	Very high	95.3	Very high	20 Å²	20	46.2 Å²	46.2	12%	0.121	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-34.5	-180	175.3	0	0	0	0	111.6	I192 R193 R198 C199 T202 F204 V233 S234 Y235	I192-V196 WeakPolarHBondContact O-CG2 3.22Å; I192-V196 PolarHBondContact O-N 2.88Å; I192-V196 VanDerWaalsContact O-N 3.11Å; R193-V196 PolarHBondContact O-N 3.05Å; V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 PolarHBondContact O-N 3.23Å; V196-C199 VanDerWaalsContact O-O 3.08Å; V196-T202 HydrophobicContact CG2-CG2 4.09Å; V196-F204 HydrophobicContact CG2-CE2 4.06Å; V196-F204 HydrophobicContact CG2-CZ 4.02Å; V196-V233 HydrophobicContact CB-CG1 4.29Å; V196-V233 HydrophobicContact CG1-CG1 3.57Å; V196-S234 VanDerWaalsContact CG1-O 3.29Å; V196-S234 WeakPolarHBondContact CG1-O 3.32Å; V196-Y235 HydrophobicContact CB-CD1 4.39Å; V196-Y235 HydrophobicContact CB-CE1 4.13Å; V196-Y235 HydrophobicContact CG1-CD1 4.24Å; V196-Y235 HydrophobicContact CG1-CE1 4.26Å; V196-Y235 HydrophobicContact CG2-CD1 3.74Å; V196-Y235 HydrophobicContact CG2-CE1 3.75Å
197	L	93.6	Very high	95.3	Very high	105 Å²	105	45.4 Å²	45.4	55%	0.55	21%	0.214	S	C	.	.	H	α-helix	trans	-67	-25.7	173.8	-72.2	174.3	0	0	0	113.6	R193 L195 V233	R193-L197 HydrophobicContact CG-CD1 4.04Å; R193-L197 HydrophobicContact CG-CG 4.49Å; R193-L197 WeakPolarHBondContact O-CG 3.28Å; R193-L197 PolarHBondContact O-N 3.48Å; L195-L197 VanDerWaalsContact C-N 3.28Å; L195-L197 PolarHBondContact O-N 2.99Å; L197-V233 HydrophobicContact CD2-CG1 4.22Å; L197-V233 HydrophobicContact CD2-CG2 3.82Å; L197-V233 HydrophobicContact CG-CG2 4.37Å
198	R	91.8	Very high	95.1	Very high	157 Å²	157	42.5 Å²	42.5	59%	0.592	20%	0.201	S	C	*	.	H	α-helix	trans	-96	-18.4	-176.7	-74.6	-177.5	-70.9	168.1	-4.3	114.2	R90 D194 L195 V196	R90-R198 PolarHBondContact NH2-O 3.33Å; D194-R198 WeakPolarHBondContact O-CG 3.45Å; D194-R198 PolarHBondContact O-NE 3.12Å; L195-R198 PolarHBondContact O-N 3.21Å; V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 PolarHBondContact O-N 3.23Å
199	C	92.1	Very high	94.9	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.02	20%	0.201	C	C	.	.			trans	-137.7	127.8	-171.6	-74.3	0	0	0	0	110.7	R90 C165 L195 V196 Q201 T202	R90-C199 PolarHBondContact NH2-SG 3.1Å; C165-C199 WeakPolarHBondContact CA-SG 3.29Å; C165-C199 HydrophobicContact CB-CB 3.63Å; C165-C199 WeakPolarHBondContact CB-SG 3.5Å; C165-C199 WeakPolarHBondContact SG-CB 3.48Å; C165-C199 CovalentContact SG-SG 2.04Å; C165-C199 PolarHBondContact SG-SG 3.45Å; L195-C199 PolarHBondContact O-N 2.74Å; V196-C199 VanDerWaalsContact O-O 3.08Å; C199-Q201 VanDerWaalsContact C-N 3.29Å; C199-Q201 PolarHBondContact O-N 3.43Å; C199-T202 HydrophobicContact CB-CG2 3.7Å
200	P	88.2	Confident	94.5	Very high	77 Å²	77	38.7 Å²	38.7	50%	0.5	19%	0.188	S	C	.	.	S	Bend	trans	-70.5	-25.8	-178.3	27.6	-33.2	0	0	0	113	D88 I91 R237	D88-P200 HydrophobicContact CB-CG 4.07Å; D88-P200 WeakPolarHBondContact OD2-CD 3.46Å; I91-P200 HydrophobicContact CD1-CG 3.69Å; P200-R237 WeakPolarHBondContact O-CB 2.96Å
201	Q	94.4	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-127.8	124.9	170.7	-172.6	-174.3	-74.3	0	0	107.7	I91 N93 Y157 C199 R237 I239	I91-Q201 HydrophobicContact CD1-CB 3.61Å; I91-Q201 HydrophobicContact CG1-CB 4.38Å; N93-Q201 PolarHBondContact ND2-OE1 3.24Å; N93-Q201 PolarHBondContact OD1-NE2 3.39Å; N93-Q201 PolarHBondContact OD1-OE1 2.86Å; Y157-Q201 PolarHBondContact OH-NE2 2.87Å; C199-Q201 VanDerWaalsContact C-N 3.29Å; C199-Q201 PolarHBondContact O-N 3.43Å; Q201-R237 WeakPolarHBondContact CG-O 3.37Å; Q201-I239 HydrophobicContact CG-CD1 4.46Å
202	T	96.3	Very high	94	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.8	-178.3	51.9	0	0	0	0	110.6	Y157 C165 L195 V196 C199 F204 A238 I239	Y157-T202 VanDerWaalsContact OH-C 3.27Å; C165-T202 WeakPolarHBondContact O-CA 3.43Å; L195-T202 HydrophobicContact CB-CG2 4.48Å; L195-T202 HydrophobicContact CD2-CG2 4.12Å; L195-T202 HydrophobicContact CG-CG2 3.74Å; V196-T202 HydrophobicContact CG2-CG2 4.09Å; C199-T202 HydrophobicContact CB-CG2 3.7Å; T202-F204 WeakPolarHBondContact OG1-CE2 3Å; T202-A238 WeakPolarHBondContact OG1-CB 3.43Å; T202-I239 PolarHBondContact O-N 3.06Å
203	L	98.1	Very high	93.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.9	174	171.5	62.4	0	0	0	109.9	A153 Y157 C165 V166 R167 I205 I239 I241	A153-L203 HydrophobicContact CB-CD2 3.86Å; Y157-L203 HydrophobicContact CD2-CD2 4.36Å; Y157-L203 HydrophobicContact CE2-CB 3.55Å; Y157-L203 HydrophobicContact CE2-CD2 3.78Å; Y157-L203 HydrophobicContact CE2-CG 4.31Å; Y157-L203 WeakPolarHBondContact OH-CB 2.98Å; Y157-L203 PolarHBondContact OH-N 2.91Å; C165-L203 PolarHBondContact O-N 3.08Å; V166-L203 CarbonylContact C-O 3.59Å; V166-L203 WeakPolarHBondContact CA-O 3.45Å; V166-L203 HydrophobicContact CG1-CB 4.37Å; V166-L203 HydrophobicContact CG1-CD2 4.07Å; V166-L203 HydrophobicContact CG1-CG 4.19Å; V166-L203 HydrophobicContact CG2-CB 4.16Å; V166-L203 HydrophobicContact CG2-CD2 4.24Å; R167-L203 PolarHBondContact N-O 3.1Å; L203-I205 HydrophobicContact CD1-CG1 4.19Å; L203-I205 HydrophobicContact CD2-CD1 4.17Å; L203-I205 HydrophobicContact CD2-CG1 4.38Å; L203-I205 HydrophobicContact CG-CD1 4.34Å; L203-I205 HydrophobicContact CG-CG1 4.03Å; L203-I239 CarbonylContact C-O 3.58Å; L203-I239 WeakPolarHBondContact CA-O 3.48Å; L203-I239 HydrophobicContact CD1-CB 3.96Å; L203-I239 HydrophobicContact CD1-CG2 3.76Å; L203-I241 HydrophobicContact CD1-CD1 3.67Å; L203-I241 HydrophobicContact CD1-CG1 3.82Å
204	F	98.3	Very high	93.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.9	173.9	-60.8	-78	0	0	0	109.6	R167 F169 I192 L195 V196 T202 F206 A238 I239 F240 I241	R167-F204 HydrophobicContact CB-CD1 3.98Å; R167-F204 HydrophobicContact CB-CE1 4.27Å; R167-F204 WeakPolarHBondContact O-CA 3.3Å; F169-F204 HydrophobicContact CE2-CD1 4.09Å; I192-F204 HydrophobicContact CB-CE1 4.21Å; I192-F204 HydrophobicContact CB-CZ 4.16Å; I192-F204 HydrophobicContact CG1-CD1 4.21Å; I192-F204 HydrophobicContact CG1-CE1 3.79Å; I192-F204 HydrophobicContact CG1-CZ 4.13Å; I192-F204 HydrophobicContact CG2-CE1 4.42Å; I192-F204 HydrophobicContact CG2-CE2 4.32Å; I192-F204 HydrophobicContact CG2-CZ 3.9Å; L195-F204 HydrophobicContact CB-CE1 4.14Å; L195-F204 HydrophobicContact CB-CZ 4.04Å; L195-F204 HydrophobicContact CD2-CD1 4.03Å; L195-F204 HydrophobicContact CD2-CE1 3.31Å; L195-F204 HydrophobicContact CD2-CE2 4.46Å; L195-F204 HydrophobicContact CD2-CZ 3.58Å; L195-F204 HydrophobicContact CG-CE1 4.3Å; L195-F204 HydrophobicContact CG-CZ 4.24Å; V196-F204 HydrophobicContact CG2-CE2 4.06Å; V196-F204 HydrophobicContact CG2-CZ 4.02Å; T202-F204 WeakPolarHBondContact OG1-CE2 3Å; F204-F206 HydrophobicContact CB-CE2 3.87Å; F204-A238 HydrophobicContact CE2-CB 4.27Å; F204-I239 PolarHBondContact N-O 3.29Å; F204-F240 HydrophobicContact CB-CD1 3.78Å; F204-F240 HydrophobicContact CB-CE1 4.03Å; F204-F240 AromaticContact CD2-CD1 3.97Å; F204-F240 HydrophobicContact CD2-CD1 3.97Å; F204-F240 AromaticContact CD2-CE1 3.5Å; F204-F240 HydrophobicContact CD2-CE1 3.5Å; F204-F240 VanDerWaalsContact CD2-CE1 3.5Å; F204-F240 AromaticContact CD2-CZ 3.81Å; F204-F240 HydrophobicContact CD2-CZ 3.81Å; F204-F240 HydrophobicContact CE2-CE1 4.19Å; F204-F240 HydrophobicContact CE2-CZ 4.16Å; F204-F240 HydrophobicContact CG-CD1 4.19Å; F204-F240 AromaticContact CG-CE1 3.93Å; F204-F240 HydrophobicContact CG-CE1 3.93Å; F204-F240 WeakPolarHBondContact O-CA 3.37Å; F204-I241 PolarHBondContact O-N 3.49Å
205	I	98.3	Very high	93	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.7	177.5	-55	169.8	0	0	0	108.1	A149 V166 R167 L168 F169 L203 I241 L243	A149-I205 HydrophobicContact CB-CD1 4.3Å; A149-I205 HydrophobicContact CB-CG2 4.39Å; V166-I205 HydrophobicContact CG1-CD1 4.29Å; R167-I205 PolarHBondContact O-N 2.88Å; L168-I205 CarbonylContact C-O 3.53Å; L168-I205 WeakPolarHBondContact CA-O 3.23Å; L168-I205 HydrophobicContact CD1-CB 3.79Å; L168-I205 HydrophobicContact CD1-CG2 3.62Å; F169-I205 PolarHBondContact N-O 2.84Å; L203-I205 HydrophobicContact CD1-CG1 4.19Å; L203-I205 HydrophobicContact CD2-CD1 4.17Å; L203-I205 HydrophobicContact CD2-CG1 4.38Å; L203-I205 HydrophobicContact CG-CD1 4.34Å; L203-I205 HydrophobicContact CG-CG1 4.03Å; I205-I241 CarbonylContact C-O 3.5Å; I205-I241 WeakPolarHBondContact CA-O 3.29Å; I205-I241 HydrophobicContact CG1-CB 4.46Å; I205-L243 HydrophobicContact CG2-CD1 3.94Å; I205-L243 HydrophobicContact CG2-CG 4.25Å
206	F	97.2	Very high	92.8	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	101.6	174.6	-68.4	-89.3	0	0	0	109.1	F169 L188 F204 A209 L212 I220 F240 I241 F242 L243	F169-F206 HydrophobicContact CB-CD1 3.83Å; F169-F206 HydrophobicContact CB-CE1 4.05Å; F169-F206 HydrophobicContact CD2-CD1 4.17Å; F169-F206 AromaticContact CD2-CE1 3.66Å; F169-F206 HydrophobicContact CD2-CE1 3.66Å; F169-F206 HydrophobicContact CD2-CE2 4.46Å; F169-F206 AromaticContact CD2-CZ 3.83Å; F169-F206 HydrophobicContact CD2-CZ 3.83Å; F169-F206 HydrophobicContact CE2-CE1 4.37Å; F169-F206 HydrophobicContact CE2-CZ 4.24Å; F169-F206 HydrophobicContact CG-CD1 4.35Å; F169-F206 HydrophobicContact CG-CE1 4.07Å; F169-F206 CarbonylContact O-C 3.24Å; F169-F206 WeakPolarHBondContact O-CA 3.25Å; L188-F206 HydrophobicContact CD1-CE1 4.09Å; L188-F206 HydrophobicContact CD1-CZ 4.26Å; F204-F206 HydrophobicContact CB-CE2 3.87Å; F206-A209 HydrophobicContact CB-CB 4.46Å; F206-L212 HydrophobicContact CB-CD1 4.28Å; F206-L212 HydrophobicContact CD1-CD1 3.95Å; F206-L212 HydrophobicContact CG-CD1 4.41Å; F206-I220 HydrophobicContact CE1-CD1 4.28Å; F206-I220 HydrophobicContact CE2-CD1 4.25Å; F206-I220 HydrophobicContact CZ-CD1 3.96Å; F206-F240 HydrophobicContact CE2-CD1 4.02Å; F206-I241 PolarHBondContact N-O 3.36Å; F206-F242 HydrophobicContact CB-CD1 3.56Å; F206-F242 HydrophobicContact CB-CE1 3.84Å; F206-F242 HydrophobicContact CB-CG 4.45Å; F206-F242 HydrophobicContact CD1-CE1 4.45Å; F206-F242 HydrophobicContact CD2-CD1 4Å; F206-F242 AromaticContact CD2-CE1 3.5Å; F206-F242 HydrophobicContact CD2-CE1 3.5Å; F206-F242 VanDerWaalsContact CD2-CE1 3.5Å; F206-F242 AromaticContact CD2-CZ 3.89Å; F206-F242 HydrophobicContact CD2-CZ 3.89Å; F206-F242 HydrophobicContact CE2-CE1 4.16Å; F206-F242 HydrophobicContact CE2-CZ 4.25Å; F206-F242 AromaticContact CG-CD1 3.96Å; F206-F242 HydrophobicContact CG-CD1 3.96Å; F206-F242 AromaticContact CG-CE1 3.67Å; F206-F242 HydrophobicContact CG-CE1 3.67Å; F206-F242 HydrophobicContact CG-CZ 4.5Å; F206-L243 PolarHBondContact O-N 3.02Å
207	D	96.3	Very high	92.6	Very high	21 Å²	21	34.2 Å²	34.2	11%	0.112	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	144.3	178	-167	21.9	0	0	0	111.2	N146 L168 F169 I170 A171 A209 L243	N146-D207 PolarHBondContact ND2-OD1 2.74Å; N146-D207 PolarHBondContact ND2-OD2 2.99Å; N146-D207 PolarHBondContact OD1-OD2 2.97Å; L168-D207 HydrophobicContact CD1-CB 4.2Å; F169-D207 PolarHBondContact O-N 3.05Å; I170-D207 HydrophobicContact CG1-CB 4.16Å; A171-D207 PolarHBondContact N-O 3.23Å; D207-A209 VanDerWaalsContact C-N 3.27Å; D207-A209 PolarHBondContact O-N 3.43Å; D207-L243 HydrophobicContact CB-CD1 4.17Å
208	E	92.7	Very high	92.3	Very high	42 Å²	42	32.6 Å²	32.6	20%	0.196	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	45	-171.5	-59.7	-83	169.3	0	0	111.5	A171 P172 E210 K211 L243	A171-E208 VanDerWaalsContact CB-O 3.3Å; A171-E208 WeakPolarHBondContact CB-O 3.19Å; P172-E208 HydrophobicContact CG-CB 4.42Å; E208-E210 VanDerWaalsContact CA-OE2 3.3Å; E208-E210 WeakPolarHBondContact CA-OE2 3.32Å; E208-E210 PolarHBondContact O-N 3.3Å; E208-E210 VanDerWaalsContact O-N 3.16Å; E208-K211 HydrophobicContact CB-CD 4.26Å; E208-K211 WeakPolarHBondContact O-CB 3.29Å; E208-K211 PolarHBondContact O-N 3.36Å; E208-K211 WeakPolarHBondContact OE2-CE 3.48Å; E208-K211 IonicContact OE2-NZ 2.68Å; E208-K211 PolarHBondContact OE2-NZ 3.5Å; E208-L243 PolarHBondContact N-O 3.47Å
209	A	91.4	Very high	92.3	Very high	3 Å²	3	25.9 Å²	25.9	3%	0.025	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-60.7	-23.8	-174.2	0	0	0	0	0	113.4	F206 D207 K211 L212 F242 L243	F206-A209 HydrophobicContact CB-CB 4.46Å; D207-A209 VanDerWaalsContact C-N 3.27Å; D207-A209 PolarHBondContact O-N 3.43Å; A209-K211 PolarHBondContact O-N 2.69Å; A209-L212 HydrophobicContact CB-CD1 4.18Å; A209-L212 WeakPolarHBondContact O-CB 3.13Å; A209-L212 PolarHBondContact O-N 3.36Å; A209-L212 VanDerWaalsContact O-N 3.13Å; A209-F242 HydrophobicContact CB-CB 4.12Å; A209-F242 HydrophobicContact CB-CD1 3.98Å; A209-L243 PolarHBondContact N-O 3.31Å
210	E	87.6	Confident	92.3	Very high	35 Å²	35	25.8 Å²	25.8	16%	0.164	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-63	-19.1	171.6	69.9	-86.5	-142	0	0	113.8	E208 S244 N245 I246	E208-E210 VanDerWaalsContact CA-OE2 3.3Å; E208-E210 WeakPolarHBondContact CA-OE2 3.32Å; E208-E210 PolarHBondContact O-N 3.3Å; E208-E210 VanDerWaalsContact O-N 3.16Å; E210-S244 VanDerWaalsContact OE2-CA 3.28Å; E210-S244 WeakPolarHBondContact OE2-CA 3.39Å; E210-N245 VanDerWaalsContact OE1-CB 3.22Å; E210-N245 WeakPolarHBondContact OE1-CB 3.37Å; E210-N245 PolarHBondContact OE1-N 3.04Å; E210-N245 PolarHBondContact OE1-ND2 2.91Å; E210-N245 PolarHBondContact OE2-N 3.43Å; E210-I246 HydrophobicContact CB-CD1 3.36Å; E210-I246 HydrophobicContact CB-CG1 3.59Å; E210-I246 HydrophobicContact CG-CG1 4.34Å
211	K	90.1	Very high	92.4	Very high	120 Å²	120	23.5 Å²	23.5	52%	0.522	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-94.8	-2.9	177.4	-59.8	-179.2	179.3	142.9	0	112.6	A171 P172 E208 A209	A171-K211 HydrophobicContact CB-CB 4.28Å; P172-K211 HydrophobicContact CB-CD 4.47Å; P172-K211 HydrophobicContact CG-CD 4.31Å; E208-K211 HydrophobicContact CB-CD 4.26Å; E208-K211 WeakPolarHBondContact O-CB 3.29Å; E208-K211 PolarHBondContact O-N 3.36Å; E208-K211 WeakPolarHBondContact OE2-CE 3.48Å; E208-K211 IonicContact OE2-NZ 2.68Å; E208-K211 PolarHBondContact OE2-NZ 3.5Å; A209-K211 PolarHBondContact O-N 2.69Å
212	L	90.2	Very high	92.2	Very high	9 Å²	9	25.7 Å²	25.7	5%	0.047	13%	0.134	C	C	.	.	S	Bend	trans	-67.3	135	175	-73	170.1	0	0	0	109.9	A171 F175 F206 A209 L216 I217	A171-L212 HydrophobicContact CB-CD2 3.54Å; A171-L212 HydrophobicContact CB-CG 3.71Å; F175-L212 HydrophobicContact CD2-CD2 3.56Å; F175-L212 HydrophobicContact CE2-CD2 3.9Å; F206-L212 HydrophobicContact CB-CD1 4.28Å; F206-L212 HydrophobicContact CD1-CD1 3.95Å; F206-L212 HydrophobicContact CG-CD1 4.41Å; A209-L212 HydrophobicContact CB-CD1 4.18Å; A209-L212 WeakPolarHBondContact O-CB 3.13Å; A209-L212 PolarHBondContact O-N 3.36Å; A209-L212 VanDerWaalsContact O-N 3.13Å; L212-L216 HydrophobicContact CD2-CD1 4.26Å; L212-I217 HydrophobicContact CB-CD1 4.22Å; L212-I217 HydrophobicContact CB-CG1 4.11Å; L212-I217 HydrophobicContact CD1-CG1 4.48Å
213	H	89.7	Confident	92.1	Very high	82 Å²	82	25.9 Å²	25.9	38%	0.38	14%	0.135	S	C	.	.			trans	-64.9	136	173.1	-169.8	-74.2	0	0	0	109.5	L181 G215 L216 I217	L181-H213 HydrophobicContact CD1-CB 4.02Å; L181-H213 VanDerWaalsContact CD2-CE1 3.46Å; L181-H213 WeakPolarHBondContact CD2-CE1 3.24Å; H213-G215 VanDerWaalsContact C-N 3.27Å; H213-G215 PolarHBondContact ND1-N 2.98Å; H213-G215 VanDerWaalsContact ND1-N 3.14Å; H213-G215 PolarHBondContact O-N 3.01Å; H213-L216 HydrophobicContact CB-CD1 4.38Å; H213-L216 HydrophobicContact CB-CG 4.43Å; H213-L216 WeakPolarHBondContact O-CB 3.44Å; H213-L216 PolarHBondContact O-N 3.32Å; H213-I217 PolarHBondContact O-N 3.36Å
214	P	87.3	Confident	91.8	Very high	44 Å²	44	25.9 Å²	25.9	29%	0.286	14%	0.135	S	C	.	.	H	α-helix	trans	-51	-44	-178.8	-30	35.3	0	0	0	113.6	L216 I217 D218 A289	P214-L216 PolarHBondContact O-N 2.93Å; P214-L216 VanDerWaalsContact O-N 3.1Å; P214-I217 CarbonylContact O-C 3.6Å; P214-I217 WeakPolarHBondContact O-CA 3.26Å; P214-I217 VanDerWaalsContact O-CB 3.3Å; P214-I217 WeakPolarHBondContact O-CB 3.03Å; P214-I217 PolarHBondContact O-N 2.74Å; P214-D218 PolarHBondContact O-N 2.78Å; P214-A289 HydrophobicContact CG-CB 4.39Å
215	G	89.7	Confident	91.3	Very high	7 Å²	7	28.4 Å²	28.4	7%	0.072	15%	0.148	C	C	.	.	H	α-helix	trans	-57.7	-25.4	174.5	0	0	0	0	0	116.1	K185 H213 A219	K185-G215 WeakPolarHBondContact CE-O 3.49Å; H213-G215 VanDerWaalsContact C-N 3.27Å; H213-G215 PolarHBondContact ND1-N 2.98Å; H213-G215 VanDerWaalsContact ND1-N 3.14Å; H213-G215 PolarHBondContact O-N 3.01Å; G215-A219 PolarHBondContact O-N 3.43Å
216	L	91.9	Very high	90.7	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-75	-35.3	171.8	-70.3	173.5	0	0	0	111.5	F175 L181 K185 L188 L212 H213 P214 A219 I220	F175-L216 HydrophobicContact CB-CD1 3.73Å; F175-L216 HydrophobicContact CD1-CD1 4.01Å; F175-L216 HydrophobicContact CD2-CD1 3.82Å; F175-L216 HydrophobicContact CE2-CD1 4.45Å; F175-L216 HydrophobicContact CG-CD1 3.57Å; L181-L216 HydrophobicContact CD1-CD1 4.46Å; L181-L216 HydrophobicContact CD1-CD2 3.96Å; L181-L216 HydrophobicContact CD1-CG 3.67Å; K185-L216 HydrophobicContact CG-CD2 3.92Å; L188-L216 HydrophobicContact CD2-CB 4.45Å; L188-L216 HydrophobicContact CD2-CD2 4.33Å; L212-L216 HydrophobicContact CD2-CD1 4.26Å; H213-L216 HydrophobicContact CB-CD1 4.38Å; H213-L216 HydrophobicContact CB-CG 4.43Å; H213-L216 WeakPolarHBondContact O-CB 3.44Å; H213-L216 PolarHBondContact O-N 3.32Å; P214-L216 PolarHBondContact O-N 2.93Å; P214-L216 VanDerWaalsContact O-N 3.1Å; L216-A219 WeakPolarHBondContact O-CB 3.5Å; L216-A219 PolarHBondContact O-N 3.33Å; L216-I220 PolarHBondContact O-N 2.88Å
217	I	89	Confident	90.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-47.7	174.5	-60.6	-164.7	0	0	0	109.7	L212 H213 P214 A219 I220 K221 A289 L293	L212-I217 HydrophobicContact CB-CD1 4.22Å; L212-I217 HydrophobicContact CB-CG1 4.11Å; L212-I217 HydrophobicContact CD1-CG1 4.48Å; H213-I217 PolarHBondContact O-N 3.36Å; P214-I217 CarbonylContact O-C 3.6Å; P214-I217 WeakPolarHBondContact O-CA 3.26Å; P214-I217 VanDerWaalsContact O-CB 3.3Å; P214-I217 WeakPolarHBondContact O-CB 3.03Å; P214-I217 PolarHBondContact O-N 2.74Å; I217-A219 PolarHBondContact O-N 3.2Å; I217-A219 VanDerWaalsContact O-N 3.14Å; I217-I220 WeakPolarHBondContact O-CG1 3.31Å; I217-I220 PolarHBondContact O-N 3.1Å; I217-K221 HydrophobicContact CG2-CG 4.44Å; I217-K221 WeakPolarHBondContact O-CG 3.21Å; I217-K221 PolarHBondContact O-N 3.13Å; I217-A289 HydrophobicContact CD1-CB 3.18Å; I217-A289 WeakPolarHBondContact CD1-O 3.47Å; I217-A289 HydrophobicContact CG1-CB 4.27Å; I217-L293 HydrophobicContact CD1-CD1 4.12Å; I217-L293 HydrophobicContact CG2-CD1 3.68Å; I217-L293 HydrophobicContact CG2-CD2 3.49Å; I217-L293 VanDerWaalsContact CG2-CD2 3.49Å; I217-L293 HydrophobicContact CG2-CG 3.43Å; I217-L293 VanDerWaalsContact CG2-CG 3.43Å
218	D	87.6	Confident	89.6	Confident	71 Å²	71	43 Å²	43	38%	0.38	21%	0.214	S	C	.	.	H	α-helix	trans	-52.4	-37.6	173.5	-69.4	-38.4	0	0	0	112.8	P214 I220 K221	P214-D218 PolarHBondContact O-N 2.78Å; D218-I220 VanDerWaalsContact C-N 3.27Å; D218-I220 PolarHBondContact O-N 3.07Å; D218-K221 WeakPolarHBondContact OD1-CE 3.38Å; D218-K221 IonicContact OD1-NZ 3.75Å; D218-K221 PolarHBondContact OD1-NZ 3.21Å
219	A	91.1	Very high	89.4	Confident	16 Å²	16	45.3 Å²	45.3	13%	0.132	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-21.6	179.7	0	0	0	0	0	113.5	K185 G215 L216 I217 Y223	K185-A219 HydrophobicContact CB-CB 4.24Å; K185-A219 HydrophobicContact CD-CB 4.49Å; K185-A219 HydrophobicContact CG-CB 3.93Å; G215-A219 PolarHBondContact O-N 3.43Å; L216-A219 WeakPolarHBondContact O-CB 3.5Å; L216-A219 PolarHBondContact O-N 3.33Å; I217-A219 PolarHBondContact O-N 3.2Å; I217-A219 VanDerWaalsContact O-N 3.14Å; A219-Y223 WeakPolarHBondContact O-CE2 3.47Å
220	I	92.3	Very high	89.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-103	-17.6	179	64.2	171.4	0	0	0	114.1	L188 I192 F206 L216 I217 D218 P222 Y223 M224 F242	L188-I220 HydrophobicContact CD1-CG2 4.45Å; L188-I220 HydrophobicContact CD2-CG2 3.44Å; L188-I220 VanDerWaalsContact CD2-CG2 3.44Å; L188-I220 HydrophobicContact CG-CG2 3.76Å; I192-I220 HydrophobicContact CD1-CB 4.39Å; I192-I220 HydrophobicContact CD1-CG2 3.56Å; F206-I220 HydrophobicContact CE1-CD1 4.28Å; F206-I220 HydrophobicContact CE2-CD1 4.25Å; F206-I220 HydrophobicContact CZ-CD1 3.96Å; L216-I220 PolarHBondContact O-N 2.88Å; I217-I220 WeakPolarHBondContact O-CG1 3.31Å; I217-I220 PolarHBondContact O-N 3.1Å; D218-I220 VanDerWaalsContact C-N 3.27Å; D218-I220 PolarHBondContact O-N 3.07Å; I220-P222 VanDerWaalsContact C-N 3.31Å; I220-Y223 HydrophobicContact CB-CD2 4.29Å; I220-Y223 HydrophobicContact CG2-CD2 4.5Å; I220-Y223 WeakPolarHBondContact O-CB 3.45Å; I220-Y223 PolarHBondContact O-N 3.25Å; I220-M224 HydrophobicContact CD1-SD 4.24Å; I220-M224 HydrophobicContact CG1-SD 4.34Å; I220-F242 HydrophobicContact CD1-CE1 3.9Å; I220-F242 HydrophobicContact CD1-CZ 3.84Å
221	K	90.8	Very high	89.3	Confident	29 Å²	29	49.2 Å²	49.2	13%	0.126	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-45.6	-46.2	177.6	-73.7	-179.4	-176.2	164.2	0	113.7	I217 D218 Y223 M224 D225 E292 L293 D296 L298	I217-K221 HydrophobicContact CG2-CG 4.44Å; I217-K221 WeakPolarHBondContact O-CG 3.21Å; I217-K221 PolarHBondContact O-N 3.13Å; D218-K221 WeakPolarHBondContact OD1-CE 3.38Å; D218-K221 IonicContact OD1-NZ 3.75Å; D218-K221 PolarHBondContact OD1-NZ 3.21Å; K221-Y223 PolarHBondContact O-N 3.34Å; K221-Y223 VanDerWaalsContact O-N 3.13Å; K221-M224 PolarHBondContact O-N 3.32Å; K221-D225 PolarHBondContact O-N 3.28Å; K221-E292 IonicContact NZ-OE2 2.72Å; K221-E292 PolarHBondContact NZ-OE2 2.98Å; K221-L293 HydrophobicContact CG-CD2 4.1Å; K221-D296 IonicContact NZ-OD2 3.51Å; K221-L298 HydrophobicContact CB-CD1 3.81Å; K221-L298 HydrophobicContact CD-CD1 4.11Å; K221-L298 HydrophobicContact CG-CD1 3.58Å
222	P	91.6	Very high	89.3	Confident	46 Å²	46	46.6 Å²	46.6	30%	0.299	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.9	-29.6	-178.9	-24.4	35.5	0	0	0	113.5	I220 M224 Y227 V230	I220-P222 VanDerWaalsContact C-N 3.31Å; P222-M224 PolarHBondContact O-N 3.1Å; P222-Y227 WeakPolarHBondContact O-CD2 3.45Å; P222-V230 HydrophobicContact CB-CG1 4.21Å; P222-V230 HydrophobicContact CB-CG2 4.25Å; P222-V230 WeakPolarHBondContact O-CG2 3.36Å
223	Y	92.7	Very high	89.4	Confident	6 Å²	6	46.8 Å²	46.8	2%	0.024	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-79.1	-5.9	-179.7	-50.4	-53.6	0	0	0	113.4	P132 R189 I192 A219 I220 K221 V230 Y235 F240	P132-Y223 WeakPolarHBondContact CG-O 3.25Å; R189-Y223 HydrophobicContact CG-CE2 4.16Å; R189-Y223 PolarHBondContact NE-OH 3.19Å; I192-Y223 HydrophobicContact CD1-CD2 4.08Å; I192-Y223 HydrophobicContact CD1-CE2 4.4Å; I192-Y223 HydrophobicContact CG2-CD2 4.02Å; I192-Y223 HydrophobicContact CG2-CE2 4.38Å; I192-Y223 HydrophobicContact CG2-CG 4.2Å; A219-Y223 WeakPolarHBondContact O-CE2 3.47Å; I220-Y223 HydrophobicContact CB-CD2 4.29Å; I220-Y223 HydrophobicContact CG2-CD2 4.5Å; I220-Y223 WeakPolarHBondContact O-CB 3.45Å; I220-Y223 PolarHBondContact O-N 3.25Å; K221-Y223 PolarHBondContact O-N 3.34Å; K221-Y223 VanDerWaalsContact O-N 3.13Å; Y223-V230 HydrophobicContact CD1-CB 4.07Å; Y223-V230 HydrophobicContact CD1-CG1 4.08Å; Y223-V230 HydrophobicContact CD1-CG2 4.3Å; Y223-V230 HydrophobicContact CE1-CB 4.05Å; Y223-V230 HydrophobicContact CE1-CG1 3.66Å; Y223-Y235 AromaticContact CD1-CD1 3.97Å; Y223-Y235 HydrophobicContact CD1-CD1 3.97Å; Y223-Y235 AromaticContact CD1-CD2 3.92Å; Y223-Y235 HydrophobicContact CD1-CD2 3.92Å; Y223-Y235 AromaticContact CD1-CE1 3.62Å; Y223-Y235 HydrophobicContact CD1-CE1 3.62Å; Y223-Y235 AromaticContact CD1-CE2 3.57Å; Y223-Y235 HydrophobicContact CD1-CE2 3.57Å; Y223-Y235 HydrophobicContact CD1-CG 4.12Å; Y223-Y235 AromaticContact CD1-CZ 3.39Å; Y223-Y235 HydrophobicContact CE1-CE1 4.15Å; Y223-Y235 AromaticContact CE1-CE2 3.95Å; Y223-Y235 HydrophobicContact CE1-CE2 3.95Å; Y223-Y235 AromaticContact CE1-CZ 3.61Å; Y223-Y235 HydrophobicContact CG-CD1 4.26Å; Y223-Y235 HydrophobicContact CG-CE1 4.14Å; Y223-F240 WeakPolarHBondContact O-CE2 3.18Å
224	M	91.6	Very high	89.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-112.9	-7.6	-178	-62.2	170.1	55	0	0	112.9	K131 T134 I220 K221 P222 F240 F242 L293 L298	K131-M224 WeakPolarHBondContact CE-O 3.46Å; T134-M224 HydrophobicContact CG2-CE 3.32Å; I220-M224 HydrophobicContact CD1-SD 4.24Å; I220-M224 HydrophobicContact CG1-SD 4.34Å; K221-M224 PolarHBondContact O-N 3.32Å; P222-M224 PolarHBondContact O-N 3.1Å; M224-F240 HydrophobicContact CG-CD1 4.24Å; M224-F240 HydrophobicContact CG-CD2 3.92Å; M224-F240 HydrophobicContact CG-CE1 4.33Å; M224-F240 HydrophobicContact CG-CE2 3.99Å; M224-F240 HydrophobicContact CG-CG 4.05Å; M224-F240 HydrophobicContact CG-CZ 4.21Å; M224-F242 HydrophobicContact CE-CE2 3.44Å; M224-F242 VanDerWaalsContact CE-CE2 3.44Å; M224-F242 HydrophobicContact CE-CZ 3.82Å; M224-F242 HydrophobicContact SD-CE2 3.89Å; M224-F242 HydrophobicContact SD-CZ 3.66Å; M224-L293 HydrophobicContact CE-CD2 4.08Å; M224-L293 HydrophobicContact SD-CD2 4.34Å; M224-L298 HydrophobicContact CB-CD2 4.46Å; M224-L298 HydrophobicContact CE-CB 4.23Å
225	D	88.9	Confident	89.9	Confident	52 Å²	52	44 Å²	44	28%	0.278	25%	0.248	S	C	.	.	S	Bend	trans	-88.4	178.1	-178.5	-154.7	-10.3	0	0	0	111.7	K221 Y227 L298	K221-D225 PolarHBondContact O-N 3.28Å; D225-Y227 HydrophobicContact CB-CD2 3.78Å; D225-Y227 HydrophobicContact CB-CE2 3.79Å; D225-Y227 PolarHBondContact O-N 2.84Å; D225-L298 HydrophobicContact CB-CD2 3.75Å
226	H	85.4	Confident	90	Very high	106 Å²	106	46.2 Å²	46.2	49%	0.491	25%	0.254	S	S	.	.	S	Bend	trans	-79.4	26.9	-175.6	-58.5	78.3	0	0	0	113.6
227	Y	86.5	Confident	90.1	Very high	128 Å²	128	49.4 Å²	49.4	50%	0.502	27%	0.266	S	S	.	.			trans	-76.1	137.7	178.5	-64	-60.3	0	0	0	111.2	P222 D225 N229 V230	P222-Y227 WeakPolarHBondContact O-CD2 3.45Å; D225-Y227 HydrophobicContact CB-CD2 3.78Å; D225-Y227 HydrophobicContact CB-CE2 3.79Å; D225-Y227 PolarHBondContact O-N 2.84Å; Y227-N229 VanDerWaalsContact C-N 3.28Å; Y227-N229 PolarHBondContact O-N 2.87Å; Y227-V230 HydrophobicContact CD2-CG2 4.19Å; Y227-V230 HydrophobicContact CG-CG2 4.49Å
228	D	83.3	Confident	90.4	Very high	101 Å²	101	49.3 Å²	49.3	54%	0.54	27%	0.266	S	S	.	.	S	Bend	trans	-60.3	-43.5	174.8	-62.7	-5.3	0	0	0	111.3	S234 R236	D228-S234 WeakPolarHBondContact O-CB 3.37Å; D228-S234 PolarHBondContact O-OG 3.28Å; D228-R236 VanDerWaalsContact CG-NH2 3.34Å; D228-R236 IonicContact OD1-CZ 3.68Å; D228-R236 IonicContact OD1-NH2 2.59Å; D228-R236 PolarHBondContact OD1-NH2 3.27Å
229	N	88.3	Confident	90.9	Very high	90 Å²	90	46 Å²	46	48%	0.481	25%	0.248	S	C	.	.			trans	-149.8	154	174.4	63.8	82.1	0	0	0	110.6	Y227 G232 V233	Y227-N229 VanDerWaalsContact C-N 3.28Å; Y227-N229 PolarHBondContact O-N 2.87Å; N229-G232 PolarHBondContact OD1-N 3.46Å; N229-V233 CarbonylContact C-O 3.49Å; N229-V233 WeakPolarHBondContact CA-O 3.27Å; N229-V233 WeakPolarHBondContact CB-O 3.31Å
230	V	89.6	Confident	91.2	Very high	20 Å²	20	45.2 Å²	45.2	12%	0.121	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-122.1	123.3	167.8	-176.9	0	0	0	0	106.9	P222 Y223 Y227 G232 V233 Y235	P222-V230 HydrophobicContact CB-CG1 4.21Å; P222-V230 HydrophobicContact CB-CG2 4.25Å; P222-V230 WeakPolarHBondContact O-CG2 3.36Å; Y223-V230 HydrophobicContact CD1-CB 4.07Å; Y223-V230 HydrophobicContact CD1-CG1 4.08Å; Y223-V230 HydrophobicContact CD1-CG2 4.3Å; Y223-V230 HydrophobicContact CE1-CB 4.05Å; Y223-V230 HydrophobicContact CE1-CG1 3.66Å; Y227-V230 HydrophobicContact CD2-CG2 4.19Å; Y227-V230 HydrophobicContact CG-CG2 4.49Å; V230-G232 PolarHBondContact O-N 2.82Å; V230-V233 PolarHBondContact N-O 2.83Å; V230-V233 PolarHBondContact O-N 3.14Å; V230-V233 VanDerWaalsContact O-N 3.12Å; V230-Y235 HydrophobicContact CB-CD2 4.06Å; V230-Y235 HydrophobicContact CB-CE2 3.68Å; V230-Y235 HydrophobicContact CG2-CD2 4.18Å; V230-Y235 HydrophobicContact CG2-CE2 4.29Å
231	D	88.6	Confident	91.5	Very high	100 Å²	100	45.1 Å²	45.1	54%	0.535	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	36.4	-175	-58	-35.4	0	0	0	112.9	R189 V233	R189-D231 IonicContact NH2-OD2 2.84Å; R189-D231 PolarHBondContact NH2-OD2 3.21Å; D231-V233 VanDerWaalsContact C-N 3.32Å; D231-V233 PolarHBondContact O-N 3.45Å
232	G	89.1	Confident	91.7	Very high	65 Å²	65	43.9 Å²	43.9	67%	0.67	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	6.4	178.8	0	0	0	0	0	115.5	N229 V230	N229-G232 PolarHBondContact OD1-N 3.46Å; V230-G232 PolarHBondContact O-N 2.82Å
233	V	92.3	Very high	91.9	Very high	14 Å²	14	41.8 Å²	41.8	9%	0.085	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-114.6	135.3	178	-176.7	0	0	0	0	110	R193 V196 L197 N229 V230 D231 Y235	R193-V233 HydrophobicContact CG-CG2 4.49Å; V196-V233 HydrophobicContact CB-CG1 4.29Å; V196-V233 HydrophobicContact CG1-CG1 3.57Å; L197-V233 HydrophobicContact CD2-CG1 4.22Å; L197-V233 HydrophobicContact CD2-CG2 3.82Å; L197-V233 HydrophobicContact CG-CG2 4.37Å; N229-V233 CarbonylContact C-O 3.49Å; N229-V233 WeakPolarHBondContact CA-O 3.27Å; N229-V233 WeakPolarHBondContact CB-O 3.31Å; V230-V233 PolarHBondContact N-O 2.83Å; V230-V233 PolarHBondContact O-N 3.14Å; V230-V233 VanDerWaalsContact O-N 3.12Å; D231-V233 VanDerWaalsContact C-N 3.32Å; D231-V233 PolarHBondContact O-N 3.45Å; V233-Y235 HydrophobicContact CB-CE2 3.94Å; V233-Y235 HydrophobicContact CG1-CE2 4.15Å; V233-Y235 VanDerWaalsContact O-CD2 3.26Å; V233-Y235 WeakPolarHBondContact O-CD2 3.42Å; V233-Y235 WeakPolarHBondContact O-CE2 3.44Å
234	S	92.8	Very high	91.9	Very high	59 Å²	59	41.5 Å²	41.5	41%	0.413	22%	0.221	S	C	.	.			trans	-88.6	132.7	176.1	-164.5	0	0	0	0	111.5	V196 D228	V196-S234 VanDerWaalsContact CG1-O 3.29Å; V196-S234 WeakPolarHBondContact CG1-O 3.32Å; D228-S234 WeakPolarHBondContact O-CB 3.37Å; D228-S234 PolarHBondContact O-OG 3.28Å
235	Y	94.5	Very high	91.9	Very high	7 Å²	7	44 Å²	44	3%	0.027	23%	0.234	C	C	.	.			trans	-106.8	1.7	179.4	-63.3	-91.7	0	0	0	112.4	P132 I192 V196 Y223 V230 V233 R237 A238	P132-Y235 WeakPolarHBondContact CB-O 3.31Å; I192-Y235 HydrophobicContact CG2-CD1 4.28Å; I192-Y235 HydrophobicContact CG2-CE1 3.72Å; V196-Y235 HydrophobicContact CB-CD1 4.39Å; V196-Y235 HydrophobicContact CB-CE1 4.13Å; V196-Y235 HydrophobicContact CG1-CD1 4.24Å; V196-Y235 HydrophobicContact CG1-CE1 4.26Å; V196-Y235 HydrophobicContact CG2-CD1 3.74Å; V196-Y235 HydrophobicContact CG2-CE1 3.75Å; Y223-Y235 AromaticContact CD1-CD1 3.97Å; Y223-Y235 HydrophobicContact CD1-CD1 3.97Å; Y223-Y235 AromaticContact CD1-CD2 3.92Å; Y223-Y235 HydrophobicContact CD1-CD2 3.92Å; Y223-Y235 AromaticContact CD1-CE1 3.62Å; Y223-Y235 HydrophobicContact CD1-CE1 3.62Å; Y223-Y235 AromaticContact CD1-CE2 3.57Å; Y223-Y235 HydrophobicContact CD1-CE2 3.57Å; Y223-Y235 HydrophobicContact CD1-CG 4.12Å; Y223-Y235 AromaticContact CD1-CZ 3.39Å; Y223-Y235 HydrophobicContact CE1-CE1 4.15Å; Y223-Y235 AromaticContact CE1-CE2 3.95Å; Y223-Y235 HydrophobicContact CE1-CE2 3.95Å; Y223-Y235 AromaticContact CE1-CZ 3.61Å; Y223-Y235 HydrophobicContact CG-CD1 4.26Å; Y223-Y235 HydrophobicContact CG-CE1 4.14Å; V230-Y235 HydrophobicContact CB-CD2 4.06Å; V230-Y235 HydrophobicContact CB-CE2 3.68Å; V230-Y235 HydrophobicContact CG2-CD2 4.18Å; V230-Y235 HydrophobicContact CG2-CE2 4.29Å; V233-Y235 HydrophobicContact CB-CE2 3.94Å; V233-Y235 HydrophobicContact CG1-CE2 4.15Å; V233-Y235 VanDerWaalsContact O-CD2 3.26Å; V233-Y235 WeakPolarHBondContact O-CD2 3.42Å; V233-Y235 WeakPolarHBondContact O-CE2 3.44Å; Y235-R237 PolarHBondContact O-N 3.24Å; Y235-A238 WeakPolarHBondContact O-CB 3.45Å; Y235-A238 PolarHBondContact O-N 2.87Å
236	R	93.1	Very high	91.8	Very high	54 Å²	54	42.8 Å²	42.8	20%	0.204	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.9	-173.3	-70.4	176	171.9	-159.2	-0.1	114.9	F123 S129 N130 D228	F123-R236 WeakPolarHBondContact CE2-O 3.3Å; F123-R236 WeakPolarHBondContact CZ-O 3.33Å; S129-R236 WeakPolarHBondContact O-CB 3.5Å; S129-R236 WeakPolarHBondContact O-CD 3.41Å; N130-R236 PolarHBondContact OD1-NH1 3.39Å; D228-R236 VanDerWaalsContact CG-NH2 3.34Å; D228-R236 IonicContact OD1-CZ 3.68Å; D228-R236 IonicContact OD1-NH2 2.59Å; D228-R236 PolarHBondContact OD1-NH2 3.27Å
237	R	93.3	Very high	91.8	Very high	70 Å²	70	37.8 Å²	37.8	26%	0.264	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	2.3	178.1	-67.4	-68.4	-53.4	160.7	5.4	113.8	P200 Q201 Y235	P200-R237 WeakPolarHBondContact O-CB 2.96Å; Q201-R237 WeakPolarHBondContact CG-O 3.37Å; Y235-R237 PolarHBondContact O-N 3.24Å
238	A	95.9	Very high	92	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	149.3	176.4	0	0	0	0	0	111.4	F123 P132 L133 T202 F204 Y235 F240	F123-A238 WeakPolarHBondContact CZ-O 3.3Å; P132-A238 WeakPolarHBondContact CA-O 3.28Å; P132-A238 HydrophobicContact CB-CB 4.26Å; P132-A238 WeakPolarHBondContact CB-O 3.38Å; L133-A238 PolarHBondContact N-O 2.84Å; L133-A238 VanDerWaalsContact N-O 3.11Å; T202-A238 WeakPolarHBondContact OG1-CB 3.43Å; F204-A238 HydrophobicContact CE2-CB 4.27Å; Y235-A238 WeakPolarHBondContact O-CB 3.45Å; Y235-A238 PolarHBondContact O-N 2.87Å; A238-F240 HydrophobicContact CB-CD2 4.4Å; A238-F240 HydrophobicContact CB-CE2 3.71Å; A238-F240 HydrophobicContact CB-CZ 4.21Å
239	I	97.6	Very high	92.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.8	173.6	-55.8	172.1	0	0	0	107.6	F123 L133 L156 Q201 T202 L203 F204 I241	F123-I239 HydrophobicContact CD1-CD1 4.07Å; F123-I239 HydrophobicContact CD1-CG1 3.96Å; F123-I239 HydrophobicContact CE1-CD1 3.9Å; F123-I239 HydrophobicContact CE1-CG1 3.47Å; F123-I239 VanDerWaalsContact CE1-CG1 3.47Å; F123-I239 HydrophobicContact CZ-CG1 4.19Å; L133-I239 HydrophobicContact CB-CG1 4.38Å; L133-I239 HydrophobicContact CB-CG2 4.41Å; L133-I239 HydrophobicContact CD2-CG2 4.15Å; L133-I239 HydrophobicContact CG-CG2 4.38Å; L133-I239 CarbonylContact O-C 3.37Å; L133-I239 WeakPolarHBondContact O-CA 3.32Å; L156-I239 HydrophobicContact CD1-CD1 3.77Å; Q201-I239 HydrophobicContact CG-CD1 4.46Å; T202-I239 PolarHBondContact O-N 3.06Å; L203-I239 CarbonylContact C-O 3.58Å; L203-I239 WeakPolarHBondContact CA-O 3.48Å; L203-I239 HydrophobicContact CD1-CB 3.96Å; L203-I239 HydrophobicContact CD1-CG2 3.76Å; F204-I239 PolarHBondContact N-O 3.29Å; I239-I241 HydrophobicContact CG2-CG1 4.25Å
240	F	97.6	Very high	92.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.5	175.5	-65.1	-89.7	0	0	0	109.5	P132 L133 T134 L135 F204 F206 Y223 M224 A238 F242	P132-F240 HydrophobicContact CB-CD2 3.98Å; P132-F240 HydrophobicContact CB-CE2 3.86Å; P132-F240 HydrophobicContact CG-CD2 4.44Å; P132-F240 HydrophobicContact CG-CE2 4.17Å; L133-F240 PolarHBondContact O-N 2.99Å; T134-F240 WeakPolarHBondContact CA-O 3.28Å; T134-F240 HydrophobicContact CG2-CB 4.39Å; L135-F240 PolarHBondContact N-O 2.74Å; F204-F240 HydrophobicContact CB-CD1 3.78Å; F204-F240 HydrophobicContact CB-CE1 4.03Å; F204-F240 AromaticContact CD2-CD1 3.97Å; F204-F240 HydrophobicContact CD2-CD1 3.97Å; F204-F240 AromaticContact CD2-CE1 3.5Å; F204-F240 HydrophobicContact CD2-CE1 3.5Å; F204-F240 VanDerWaalsContact CD2-CE1 3.5Å; F204-F240 AromaticContact CD2-CZ 3.81Å; F204-F240 HydrophobicContact CD2-CZ 3.81Å; F204-F240 HydrophobicContact CE2-CE1 4.19Å; F204-F240 HydrophobicContact CE2-CZ 4.16Å; F204-F240 HydrophobicContact CG-CD1 4.19Å; F204-F240 AromaticContact CG-CE1 3.93Å; F204-F240 HydrophobicContact CG-CE1 3.93Å; F204-F240 WeakPolarHBondContact O-CA 3.37Å; F206-F240 HydrophobicContact CE2-CD1 4.02Å; Y223-F240 WeakPolarHBondContact O-CE2 3.18Å; M224-F240 HydrophobicContact CG-CD1 4.24Å; M224-F240 HydrophobicContact CG-CD2 3.92Å; M224-F240 HydrophobicContact CG-CE1 4.33Å; M224-F240 HydrophobicContact CG-CE2 3.99Å; M224-F240 HydrophobicContact CG-CG 4.05Å; M224-F240 HydrophobicContact CG-CZ 4.21Å; A238-F240 HydrophobicContact CB-CD2 4.4Å; A238-F240 HydrophobicContact CB-CE2 3.71Å; A238-F240 HydrophobicContact CB-CZ 4.21Å; F240-F242 HydrophobicContact CB-CE2 3.92Å
241	I	97.9	Very high	92.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118.7	174.5	-56.7	-175.7	0	0	0	108.7	L135 F137 I152 L203 F204 I205 F206 I239 L243	L135-I241 HydrophobicContact CB-CG1 4.43Å; L135-I241 HydrophobicContact CD1-CG1 4.44Å; L135-I241 CarbonylContact O-C 3.53Å; L135-I241 WeakPolarHBondContact O-CA 3.22Å; F137-I241 HydrophobicContact CD2-CG2 4.09Å; F137-I241 HydrophobicContact CE1-CG2 4.37Å; F137-I241 HydrophobicContact CE2-CG2 3.88Å; F137-I241 HydrophobicContact CG-CG2 4.39Å; F137-I241 HydrophobicContact CZ-CG2 4.04Å; I152-I241 HydrophobicContact CD1-CD1 3.81Å; I152-I241 HydrophobicContact CG2-CD1 4.19Å; L203-I241 HydrophobicContact CD1-CD1 3.67Å; L203-I241 HydrophobicContact CD1-CG1 3.82Å; F204-I241 PolarHBondContact O-N 3.49Å; I205-I241 CarbonylContact C-O 3.5Å; I205-I241 WeakPolarHBondContact CA-O 3.29Å; I205-I241 HydrophobicContact CG1-CB 4.46Å; F206-I241 PolarHBondContact N-O 3.36Å; I239-I241 HydrophobicContact CG2-CG1 4.25Å; I241-L243 HydrophobicContact CG2-CD2 3.63Å; I241-L243 HydrophobicContact CG2-CG 4.48Å
242	F	96.3	Very high	93	Very high	3 Å²	3	21.1 Å²	21.1	1%	0.013	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131.8	173.4	-64	-86.1	0	0	0	109.9	T134 L135 F137 F206 A209 I220 M224 F240 L293	T134-F242 HydrophobicContact CG2-CD2 4.12Å; T134-F242 HydrophobicContact CG2-CE2 3.89Å; L135-F242 PolarHBondContact O-N 2.89Å; F137-F242 PolarHBondContact N-O 3.36Å; F206-F242 HydrophobicContact CB-CD1 3.56Å; F206-F242 HydrophobicContact CB-CE1 3.84Å; F206-F242 HydrophobicContact CB-CG 4.45Å; F206-F242 HydrophobicContact CD1-CE1 4.45Å; F206-F242 HydrophobicContact CD2-CD1 4Å; F206-F242 AromaticContact CD2-CE1 3.5Å; F206-F242 HydrophobicContact CD2-CE1 3.5Å; F206-F242 VanDerWaalsContact CD2-CE1 3.5Å; F206-F242 AromaticContact CD2-CZ 3.89Å; F206-F242 HydrophobicContact CD2-CZ 3.89Å; F206-F242 HydrophobicContact CE2-CE1 4.16Å; F206-F242 HydrophobicContact CE2-CZ 4.25Å; F206-F242 AromaticContact CG-CD1 3.96Å; F206-F242 HydrophobicContact CG-CD1 3.96Å; F206-F242 AromaticContact CG-CE1 3.67Å; F206-F242 HydrophobicContact CG-CE1 3.67Å; F206-F242 HydrophobicContact CG-CZ 4.5Å; A209-F242 HydrophobicContact CB-CB 4.12Å; A209-F242 HydrophobicContact CB-CD1 3.98Å; I220-F242 HydrophobicContact CD1-CE1 3.9Å; I220-F242 HydrophobicContact CD1-CZ 3.84Å; M224-F242 HydrophobicContact CE-CE2 3.44Å; M224-F242 VanDerWaalsContact CE-CE2 3.44Å; M224-F242 HydrophobicContact CE-CZ 3.82Å; M224-F242 HydrophobicContact SD-CE2 3.89Å; M224-F242 HydrophobicContact SD-CZ 3.66Å; F240-F242 HydrophobicContact CB-CE2 3.92Å; F242-L293 HydrophobicContact CE1-CD1 4.49Å
243	L	95.7	Very high	93.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.9	177.3	-45	179.4	0	0	0	108.6	F137 K145 N146 A149 I205 F206 D207 E208 A209 I241	F137-L243 HydrophobicContact CB-CD2 3.8Å; F137-L243 HydrophobicContact CD2-CD2 3.31Å; F137-L243 HydrophobicContact CE2-CD2 4.11Å; F137-L243 HydrophobicContact CG-CD2 3.82Å; K145-L243 HydrophobicContact CB-CD2 4.35Å; N146-L243 HydrophobicContact CB-CD1 4.45Å; N146-L243 WeakPolarHBondContact OD1-CD1 3.4Å; A149-L243 HydrophobicContact CB-CD1 4.31Å; A149-L243 HydrophobicContact CB-CD2 4.27Å; I205-L243 HydrophobicContact CG2-CD1 3.94Å; I205-L243 HydrophobicContact CG2-CG 4.25Å; F206-L243 PolarHBondContact O-N 3.02Å; D207-L243 HydrophobicContact CB-CD1 4.17Å; E208-L243 PolarHBondContact N-O 3.47Å; A209-L243 PolarHBondContact N-O 3.31Å; I241-L243 HydrophobicContact CG2-CD2 3.63Å; I241-L243 HydrophobicContact CG2-CG 4.48Å
244	S	92.3	Very high	93.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.9	-173.8	177.9	0	0	0	0	112.6	F137 H138 G139 K145 E210 I246 Q290	F137-S244 PolarHBondContact O-N 3.12Å; H138-S244 WeakPolarHBondContact CA-O 3.48Å; G139-S244 PolarHBondContact N-O 3.29Å; K145-S244 VanDerWaalsContact CD-O 3.29Å; K145-S244 WeakPolarHBondContact CD-O 3.28Å; K145-S244 WeakPolarHBondContact CE-O 3.42Å; K145-S244 PolarHBondContact NZ-O 3.14Å; E210-S244 VanDerWaalsContact OE2-CA 3.28Å; E210-S244 WeakPolarHBondContact OE2-CA 3.39Å; S244-I246 WeakPolarHBondContact OG-CB 3.32Å; S244-I246 PolarHBondContact OG-N 3.28Å; S244-Q290 PolarHBondContact OG-NE2 2.94Å; S244-Q290 PolarHBondContact OG-OE1 3.1Å
245	N	90.8	Very high	93.4	Very high	52 Å²	52	19 Å²	19	28%	0.278	10%	0.102	S	C	.	.			trans	-92.5	-5.5	167.6	-55.8	-62.9	0	0	0	113.6	G139 K145 E210 G248	G139-N245 WeakPolarHBondContact O-CA 3.38Å; G139-N245 PolarHBondContact O-OD1 3.37Å; K145-N245 PolarHBondContact NZ-OD1 3.41Å; E210-N245 VanDerWaalsContact OE1-CB 3.22Å; E210-N245 WeakPolarHBondContact OE1-CB 3.37Å; E210-N245 PolarHBondContact OE1-N 3.04Å; E210-N245 PolarHBondContact OE1-ND2 2.91Å; E210-N245 PolarHBondContact OE2-N 3.43Å; N245-G248 PolarHBondContact O-N 3.29Å; N245-G248 VanDerWaalsContact O-N 3.13Å
246	I	86.3	Confident	93.4	Very high	27 Å²	27	20 Å²	20	14%	0.138	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	141.7	173.1	-70.5	175	0	0	0	109.7	H138 E210 S244 G248	H138-I246 PolarHBondContact ND1-O 3.25Å; H138-I246 VanDerWaalsContact ND1-O 3.08Å; E210-I246 HydrophobicContact CB-CD1 3.36Å; E210-I246 HydrophobicContact CB-CG1 3.59Å; E210-I246 HydrophobicContact CG-CG1 4.34Å; S244-I246 WeakPolarHBondContact OG-CB 3.32Å; S244-I246 PolarHBondContact OG-N 3.28Å; I246-G248 PolarHBondContact O-N 2.86Å
247	G	86.4	Confident	93.5	Very high	2 Å²	2	20.4 Å²	20.4	2%	0.021	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-7.7	-174.3	0	0	0	0	0	113.7	A249 T250 I251 E280	G247-A249 VanDerWaalsContact C-N 3.33Å; G247-A249 PolarHBondContact O-N 3.23Å; G247-T250 PolarHBondContact O-N 3.37Å; G247-I251 WeakPolarHBondContact O-CB 3.41Å; G247-I251 WeakPolarHBondContact O-CD1 3.42Å; G247-I251 WeakPolarHBondContact O-CG1 3.37Å; G247-I251 PolarHBondContact O-N 2.91Å; G247-E280 WeakPolarHBondContact CA-OE2 3.01Å
248	G	90.1	Very high	93.6	Very high	4 Å²	4	18.3 Å²	18.3	4%	0.041	11%	0.107	C	C	.	.	H	α-helix	trans	-62.6	-35.9	-177	0	0	0	0	0	113.8	N245 I246 N252	N245-G248 PolarHBondContact O-N 3.29Å; N245-G248 VanDerWaalsContact O-N 3.13Å; I246-G248 PolarHBondContact O-N 2.86Å; G248-N252 WeakPolarHBondContact O-CB 3.37Å; G248-N252 PolarHBondContact O-N 3.01Å; G248-N252 PolarHBondContact O-OD1 2.84Å; G248-N252 VanDerWaalsContact O-OD1 3.12Å
249	A	90.1	Very high	93.6	Very high	53 Å²	53	23.9 Å²	23.9	44%	0.438	13%	0.128	S	C	.	.	H	α-helix	trans	-68	-50.8	176.6	0	0	0	0	0	111.1	G247 I251 N252 D253	G247-A249 VanDerWaalsContact C-N 3.33Å; G247-A249 PolarHBondContact O-N 3.23Å; A249-I251 PolarHBondContact O-N 3.13Å; A249-N252 WeakPolarHBondContact O-CA 3.42Å; A249-N252 VanDerWaalsContact O-CB 3.31Å; A249-N252 WeakPolarHBondContact O-CB 3.04Å; A249-N252 PolarHBondContact O-N 2.93Å; A249-D253 PolarHBondContact O-N 2.92Å
250	T	91.8	Very high	93.5	Very high	22 Å²	22	29 Å²	29	14%	0.135	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-42.1	178.4	-62.6	0	0	0	0	113	G247 N252 D253 V254 R276 L277 E280	G247-T250 PolarHBondContact O-N 3.37Å; T250-N252 PolarHBondContact O-N 3.45Å; T250-D253 PolarHBondContact O-N 2.71Å; T250-V254 WeakPolarHBondContact O-CG2 3.48Å; T250-V254 PolarHBondContact O-N 3.01Å; T250-R276 HydrophobicContact CG2-CB 3.42Å; T250-R276 VanDerWaalsContact CG2-CB 3.42Å; T250-L277 HydrophobicContact CG2-CD2 4.31Å; T250-L277 HydrophobicContact CG2-CG 4.4Å; T250-E280 WeakPolarHBondContact CB-OE2 3.45Å; T250-E280 PolarHBondContact OG1-OE2 3.39Å
251	I	94.5	Very high	93.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-40	175.1	-70	162.6	0	0	0	110.4	H138 G247 A249 A255 L273 L277 P304 L306	H138-I251 HydrophobicContact CB-CD1 4.24Å; G247-I251 WeakPolarHBondContact O-CB 3.41Å; G247-I251 WeakPolarHBondContact O-CD1 3.42Å; G247-I251 WeakPolarHBondContact O-CG1 3.37Å; G247-I251 PolarHBondContact O-N 2.91Å; A249-I251 PolarHBondContact O-N 3.13Å; I251-A255 PolarHBondContact O-N 2.95Å; I251-A255 VanDerWaalsContact O-N 3.08Å; I251-L273 HydrophobicContact CB-CD2 4.43Å; I251-L273 HydrophobicContact CG1-CD2 4.21Å; I251-L273 HydrophobicContact CG2-CD2 4.36Å; I251-L277 HydrophobicContact CD1-CD1 4.33Å; I251-L277 HydrophobicContact CD1-CD2 4.32Å; I251-L277 HydrophobicContact CG1-CD1 4.06Å; I251-L277 HydrophobicContact CG1-CD2 4.06Å; I251-L277 HydrophobicContact CG1-CG 4.44Å; I251-P304 HydrophobicContact CD1-CB 3.87Å; I251-P304 HydrophobicContact CG1-CB 4.3Å; I251-L306 HydrophobicContact CG2-CD2 3.79Å
252	N	93.8	Very high	93.3	Very high	9 Å²	9	36.3 Å²	36.3	5%	0.048	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-40.4	177.4	-85.6	40.7	0	0	0	112.8	W140 G248 A249 T250 V254 A255 L256 P307	W140-N252 HydrophobicContact CE3-CB 4.05Å; W140-N252 HydrophobicContact CZ3-CB 3.96Å; W140-N252 WeakPolarHBondContact CZ3-ND2 3.44Å; G248-N252 WeakPolarHBondContact O-CB 3.37Å; G248-N252 PolarHBondContact O-N 3.01Å; G248-N252 PolarHBondContact O-OD1 2.84Å; G248-N252 VanDerWaalsContact O-OD1 3.12Å; A249-N252 WeakPolarHBondContact O-CA 3.42Å; A249-N252 VanDerWaalsContact O-CB 3.31Å; A249-N252 WeakPolarHBondContact O-CB 3.04Å; A249-N252 PolarHBondContact O-N 2.93Å; T250-N252 PolarHBondContact O-N 3.45Å; N252-V254 VanDerWaalsContact C-N 3.33Å; N252-A255 PolarHBondContact O-N 3.33Å; N252-L256 WeakPolarHBondContact O-CB 3.36Å; N252-L256 PolarHBondContact O-N 3Å; N252-P307 HydrophobicContact CB-CG 4.33Å; N252-P307 WeakPolarHBondContact ND2-CB 3.42Å; N252-P307 WeakPolarHBondContact OD1-CB 3.22Å; N252-P307 VanDerWaalsContact OD1-CD 3.31Å; N252-P307 WeakPolarHBondContact OD1-CD 3.43Å; N252-P307 WeakPolarHBondContact OD1-CG 3.45Å
253	D	93.8	Very high	93.3	Very high	84 Å²	84	40.6 Å²	40.6	45%	0.449	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-41.1	177.7	-66.9	-18.4	0	0	0	110.8	A249 T250 A255 L256 D257	A249-D253 PolarHBondContact O-N 2.92Å; T250-D253 PolarHBondContact O-N 2.71Å; D253-A255 PolarHBondContact O-N 3.13Å; D253-L256 PolarHBondContact O-N 3.24Å; D253-D257 WeakPolarHBondContact O-CB 3.47Å; D253-D257 VanDerWaalsContact O-CG 3.27Å; D253-D257 PolarHBondContact O-N 3.3Å
254	V	94.6	Very high	93.3	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-45.5	173.1	174.3	0	0	0	0	111.5	T250 N252 L256 D257 F258 I268 D272 L273 R276	T250-V254 WeakPolarHBondContact O-CG2 3.48Å; T250-V254 PolarHBondContact O-N 3.01Å; N252-V254 VanDerWaalsContact C-N 3.33Å; V254-L256 PolarHBondContact O-N 3.46Å; V254-D257 PolarHBondContact O-N 3.4Å; V254-F258 HydrophobicContact CG1-CD2 4.03Å; V254-F258 HydrophobicContact CG1-CE2 4.01Å; V254-F258 WeakPolarHBondContact O-CD2 3.13Å; V254-F258 PolarHBondContact O-N 3.11Å; V254-I268 HydrophobicContact CG1-CG2 4.36Å; V254-D272 HydrophobicContact CG1-CB 4.36Å; V254-L273 HydrophobicContact CB-CD2 3.73Å; V254-L273 HydrophobicContact CG1-CD2 3.7Å; V254-L273 HydrophobicContact CG1-CG 4.49Å; V254-L273 HydrophobicContact CG2-CD2 3.99Å; V254-R276 VanDerWaalsContact CG2-CD 3.45Å
255	A	95.6	Very high	93.4	Very high	6 Å²	6	46 Å²	46	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-34.9	177.4	0	0	0	0	0	112.2	I251 N252 D253 W259 I268 L306 P307 F350	I251-A255 PolarHBondContact O-N 2.95Å; I251-A255 VanDerWaalsContact O-N 3.08Å; N252-A255 PolarHBondContact O-N 3.33Å; D253-A255 PolarHBondContact O-N 3.13Å; A255-W259 PolarHBondContact O-N 2.73Å; A255-I268 HydrophobicContact CB-CD1 4.2Å; A255-L306 HydrophobicContact CB-CD2 4.44Å; A255-P307 HydrophobicContact CB-CG 3.83Å; A255-F350 HydrophobicContact CB-CE2 4.48Å; A255-F350 HydrophobicContact CB-CZ 3.9Å
256	L	94.8	Very high	93.6	Very high	30 Å²	30	47.6 Å²	47.6	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-71.3	-42.9	175.9	-172.5	61.1	0	0	0	111.9	N252 D253 V254 F258 W259 H260 P344 L349 F350	N252-L256 WeakPolarHBondContact O-CB 3.36Å; N252-L256 PolarHBondContact O-N 3Å; D253-L256 PolarHBondContact O-N 3.24Å; V254-L256 PolarHBondContact O-N 3.46Å; L256-F258 VanDerWaalsContact C-N 3.34Å; L256-F258 PolarHBondContact O-N 2.76Å; L256-W259 WeakPolarHBondContact O-CB 3.5Å; L256-W259 PolarHBondContact O-N 3.29Å; L256-W259 VanDerWaalsContact O-N 3.16Å; L256-H260 PolarHBondContact O-CD2 3.38Å; L256-H260 PolarHBondContact O-N 3.14Å; L256-P344 HydrophobicContact CD1-CG 4.37Å; L256-P344 HydrophobicContact CD2-CG 4.14Å; L256-L349 HydrophobicContact CD1-CD2 4.06Å; L256-F350 HydrophobicContact CB-CE2 4.14Å; L256-F350 HydrophobicContact CD1-CE2 4.21Å
257	D	94.9	Very high	94	Very high	62 Å²	62	50.6 Å²	50.6	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-58.1	-44.7	176.7	-75.8	-13.7	0	0	0	111.3	D253 V254 H260 S261 R276	D253-D257 WeakPolarHBondContact O-CB 3.47Å; D253-D257 VanDerWaalsContact O-CG 3.27Å; D253-D257 PolarHBondContact O-N 3.3Å; V254-D257 PolarHBondContact O-N 3.4Å; D257-H260 PolarHBondContact O-N 2.7Å; D257-S261 WeakPolarHBondContact O-CB 3.38Å; D257-S261 PolarHBondContact O-N 3.34Å; D257-S261 PolarHBondContact O-OG 2.97Å; D257-R276 IonicContact OD2-CZ 3.72Å; D257-R276 IonicContact OD2-NH1 3.78Å; D257-R276 PolarHBondContact OD2-NH1 2.98Å; D257-R276 IonicContact OD2-NH2 2.94Å; D257-R276 PolarHBondContact OD2-NH2 2.9Å
258	F	96	Very high	94.5	Very high	26 Å²	26	50.7 Å²	50.7	11%	0.114	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-42.9	175.7	-91.4	-113.9	0	0	0	111.7	V254 L256 S261 G262 Q263 D267 I268 D272	V254-F258 HydrophobicContact CG1-CD2 4.03Å; V254-F258 HydrophobicContact CG1-CE2 4.01Å; V254-F258 WeakPolarHBondContact O-CD2 3.13Å; V254-F258 PolarHBondContact O-N 3.11Å; L256-F258 VanDerWaalsContact C-N 3.34Å; L256-F258 PolarHBondContact O-N 2.76Å; F258-S261 CarbonylContact O-C 3.59Å; F258-S261 PolarHBondContact O-N 3.31Å; F258-G262 PolarHBondContact O-N 3Å; F258-Q263 HydrophobicContact CB-CB 4.44Å; F258-Q263 HydrophobicContact CD1-CB 3.84Å; F258-Q263 HydrophobicContact CG-CB 4.49Å; F258-Q263 PolarHBondContact O-N 2.95Å; F258-D267 HydrophobicContact CE1-CB 4.45Å; F258-I268 HydrophobicContact CB-CD1 4.26Å; F258-I268 HydrophobicContact CB-CG1 4.11Å; F258-I268 HydrophobicContact CD1-CB 4.46Å; F258-I268 HydrophobicContact CD1-CD1 4.46Å; F258-I268 HydrophobicContact CD1-CG1 3.44Å; F258-I268 VanDerWaalsContact CD1-CG1 3.44Å; F258-I268 HydrophobicContact CD2-CG1 4.09Å; F258-I268 HydrophobicContact CE1-CB 4.35Å; F258-I268 HydrophobicContact CE1-CG1 3.78Å; F258-I268 HydrophobicContact CE2-CG1 4.37Å; F258-I268 HydrophobicContact CG-CD1 4.25Å; F258-I268 HydrophobicContact CG-CG1 3.61Å; F258-I268 HydrophobicContact CZ-CG1 4.23Å; F258-D272 HydrophobicContact CE2-CB 4.29Å; F258-D272 HydrophobicContact CZ-CB 4.33Å; F258-D272 WeakPolarHBondContact CZ-OD2 3.31Å
259	W	94.8	Very high	94.6	Very high	118 Å²	118	51.7 Å²	51.7	45%	0.447	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-44.7	178	-175.3	86.6	0	0	0	112	A255 L256 S261 G262 E347 L349	A255-W259 PolarHBondContact O-N 2.73Å; L256-W259 WeakPolarHBondContact O-CB 3.5Å; L256-W259 PolarHBondContact O-N 3.29Å; L256-W259 VanDerWaalsContact O-N 3.16Å; W259-S261 PolarHBondContact O-N 3.31Å; W259-G262 PolarHBondContact O-N 2.97Å; W259-E347 HydrophobicContact CH2-CB 4.33Å; W259-E347 HydrophobicContact CH2-CG 4.14Å; W259-E347 HydrophobicContact CZ3-CB 4.44Å; W259-E347 HydrophobicContact CZ3-CG 3.95Å; W259-L349 HydrophobicContact CB-CD2 3.91Å; W259-L349 HydrophobicContact CD2-CD1 4.33Å; W259-L349 HydrophobicContact CD2-CD2 3.57Å; W259-L349 HydrophobicContact CE3-CD2 4.1Å; W259-L349 HydrophobicContact CG-CD1 4.33Å; W259-L349 HydrophobicContact CG-CD2 3.45Å; W259-L349 VanDerWaalsContact CG-CD2 3.45Å; W259-L349 HydrophobicContact CZ2-CD1 4.37Å
260	H	95.6	Very high	94.6	Very high	106 Å²	106	51.1 Å²	51.1	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-30.2	174.8	-75.9	-47.8	0	0	0	112.8	L256 D257 G262	L256-H260 PolarHBondContact O-CD2 3.38Å; L256-H260 PolarHBondContact O-N 3.14Å; D257-H260 PolarHBondContact O-N 2.7Å; H260-G262 PolarHBondContact O-N 3.32Å
261	S	96.3	Very high	94.5	Very high	85 Å²	85	58.2 Å²	58.2	59%	0.594	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.1	175.6	-55.8	0	0	0	0	113.3	D257 F258 W259 Q263	D257-S261 WeakPolarHBondContact O-CB 3.38Å; D257-S261 PolarHBondContact O-N 3.34Å; D257-S261 PolarHBondContact O-OG 2.97Å; F258-S261 CarbonylContact O-C 3.59Å; F258-S261 PolarHBondContact O-N 3.31Å; W259-S261 PolarHBondContact O-N 3.31Å; S261-Q263 PolarHBondContact O-N 2.91Å
262	G	94.8	Very high	94.3	Very high	69 Å²	69	61.5 Å²	61.5	71%	0.711	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	17.9	-178.5	0	0	0	0	0	114	F258 W259 H260	F258-G262 PolarHBondContact O-N 3Å; W259-G262 PolarHBondContact O-N 2.97Å; H260-G262 PolarHBondContact O-N 3.32Å
263	Q	96.1	Very high	94.1	Very high	93 Å²	93	61 Å²	61	44%	0.435	33%	0.329	S	S	.	.			trans	-85.8	155.9	177.3	-63.2	-178.8	-68.5	0	0	110.7	F258 S261	F258-Q263 HydrophobicContact CB-CB 4.44Å; F258-Q263 HydrophobicContact CD1-CB 3.84Å; F258-Q263 HydrophobicContact CG-CB 4.49Å; F258-Q263 PolarHBondContact O-N 2.95Å; S261-Q263 PolarHBondContact O-N 2.91Å
264	N	95.1	Very high	93.6	Very high	99 Å²	99	60.2 Å²	60.2	53%	0.529	32%	0.323	S	S	.	.			trans	-77	151	176.3	-54.8	-68.2	0	0	0	109.8	E266 D267	N264-E266 PolarHBondContact O-N 2.89Å; N264-D267 VanDerWaalsContact CB-OD2 3.32Å; N264-D267 WeakPolarHBondContact CB-OD2 3.35Å; N264-D267 PolarHBondContact N-OD2 2.96Å; N264-D267 VanDerWaalsContact N-OD2 3.1Å; N264-D267 PolarHBondContact ND2-OD2 2.83Å; N264-D267 WeakPolarHBondContact O-CB 3.47Å; N264-D267 PolarHBondContact O-N 2.98Å; N264-D267 VanDerWaalsContact O-N 3.13Å
265	R	95	Very high	92.9	Very high	15 Å²	15	67.3 Å²	67.3	6%	0.057	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-58.1	-38.7	173.4	-179	-160	-174.5	78.9	-8.2	111.7	G108 H110 D267 I268 L306 P307 E309	G108-R265 PolarHBondContact O-NE 3.13Å; G108-R265 PolarHBondContact O-NH2 3.35Å; H110-R265 PolarHBondContact CE1-O 2.93Å; R265-D267 PolarHBondContact O-N 3.48Å; R265-I268 HydrophobicContact CG-CD1 4.24Å; R265-I268 VanDerWaalsContact O-CB 3.31Å; R265-I268 WeakPolarHBondContact O-CB 3.39Å; R265-I268 WeakPolarHBondContact O-CD1 3.36Å; R265-I268 VanDerWaalsContact O-CG1 3.27Å; R265-I268 WeakPolarHBondContact O-CG1 3.4Å; R265-I268 PolarHBondContact O-N 3.28Å; R265-I268 VanDerWaalsContact O-N 3.1Å; R265-L306 HydrophobicContact CG-CD1 4.21Å; R265-L306 VanDerWaalsContact CZ-CB 3.49Å; R265-L306 PolarHBondContact NH2-O 3.13Å; R265-P307 PolarHBondContact NH1-O 3.37Å; R265-P307 PolarHBondContact NH2-O 3.36Å; R265-E309 WeakPolarHBondContact CD-OE1 3.22Å; R265-E309 IonicContact CZ-OE1 2.97Å; R265-E309 IonicContact NH1-OE1 3.3Å; R265-E309 PolarHBondContact NH1-OE1 2.97Å
266	E	95.4	Very high	92.3	Very high	87 Å²	87	72.2 Å²	72.2	41%	0.407	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-67.9	-15.8	-177.6	-64.2	75.7	-169	0	0	112.4	H110 N264 I268 R311	H110-E266 PolarHBondContact NE2-O 3.45Å; N264-E266 PolarHBondContact O-N 2.89Å; E266-I268 VanDerWaalsContact C-N 3.32Å; E266-R311 IonicContact OE1-CZ 2.8Å; E266-R311 IonicContact OE1-NH1 3.6Å; E266-R311 PolarHBondContact OE1-NH1 2.77Å; E266-R311 IonicContact OE1-NH2 3.37Å; E266-R311 PolarHBondContact OE1-NH2 3.4Å; E266-R311 IonicContact OE2-NH2 3.51Å
267	D	95.6	Very high	91.6	Very high	90 Å²	90	71.1 Å²	71.1	48%	0.481	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-80	-13.9	174.3	-57.4	-37.2	0	0	0	112.4	F258 N264 R265 G269	F258-D267 HydrophobicContact CE1-CB 4.45Å; N264-D267 VanDerWaalsContact CB-OD2 3.32Å; N264-D267 WeakPolarHBondContact CB-OD2 3.35Å; N264-D267 PolarHBondContact N-OD2 2.96Å; N264-D267 VanDerWaalsContact N-OD2 3.1Å; N264-D267 PolarHBondContact ND2-OD2 2.83Å; N264-D267 WeakPolarHBondContact O-CB 3.47Å; N264-D267 PolarHBondContact O-N 2.98Å; N264-D267 VanDerWaalsContact O-N 3.13Å; R265-D267 PolarHBondContact O-N 3.48Å; D267-G269 PolarHBondContact O-N 3.19Å
268	I	95.4	Very high	90.5	Very high	4 Å²	4	76 Å²	76	2%	0.021	38%	0.381	C	S	.	.			trans	-65.4	117.2	176	-59.5	167.6	0	0	0	108.5	H110 L111 V254 A255 F258 R265 E266 L273 L306	H110-I268 PolarHBondContact NE2-O 3.01Å; L111-I268 HydrophobicContact CD1-CG2 4.43Å; L111-I268 WeakPolarHBondContact CD2-O 3.35Å; V254-I268 HydrophobicContact CG1-CG2 4.36Å; A255-I268 HydrophobicContact CB-CD1 4.2Å; F258-I268 HydrophobicContact CB-CD1 4.26Å; F258-I268 HydrophobicContact CB-CG1 4.11Å; F258-I268 HydrophobicContact CD1-CB 4.46Å; F258-I268 HydrophobicContact CD1-CD1 4.46Å; F258-I268 HydrophobicContact CD1-CG1 3.44Å; F258-I268 VanDerWaalsContact CD1-CG1 3.44Å; F258-I268 HydrophobicContact CD2-CG1 4.09Å; F258-I268 HydrophobicContact CE1-CB 4.35Å; F258-I268 HydrophobicContact CE1-CG1 3.78Å; F258-I268 HydrophobicContact CE2-CG1 4.37Å; F258-I268 HydrophobicContact CG-CD1 4.25Å; F258-I268 HydrophobicContact CG-CG1 3.61Å; F258-I268 HydrophobicContact CZ-CG1 4.23Å; R265-I268 HydrophobicContact CG-CD1 4.24Å; R265-I268 VanDerWaalsContact O-CB 3.31Å; R265-I268 WeakPolarHBondContact O-CB 3.39Å; R265-I268 WeakPolarHBondContact O-CD1 3.36Å; R265-I268 VanDerWaalsContact O-CG1 3.27Å; R265-I268 WeakPolarHBondContact O-CG1 3.4Å; R265-I268 PolarHBondContact O-N 3.28Å; R265-I268 VanDerWaalsContact O-N 3.1Å; E266-I268 VanDerWaalsContact C-N 3.32Å; I268-L273 HydrophobicContact CG2-CD1 4.16Å; I268-L273 HydrophobicContact CG2-CG 4.26Å; I268-L306 HydrophobicContact CD1-CD1 4.36Å; I268-L306 HydrophobicContact CD1-CD2 4.23Å; I268-L306 HydrophobicContact CG2-CD2 4.37Å
269	G	93.5	Very high	89.5	Confident	25 Å²	25	77 Å²	77	26%	0.258	39%	0.393	S	S	.	.			trans	-93.8	172	177.2	0	0	0	0	0	113.1	D267 E271 D272	D267-G269 PolarHBondContact O-N 3.19Å; G269-E271 VanDerWaalsContact C-N 3.33Å; G269-D272 WeakPolarHBondContact CA-OD2 3.4Å; G269-D272 PolarHBondContact N-OD2 3.27Å
270	M	90.2	Very high	88.5	Confident	41 Å²	41	73.3 Å²	73.3	20%	0.202	38%	0.381	C	S	.	.	H	α-helix	trans	-67.8	-37	173.9	-169.5	63.4	-170.2	0	0	111.5	D272 L273 E274 F302 P304	M270-D272 VanDerWaalsContact C-N 3.3Å; M270-D272 PolarHBondContact O-N 3.46Å; M270-L273 PolarHBondContact O-N 3Å; M270-L273 VanDerWaalsContact O-N 3.13Å; M270-E274 HydrophobicContact CE-CG 3.75Å; M270-E274 HydrophobicContact CG-CG 4.09Å; M270-E274 WeakPolarHBondContact CG-OE1 3.29Å; M270-E274 WeakPolarHBondContact O-CG 3.27Å; M270-E274 PolarHBondContact O-N 3.11Å; M270-F302 HydrophobicContact CE-CB 3.96Å; M270-F302 HydrophobicContact CE-CD1 3.86Å; M270-F302 HydrophobicContact CE-CG 4.36Å; M270-F302 WeakPolarHBondContact CE-O 3.25Å; M270-P304 HydrophobicContact CE-CG 4.45Å; M270-P304 HydrophobicContact SD-CG 3.72Å
271	E	89.4	Confident	87	Confident	171 Å²	171	69.1 Å²	69.1	80%	0.799	36%	0.363	S	S	*	.	H	α-helix	trans	-60.5	-37.5	-178.7	-64	179.5	-174.3	0	0	112.6	G269 L273	G269-E271 VanDerWaalsContact C-N 3.33Å; E271-L273 PolarHBondContact O-N 3.28Å
272	D	90.4	Very high	85.4	Confident	68 Å²	68	72.2 Å²	72.2	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-62.9	-32.3	178.3	-58.5	-55.8	0	0	0	112.5	V254 F258 G269 M270	V254-D272 HydrophobicContact CG1-CB 4.36Å; F258-D272 HydrophobicContact CE2-CB 4.29Å; F258-D272 HydrophobicContact CZ-CB 4.33Å; F258-D272 WeakPolarHBondContact CZ-OD2 3.31Å; G269-D272 WeakPolarHBondContact CA-OD2 3.4Å; G269-D272 PolarHBondContact N-OD2 3.27Å; M270-D272 VanDerWaalsContact C-N 3.3Å; M270-D272 PolarHBondContact O-N 3.46Å
273	L	89.9	Confident	83.9	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-89.8	-41.9	-176	-64.9	170.8	0	0	0	111.5	L111 I251 V254 I268 M270 E271 H275 R276 L277 P304 L306	L111-L273 HydrophobicContact CD1-CD1 3.57Å; I251-L273 HydrophobicContact CB-CD2 4.43Å; I251-L273 HydrophobicContact CG1-CD2 4.21Å; I251-L273 HydrophobicContact CG2-CD2 4.36Å; V254-L273 HydrophobicContact CB-CD2 3.73Å; V254-L273 HydrophobicContact CG1-CD2 3.7Å; V254-L273 HydrophobicContact CG1-CG 4.49Å; V254-L273 HydrophobicContact CG2-CD2 3.99Å; I268-L273 HydrophobicContact CG2-CD1 4.16Å; I268-L273 HydrophobicContact CG2-CG 4.26Å; M270-L273 PolarHBondContact O-N 3Å; M270-L273 VanDerWaalsContact O-N 3.13Å; E271-L273 PolarHBondContact O-N 3.28Å; L273-H275 VanDerWaalsContact C-N 3.34Å; L273-H275 PolarHBondContact O-N 3.26Å; L273-R276 PolarHBondContact O-N 2.82Å; L273-L277 HydrophobicContact CB-CD1 3.97Å; L273-L277 VanDerWaalsContact O-CB 3.32Å; L273-L277 WeakPolarHBondContact O-CB 3.48Å; L273-L277 WeakPolarHBondContact O-CD1 3.49Å; L273-L277 VanDerWaalsContact O-CG 3.25Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.36Å; L273-P304 HydrophobicContact CD1-CB 3.68Å; L273-P304 HydrophobicContact CD1-CG 3.52Å; L273-L306 HydrophobicContact CD1-CD2 4.38Å
274	E	82.8	Confident	82.1	Confident	67 Å²	67	75.3 Å²	75.3	31%	0.313	37%	0.372	S	S	.	.	H	α-helix	trans	-55.8	-45.8	-175.8	-80.6	-169.6	-154.7	0	0	112.9	M270 R276 L277 R278	M270-E274 HydrophobicContact CE-CG 3.75Å; M270-E274 HydrophobicContact CG-CG 4.09Å; M270-E274 WeakPolarHBondContact CG-OE1 3.29Å; M270-E274 WeakPolarHBondContact O-CG 3.27Å; M270-E274 PolarHBondContact O-N 3.11Å; E274-R276 PolarHBondContact O-N 2.78Å; E274-L277 PolarHBondContact O-N 3.42Å; E274-R278 WeakPolarHBondContact O-CB 3.41Å; E274-R278 VanDerWaalsContact O-CG 3.22Å; E274-R278 WeakPolarHBondContact O-CG 3.25Å; E274-R278 PolarHBondContact O-N 3.39Å; E274-R278 IonicContact OE2-CZ 3.63Å; E274-R278 IonicContact OE2-NE 3.81Å; E274-R278 IonicContact OE2-NH2 3.92Å; E274-R278 PolarHBondContact OE2-NH2 3.05Å
275	H	79.1	Confident	80	Confident	151 Å²	151	79.7 Å²	79.7	70%	0.699	39%	0.39	S	S	*	.	H	α-helix	trans	-61.3	-45.6	-176.8	-178.6	-82.9	0	0	0	111.9	L273 A279	L273-H275 VanDerWaalsContact C-N 3.34Å; L273-H275 PolarHBondContact O-N 3.26Å; H275-A279 PolarHBondContact O-N 2.86Å
276	R	83.1	Confident	77.9	Confident	110 Å²	110	81.1 Å²	81.1	42%	0.415	41%	0.409	S	S	.	.	H	α-helix	trans	-74.6	-37	-177.7	-64.8	-173	-178.7	-153	9.9	112.2	T250 V254 D257 L273 E274 A279 E280	T250-R276 HydrophobicContact CG2-CB 3.42Å; T250-R276 VanDerWaalsContact CG2-CB 3.42Å; V254-R276 VanDerWaalsContact CG2-CD 3.45Å; D257-R276 IonicContact OD2-CZ 3.72Å; D257-R276 IonicContact OD2-NH1 3.78Å; D257-R276 PolarHBondContact OD2-NH1 2.98Å; D257-R276 IonicContact OD2-NH2 2.94Å; D257-R276 PolarHBondContact OD2-NH2 2.9Å; L273-R276 PolarHBondContact O-N 2.82Å; E274-R276 PolarHBondContact O-N 2.78Å; R276-A279 WeakPolarHBondContact O-CB 3.04Å; R276-A279 PolarHBondContact O-N 3.4Å; R276-E280 PolarHBondContact O-N 3.26Å; R276-E280 VanDerWaalsContact O-N 3.1Å
277	L	80	Confident	75.9	Confident	7 Å²	7	77 Å²	77	4%	0.037	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-37.6	178.1	-74.3	166.9	0	0	0	112.7	T250 I251 L273 E274 A279 E280 T281 F302	T250-L277 HydrophobicContact CG2-CD2 4.31Å; T250-L277 HydrophobicContact CG2-CG 4.4Å; I251-L277 HydrophobicContact CD1-CD1 4.33Å; I251-L277 HydrophobicContact CD1-CD2 4.32Å; I251-L277 HydrophobicContact CG1-CD1 4.06Å; I251-L277 HydrophobicContact CG1-CD2 4.06Å; I251-L277 HydrophobicContact CG1-CG 4.44Å; L273-L277 HydrophobicContact CB-CD1 3.97Å; L273-L277 VanDerWaalsContact O-CB 3.32Å; L273-L277 WeakPolarHBondContact O-CB 3.48Å; L273-L277 WeakPolarHBondContact O-CD1 3.49Å; L273-L277 VanDerWaalsContact O-CG 3.25Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.36Å; E274-L277 PolarHBondContact O-N 3.42Å; L277-A279 VanDerWaalsContact C-N 3.28Å; L277-A279 PolarHBondContact O-N 3.32Å; L277-E280 PolarHBondContact O-N 3.38Å; L277-T281 WeakPolarHBondContact O-CB 3.5Å; L277-T281 PolarHBondContact O-N 3.06Å; L277-T281 VanDerWaalsContact O-N 3.12Å; L277-T281 PolarHBondContact O-OG1 3.45Å; L277-F302 HydrophobicContact CD1-CD1 4.22Å; L277-F302 HydrophobicContact CD1-CE1 3.34Å; L277-F302 HydrophobicContact CD1-CZ 3.56Å; L277-F302 HydrophobicContact CD2-CZ 4.18Å; L277-F302 HydrophobicContact CG-CZ 4.32Å
278	R	72.8	Confident	73.7	Confident	165 Å²	165	78.6 Å²	78.6	62%	0.623	39%	0.392	S	S	*	.	H	α-helix	trans	-61.8	-38.1	172.9	-73.1	177.1	-165.8	-150.1	9.6	111.5	E274 L282	E274-R278 WeakPolarHBondContact O-CB 3.41Å; E274-R278 VanDerWaalsContact O-CG 3.22Å; E274-R278 WeakPolarHBondContact O-CG 3.25Å; E274-R278 PolarHBondContact O-N 3.39Å; E274-R278 IonicContact OE2-CZ 3.63Å; E274-R278 IonicContact OE2-NE 3.81Å; E274-R278 IonicContact OE2-NH2 3.92Å; E274-R278 PolarHBondContact OE2-NH2 3.05Å; R278-L282 WeakPolarHBondContact O-CG 3.41Å
279	A	74.9	Confident	71.6	Confident	45 Å²	45	78.6 Å²	78.6	37%	0.372	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-48.1	176.7	0	0	0	0	0	112.3	H275 R276 L277 T281 L282	H275-A279 PolarHBondContact O-N 2.86Å; R276-A279 WeakPolarHBondContact O-CB 3.04Å; R276-A279 PolarHBondContact O-N 3.4Å; L277-A279 VanDerWaalsContact C-N 3.28Å; L277-A279 PolarHBondContact O-N 3.32Å; A279-T281 VanDerWaalsContact C-N 3.3Å; A279-T281 PolarHBondContact O-N 3.36Å; A279-L282 PolarHBondContact O-N 3.41Å
280	E	73.4	Confident	69.7	Low	41 Å²	41	77.8 Å²	77.8	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-61.3	-37.7	179.7	-176.6	-173.5	169.6	0	0	112.9	G247 T250 R276 L277 L282 E283 T284	G247-E280 WeakPolarHBondContact CA-OE2 3.01Å; T250-E280 WeakPolarHBondContact CB-OE2 3.45Å; T250-E280 PolarHBondContact OG1-OE2 3.39Å; R276-E280 PolarHBondContact O-N 3.26Å; R276-E280 VanDerWaalsContact O-N 3.1Å; L277-E280 PolarHBondContact O-N 3.38Å; E280-L282 PolarHBondContact O-N 3.05Å; E280-E283 PolarHBondContact O-N 3.03Å; E280-E283 VanDerWaalsContact O-N 3.13Å; E280-T284 PolarHBondContact O-N 2.86Å; E280-T284 PolarHBondContact O-OG1 2.04Å
281	T	63.3	Low	68.1	Low	19 Å²	19	77 Å²	77	12%	0.117	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-27.3	-177.7	-54.9	0	0	0	0	112	L277 A279	L277-T281 WeakPolarHBondContact O-CB 3.5Å; L277-T281 PolarHBondContact O-N 3.06Å; L277-T281 VanDerWaalsContact O-N 3.12Å; L277-T281 PolarHBondContact O-OG1 3.45Å; A279-T281 VanDerWaalsContact C-N 3.3Å; A279-T281 PolarHBondContact O-N 3.36Å
282	L	64	Low	66.7	Low	150 Å²	150	71.2 Å²	71.2	79%	0.785	35%	0.354	S	S	*	.	H	α-helix	trans	-78.4	-24.1	176.4	-67.4	168.6	0	0	0	113.1	R278 A279 E280	R278-L282 WeakPolarHBondContact O-CG 3.41Å; A279-L282 PolarHBondContact O-N 3.41Å; E280-L282 PolarHBondContact O-N 3.05Å
283	E	63.5	Low	65.2	Low	166 Å²	166	68.1 Å²	68.1	78%	0.776	34%	0.338	S	S	*	.	H	α-helix	trans	-96.9	-21.8	-171.9	-65.7	-174.1	170.4	0	0	113.8	E280	E280-E283 PolarHBondContact O-N 3.03Å; E280-E283 VanDerWaalsContact O-N 3.13Å
284	T	57.6	Low	63.7	Low	61 Å²	61	71 Å²	71	37%	0.374	35%	0.352	S	S	.	.			trans	-94	122.5	-168.7	-48.9	0	0	0	0	113.2	E280 G286 G287	E280-T284 PolarHBondContact O-N 2.86Å; E280-T284 PolarHBondContact O-OG1 2.04Å; T284-G286 VanDerWaalsContact C-N 3.25Å; T284-G286 PolarHBondContact O-N 3.48Å; T284-G287 WeakPolarHBondContact O-CA 3.34Å; T284-G287 PolarHBondContact O-N 2.69Å
285	Q	50.9	Low	62.5	Low	191 Å²	191	70.9 Å²	70.9	89%	0.893	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.6	-179.7	-70.2	-172.2	-14.9	0	0	115.3
286	G	51.3	Low	61.7	Low	44 Å²	44	67.8 Å²	67.8	45%	0.454	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-7.5	170.3	0	0	0	0	0	114.2	T284 F288	T284-G286 VanDerWaalsContact C-N 3.25Å; T284-G286 PolarHBondContact O-N 3.48Å; G286-F288 VanDerWaalsContact C-N 3.28Å
287	G	52.4	Low	61.1	Low	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.364	C	S	.	.			trans	-79.8	-6.3	175.9	0	0	0	0	0	113.7	T284 A289 Q290 S291	T284-G287 WeakPolarHBondContact O-CA 3.34Å; T284-G287 PolarHBondContact O-N 2.69Å; G287-A289 VanDerWaalsContact C-N 3.28Å; G287-A289 PolarHBondContact O-N 2.97Å; G287-Q290 CarbonylContact O-C 3.53Å; G287-Q290 PolarHBondContact O-N 3.05Å; G287-S291 WeakPolarHBondContact O-CB 3.29Å; G287-S291 PolarHBondContact O-N 3.19Å; G287-S291 PolarHBondContact O-OG 3.03Å
288	F	49.3	Very low	61.3	Low	124 Å²	124	69.5 Å²	69.5	54%	0.544	36%	0.363	S	S	.	.	H	α-helix	trans	-56.7	-39.7	-172.8	-127.9	-89.8	0	0	0	113.9	G286 Q290 S291 E292	G286-F288 VanDerWaalsContact C-N 3.28Å; F288-Q290 VanDerWaalsContact C-N 3.31Å; F288-Q290 PolarHBondContact O-N 2.83Å; F288-S291 WeakPolarHBondContact CA-OG 2.96Å; F288-S291 PolarHBondContact O-N 2.97Å; F288-S291 PolarHBondContact O-OG 2.9Å; F288-E292 WeakPolarHBondContact O-CG 3.41Å; F288-E292 PolarHBondContact O-N 3.47Å
289	A	51.9	Low	62	Low	4 Å²	4	62.4 Å²	62.4	3%	0.033	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-36.3	178.7	0	0	0	0	0	112	P214 I217 G287	P214-A289 HydrophobicContact CG-CB 4.39Å; I217-A289 HydrophobicContact CD1-CB 3.18Å; I217-A289 WeakPolarHBondContact CD1-O 3.47Å; I217-A289 HydrophobicContact CG1-CB 4.27Å; G287-A289 VanDerWaalsContact C-N 3.28Å; G287-A289 PolarHBondContact O-N 2.97Å
290	Q	53.6	Low	62.8	Low	8 Å²	8	63.2 Å²	63.2	4%	0.037	34%	0.335	C	S	.	.	H	α-helix	trans	-88.5	-31.3	179.1	-73.5	164.2	16	0	0	111.9	S244 G287 F288 E292 L293 M294	S244-Q290 PolarHBondContact OG-NE2 2.94Å; S244-Q290 PolarHBondContact OG-OE1 3.1Å; G287-Q290 CarbonylContact O-C 3.53Å; G287-Q290 PolarHBondContact O-N 3.05Å; F288-Q290 VanDerWaalsContact C-N 3.31Å; F288-Q290 PolarHBondContact O-N 2.83Å; Q290-E292 VanDerWaalsContact C-N 3.29Å; Q290-E292 PolarHBondContact O-N 3.18Å; Q290-L293 PolarHBondContact O-N 3.43Å; Q290-M294 VanDerWaalsContact O-CB 3.23Å; Q290-M294 WeakPolarHBondContact O-CB 3.5Å; Q290-M294 WeakPolarHBondContact O-CG 3.47Å; Q290-M294 PolarHBondContact O-N 3.35Å
291	S	57.6	Low	63.6	Low	26 Å²	26	65.3 Å²	65.3	18%	0.182	34%	0.344	C	S	.	.	H	α-helix	trans	-64	-36.6	173.4	68.2	0	0	0	0	111	G287 F288 A295	G287-S291 WeakPolarHBondContact O-CB 3.29Å; G287-S291 PolarHBondContact O-N 3.19Å; G287-S291 PolarHBondContact O-OG 3.03Å; F288-S291 WeakPolarHBondContact CA-OG 2.96Å; F288-S291 PolarHBondContact O-N 2.97Å; F288-S291 PolarHBondContact O-OG 2.9Å; S291-A295 WeakPolarHBondContact O-CA 3.06Å; S291-A295 WeakPolarHBondContact O-CB 3.48Å; S291-A295 PolarHBondContact O-N 3.06Å
292	E	58.9	Low	64.9	Low	49 Å²	49	65.9 Å²	65.9	23%	0.229	35%	0.345	C	S	.	.	H	α-helix	trans	-68.8	-45.6	173.9	-77.2	-178.5	-177.2	0	0	112.3	K221 F288 Q290 M294 A295 D296	K221-E292 IonicContact NZ-OE2 2.72Å; K221-E292 PolarHBondContact NZ-OE2 2.98Å; F288-E292 WeakPolarHBondContact O-CG 3.41Å; F288-E292 PolarHBondContact O-N 3.47Å; Q290-E292 VanDerWaalsContact C-N 3.29Å; Q290-E292 PolarHBondContact O-N 3.18Å; E292-M294 VanDerWaalsContact C-N 3.26Å; E292-M294 PolarHBondContact O-N 2.86Å; E292-A295 PolarHBondContact O-N 3.2Å; E292-D296 WeakPolarHBondContact O-CB 3.18Å; E292-D296 PolarHBondContact O-N 2.88Å
293	L	58.9	Low	66.4	Low	3 Å²	3	58.8 Å²	58.8	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-34.6	174.8	-71	174.8	0	0	0	112.8	I217 K221 M224 F242 Q290 L298 I299	I217-L293 HydrophobicContact CD1-CD1 4.12Å; I217-L293 HydrophobicContact CG2-CD1 3.68Å; I217-L293 HydrophobicContact CG2-CD2 3.49Å; I217-L293 VanDerWaalsContact CG2-CD2 3.49Å; I217-L293 HydrophobicContact CG2-CG 3.43Å; I217-L293 VanDerWaalsContact CG2-CG 3.43Å; K221-L293 HydrophobicContact CG-CD2 4.1Å; M224-L293 HydrophobicContact CE-CD2 4.08Å; M224-L293 HydrophobicContact SD-CD2 4.34Å; F242-L293 HydrophobicContact CE1-CD1 4.49Å; Q290-L293 PolarHBondContact O-N 3.43Å; L293-L298 HydrophobicContact CD2-CB 4.37Å; L293-L298 HydrophobicContact CD2-CD1 3.9Å; L293-L298 PolarHBondContact O-N 3.37Å; L293-L298 VanDerWaalsContact O-N 3.11Å; L293-I299 HydrophobicContact CB-CD1 3.75Å; L293-I299 HydrophobicContact CB-CG1 4.19Å
294	M	57.9	Low	67.9	Low	60 Å²	60	50.9 Å²	50.9	30%	0.296	27%	0.271	S	S	.	.	H	α-helix	trans	-75.9	-41	176.3	-67.8	-100	88.8	0	0	111.8	Q290 E292 D296 H297 I299 F302	Q290-M294 VanDerWaalsContact O-CB 3.23Å; Q290-M294 WeakPolarHBondContact O-CB 3.5Å; Q290-M294 WeakPolarHBondContact O-CG 3.47Å; Q290-M294 PolarHBondContact O-N 3.35Å; E292-M294 VanDerWaalsContact C-N 3.26Å; E292-M294 PolarHBondContact O-N 2.86Å; M294-D296 VanDerWaalsContact C-N 3.33Å; M294-D296 PolarHBondContact O-N 3.49Å; M294-H297 PolarHBondContact O-N 2.03Å; M294-I299 HydrophobicContact CE-CB 3.46Å; M294-I299 VanDerWaalsContact CE-CB 3.46Å; M294-I299 HydrophobicContact CE-CD1 3.5Å; M294-I299 HydrophobicContact CE-CG1 4.04Å; M294-I299 HydrophobicContact CE-CG2 3.58Å; M294-I299 HydrophobicContact CG-CD1 4.14Å; M294-I299 HydrophobicContact SD-CD1 4.48Å; M294-F302 HydrophobicContact CE-CD2 4.32Å; M294-F302 HydrophobicContact SD-CD2 4.09Å
295	A	57.6	Low	69.8	Low	65 Å²	65	48 Å²	48	54%	0.537	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-37.8	-180	0	0	0	0	0	111.8	S291 E292 H297	S291-A295 WeakPolarHBondContact O-CA 3.06Å; S291-A295 WeakPolarHBondContact O-CB 3.48Å; S291-A295 PolarHBondContact O-N 3.06Å; E292-A295 PolarHBondContact O-N 3.2Å; A295-H297 PolarHBondContact O-N 3.23Å; A295-H297 PolarHBondContact O-ND1 3.36Å
296	D	62.4	Low	72	Confident	86 Å²	86	38.9 Å²	38.9	46%	0.46	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	5.3	178.4	-64.1	-25.1	0	0	0	112.7	K221 E292 M294 L298	K221-D296 IonicContact NZ-OD2 3.51Å; E292-D296 WeakPolarHBondContact O-CB 3.18Å; E292-D296 PolarHBondContact O-N 2.88Å; M294-D296 VanDerWaalsContact C-N 3.33Å; M294-D296 PolarHBondContact O-N 3.49Å; D296-L298 HydrophobicContact CB-CD1 3.83Å; D296-L298 HydrophobicContact CB-CG 3.73Å; D296-L298 PolarHBondContact O-N 3.26Å; D296-L298 VanDerWaalsContact O-N 3.1Å
297	H	71.3	Confident	74.2	Confident	148 Å²	148	36.9 Å²	36.9	69%	0.685	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	30.3	-177.6	-58.9	74	0	0	0	113.3	K131 M294 A295	K131-H297 PolarHBondContact NZ-O 3.29Å; M294-H297 PolarHBondContact O-N 2.03Å; A295-H297 PolarHBondContact O-N 3.23Å; A295-H297 PolarHBondContact O-ND1 3.36Å
298	L	83.4	Confident	76.3	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.191	C	C	.	.			trans	-78.2	-26.6	-178.3	-65.7	173.7	0	0	0	111.6	K131 T134 K221 M224 D225 L293 D296	K131-L298 WeakPolarHBondContact CE-O 3.36Å; K131-L298 VanDerWaalsContact NZ-C 3.32Å; K131-L298 PolarHBondContact NZ-O 3.2Å; T134-L298 VanDerWaalsContact CB-O 3.28Å; T134-L298 WeakPolarHBondContact CB-O 3.43Å; T134-L298 PolarHBondContact OG1-O 3.1Å; K221-L298 HydrophobicContact CB-CD1 3.81Å; K221-L298 HydrophobicContact CD-CD1 4.11Å; K221-L298 HydrophobicContact CG-CD1 3.58Å; M224-L298 HydrophobicContact CB-CD2 4.46Å; M224-L298 HydrophobicContact CE-CB 4.23Å; D225-L298 HydrophobicContact CB-CD2 3.75Å; L293-L298 HydrophobicContact CD2-CB 4.37Å; L293-L298 HydrophobicContact CD2-CD1 3.9Å; L293-L298 PolarHBondContact O-N 3.37Å; L293-L298 VanDerWaalsContact O-N 3.11Å; D296-L298 HydrophobicContact CB-CD1 3.83Å; D296-L298 HydrophobicContact CB-CG 3.73Å; D296-L298 PolarHBondContact O-N 3.26Å; D296-L298 VanDerWaalsContact O-N 3.1Å
299	I	87.9	Confident	78.6	Confident	17 Å²	17	32.7 Å²	32.7	9%	0.087	17%	0.172	C	C	.	.			trans	-85	121.8	174.1	-64	164	0	0	0	109.6	T134 L293 M294	T134-I299 HydrophobicContact CG2-CB 4.27Å; T134-I299 HydrophobicContact CG2-CG1 3.92Å; L293-I299 HydrophobicContact CB-CD1 3.75Å; L293-I299 HydrophobicContact CB-CG1 4.19Å; M294-I299 HydrophobicContact CE-CB 3.46Å; M294-I299 VanDerWaalsContact CE-CB 3.46Å; M294-I299 HydrophobicContact CE-CD1 3.5Å; M294-I299 HydrophobicContact CE-CG1 4.04Å; M294-I299 HydrophobicContact CE-CG2 3.58Å; M294-I299 HydrophobicContact CG-CD1 4.14Å; M294-I299 HydrophobicContact SD-CD1 4.48Å
300	D	90.8	Very high	80.6	Confident	61 Å²	61	35.8 Å²	35.8	33%	0.326	18%	0.183	S	C	.	.	S	Bend	trans	-79.1	-42.8	178.9	-57.4	-49.7	0	0	0	111.5	K131 T134	K131-D300 WeakPolarHBondContact CD-OD1 3.28Å; K131-D300 WeakPolarHBondContact CE-OD1 3.3Å; K131-D300 IonicContact NZ-OD1 3.38Å; K131-D300 PolarHBondContact NZ-OD1 3.18Å; T134-D300 PolarHBondContact N-OD2 3.5Å; T134-D300 PolarHBondContact O-N 2.94Å
301	F	92.1	Very high	82.6	Confident	85 Å²	85	40.8 Å²	40.8	37%	0.373	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120	-178.7	-57.3	-81.6	0	0	0	111.2	V115 A119 L133 T134 L135 S136 V303	V115-F301 HydrophobicContact CG1-CB 3.99Å; V115-F301 HydrophobicContact CG1-CD1 4.13Å; V115-F301 HydrophobicContact CG1-CG 4.26Å; A119-F301 HydrophobicContact CB-CD2 3.56Å; A119-F301 HydrophobicContact CB-CE2 3.54Å; A119-F301 HydrophobicContact CB-CG 4.14Å; A119-F301 HydrophobicContact CB-CZ 4.11Å; L133-F301 HydrophobicContact CD1-CD2 3.98Å; L133-F301 HydrophobicContact CD1-CE2 3.97Å; T134-F301 PolarHBondContact O-N 2.91Å; L135-F301 HydrophobicContact CD2-CB 3.76Å; L135-F301 HydrophobicContact CD2-CD2 3.73Å; L135-F301 HydrophobicContact CD2-CG 4.15Å; S136-F301 PolarHBondContact N-O 3.07Å; F301-V303 HydrophobicContact CB-CG2 4.35Å
302	F	90.3	Very high	84.5	Confident	32 Å²	32	39.9 Å²	39.9	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	130	162.6	-170.5	-77.6	0	0	0	108.8	H138 M270 L277 M294 P304	H138-F302 HydrophobicContact CB-CE1 3.73Å; H138-F302 HydrophobicContact CB-CE2 4.04Å; H138-F302 HydrophobicContact CB-CZ 3.32Å; H138-F302 AromaticContact CD2-CD2 3.47Å; H138-F302 VanDerWaalsContact CD2-CD2 3.47Å; H138-F302 WeakPolarHBondContact CD2-CD2 3.16Å; H138-F302 AromaticContact CD2-CE1 3.87Å; H138-F302 AromaticContact CD2-CE2 3.03Å; H138-F302 WeakPolarHBondContact CD2-CE2 3.26Å; H138-F302 AromaticContact CD2-CZ 3.26Å; H138-F302 WeakPolarHBondContact CD2-CZ 2.94Å; H138-F302 AromaticContact CE1-CE2 3.62Å; H138-F302 AromaticContact CG-CE1 3.94Å; H138-F302 AromaticContact CG-CE2 3.35Å; H138-F302 AromaticContact CG-CZ 3.17Å; H138-F302 AromaticContact ND1-CE2 3.71Å; H138-F302 AromaticContact ND1-CZ 3.8Å; H138-F302 AromaticContact NE2-CD2 3.61Å; H138-F302 AromaticContact NE2-CE2 3.24Å; H138-F302 WeakPolarHBondContact NE2-CE2 3.44Å; H138-F302 AromaticContact NE2-CZ 3.93Å; M270-F302 HydrophobicContact CE-CB 3.96Å; M270-F302 HydrophobicContact CE-CD1 3.86Å; M270-F302 HydrophobicContact CE-CG 4.36Å; M270-F302 WeakPolarHBondContact CE-O 3.25Å; L277-F302 HydrophobicContact CD1-CD1 4.22Å; L277-F302 HydrophobicContact CD1-CE1 3.34Å; L277-F302 HydrophobicContact CD1-CZ 3.56Å; L277-F302 HydrophobicContact CD2-CZ 4.18Å; L277-F302 HydrophobicContact CG-CZ 4.32Å; M294-F302 HydrophobicContact CE-CD2 4.32Å; M294-F302 HydrophobicContact SD-CD2 4.09Å; F302-P304 HydrophobicContact CE1-CB 4.19Å
303	V	94.8	Very high	86.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	101.5	-174.1	-172.8	0	0	0	0	109.6	V112 V115 V116 S136 F137 H138 F301 F305	V112-V303 HydrophobicContact CB-CG1 4.14Å; V112-V303 HydrophobicContact CG1-CG1 3.92Å; V112-V303 HydrophobicContact CG2-CG1 3.92Å; V115-V303 HydrophobicContact CG1-CG2 3.89Å; V116-V303 HydrophobicContact CG2-CG1 4.11Å; S136-V303 PolarHBondContact O-N 2.81Å; F137-V303 WeakPolarHBondContact CA-O 3.42Å; F137-V303 HydrophobicContact CD1-CB 3.62Å; F137-V303 HydrophobicContact CD1-CG1 4.11Å; F137-V303 HydrophobicContact CD1-CG2 3.85Å; F137-V303 HydrophobicContact CE1-CB 4Å; F137-V303 HydrophobicContact CE1-CG1 4.22Å; F137-V303 HydrophobicContact CE1-CG2 3.84Å; H138-V303 PolarHBondContact N-O 3.41Å; F301-V303 HydrophobicContact CB-CG2 4.35Å; V303-F305 HydrophobicContact CG1-CE2 4Å; V303-F305 WeakPolarHBondContact O-CD2 3.47Å
304	P	95.1	Very high	88.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	138.2	-178.4	31.5	-32.7	0	0	0	112.1	L111 V112 H138 I251 M270 L273 F302	L111-P304 HydrophobicContact CB-CG 4.48Å; L111-P304 HydrophobicContact CD1-CG 3.9Å; V112-P304 VanDerWaalsContact CG2-O 3.25Å; V112-P304 WeakPolarHBondContact CG2-O 3.37Å; H138-P304 CarbonylContact O-C 3.48Å; H138-P304 WeakPolarHBondContact O-CA 3.31Å; I251-P304 HydrophobicContact CD1-CB 3.87Å; I251-P304 HydrophobicContact CG1-CB 4.3Å; M270-P304 HydrophobicContact CE-CG 4.45Å; M270-P304 HydrophobicContact SD-CG 3.72Å; L273-P304 HydrophobicContact CD1-CB 3.68Å; L273-P304 HydrophobicContact CD1-CG 3.52Å; F302-P304 HydrophobicContact CE1-CB 4.19Å
305	F	97.2	Very high	90	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	109.9	175.7	-74.9	-108.7	0	0	0	109.2	Q109 V112 F137 H138 T143 G144 K145 V148 V303	Q109-F305 HydrophobicContact CG-CD1 4.34Å; V112-F305 HydrophobicContact CB-CZ 4.46Å; V112-F305 HydrophobicContact CG1-CE1 4.07Å; V112-F305 HydrophobicContact CG1-CE2 4.22Å; V112-F305 HydrophobicContact CG1-CZ 3.68Å; V112-F305 HydrophobicContact CG2-CD1 4.01Å; V112-F305 HydrophobicContact CG2-CD2 3.99Å; V112-F305 HydrophobicContact CG2-CE1 3.96Å; V112-F305 HydrophobicContact CG2-CE2 3.91Å; V112-F305 HydrophobicContact CG2-CG 4.03Å; V112-F305 HydrophobicContact CG2-CZ 3.91Å; F137-F305 HydrophobicContact CB-CD2 4.23Å; F137-F305 HydrophobicContact CB-CE2 3.58Å; F137-F305 HydrophobicContact CB-CZ 4.37Å; F137-F305 HydrophobicContact CD1-CE2 4.2Å; F137-F305 AromaticContact CD2-CE2 3.82Å; F137-F305 HydrophobicContact CD2-CE2 3.82Å; F137-F305 AromaticContact CD2-CZ 3.8Å; F137-F305 HydrophobicContact CD2-CZ 3.8Å; F137-F305 HydrophobicContact CE2-CZ 4.29Å; F137-F305 AromaticContact CG-CE2 3.61Å; F137-F305 HydrophobicContact CG-CE2 3.61Å; F137-F305 HydrophobicContact CG-CZ 4.08Å; H138-F305 WeakPolarHBondContact O-CB 3.34Å; H138-F305 PolarHBondContact O-N 3.18Å; T143-F305 WeakPolarHBondContact OG1-CB 3.37Å; G144-F305 VanDerWaalsContact C-CE1 3.49Å; K145-F305 HydrophobicContact CB-CZ 4.46Å; K145-F305 HydrophobicContact CD-CD2 4.46Å; K145-F305 HydrophobicContact CG-CB 4.4Å; K145-F305 HydrophobicContact CG-CD1 4.01Å; K145-F305 HydrophobicContact CG-CD2 3.77Å; K145-F305 HydrophobicContact CG-CE1 4.2Å; K145-F305 HydrophobicContact CG-CE2 3.99Å; K145-F305 HydrophobicContact CG-CG 3.79Å; K145-F305 HydrophobicContact CG-CZ 4.19Å; V148-F305 HydrophobicContact CB-CE1 4.35Å; V148-F305 HydrophobicContact CB-CZ 4.12Å; V148-F305 HydrophobicContact CG2-CE1 3.79Å; V148-F305 HydrophobicContact CG2-CZ 3.99Å; V303-F305 HydrophobicContact CG1-CE2 4Å; V303-F305 WeakPolarHBondContact O-CD2 3.47Å
306	L	97.4	Very high	91.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-72.6	151.4	-177.6	-66.1	172	0	0	0	111.3	Q109 L111 T143 I251 A255 R265 I268 L273	Q109-L306 PolarHBondContact NE2-O 2.85Å; L111-L306 HydrophobicContact CD1-CD1 4.32Å; T143-L306 WeakPolarHBondContact CG2-O 3.48Å; I251-L306 HydrophobicContact CG2-CD2 3.79Å; A255-L306 HydrophobicContact CB-CD2 4.44Å; R265-L306 HydrophobicContact CG-CD1 4.21Å; R265-L306 VanDerWaalsContact CZ-CB 3.49Å; R265-L306 PolarHBondContact NH2-O 3.13Å; I268-L306 HydrophobicContact CD1-CD1 4.36Å; I268-L306 HydrophobicContact CD1-CD2 4.23Å; I268-L306 HydrophobicContact CG2-CD2 4.37Å; L273-L306 HydrophobicContact CD1-CD2 4.38Å
307	P	97.1	Very high	93.4	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.019	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-65.4	145.8	178.3	26.1	-34	0	0	0	112.2	N252 A255 R265 F350	N252-P307 HydrophobicContact CB-CG 4.33Å; N252-P307 WeakPolarHBondContact ND2-CB 3.42Å; N252-P307 WeakPolarHBondContact OD1-CB 3.22Å; N252-P307 VanDerWaalsContact OD1-CD 3.31Å; N252-P307 WeakPolarHBondContact OD1-CD 3.43Å; N252-P307 WeakPolarHBondContact OD1-CG 3.45Å; A255-P307 HydrophobicContact CB-CG 3.83Å; R265-P307 PolarHBondContact NH1-O 3.37Å; R265-P307 PolarHBondContact NH2-O 3.36Å; P307-F350 HydrophobicContact CB-CB 3.93Å; P307-F350 HydrophobicContact CB-CD1 3.83Å; P307-F350 HydrophobicContact CB-CD2 4.23Å; P307-F350 HydrophobicContact CB-CE1 4.41Å; P307-F350 HydrophobicContact CB-CG 3.73Å; P307-F350 HydrophobicContact CG-CD1 3.76Å; P307-F350 HydrophobicContact CG-CD2 4.03Å; P307-F350 HydrophobicContact CG-CE1 3.83Å; P307-F350 HydrophobicContact CG-CE2 4.07Å; P307-F350 HydrophobicContact CG-CG 3.87Å; P307-F350 HydrophobicContact CG-CZ 3.98Å
308	L	97.4	Very high	94.6	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-88.9	119.3	-174.5	-62.7	-176.1	0	0	0	112.2	T143 H312 S351 C355	T143-L308 HydrophobicContact CG2-CG 4.44Å; L308-H312 HydrophobicContact CB-CB 4.2Å; L308-H312 HydrophobicContact CD2-CB 4.06Å; L308-S351 PolarHBondContact O-N 3.39Å; L308-C355 HydrophobicContact CD1-CB 4.25Å; L308-C355 WeakPolarHBondContact CD1-SG 3.41Å
309	E	96.4	Very high	95.2	Very high	30 Å²	30	34.3 Å²	34.3	14%	0.14	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-69	166.5	169	-65.8	157.4	-143	0	0	113.7	R265 R311 H312 V313 F350	R265-E309 WeakPolarHBondContact CD-OE1 3.22Å; R265-E309 IonicContact CZ-OE1 2.97Å; R265-E309 IonicContact NH1-OE1 3.3Å; R265-E309 PolarHBondContact NH1-OE1 2.97Å; E309-R311 VanDerWaalsContact C-N 3.29Å; E309-R311 HydrophobicContact CB-CG 4.22Å; E309-R311 PolarHBondContact O-N 2.98Å; E309-R311 IonicContact OE1-NH2 3.96Å; E309-R311 IonicContact OE2-CZ 3.94Å; E309-R311 IonicContact OE2-NE 3.96Å; E309-R311 PolarHBondContact OE2-NE 3.12Å; E309-R311 IonicContact OE2-NH2 3.06Å; E309-R311 PolarHBondContact OE2-NH2 2.72Å; E309-H312 PolarHBondContact N-ND1 3.11Å; E309-H312 WeakPolarHBondContact O-CB 3.29Å; E309-H312 PolarHBondContact O-N 2.85Å; E309-H312 IonicContact OE2-CE1 2.71Å; E309-V313 PolarHBondContact O-N 3.41Å; E309-F350 HydrophobicContact CG-CD1 4.07Å; E309-F350 HydrophobicContact CG-CE1 4.02Å
310	Y	95.6	Very high	95.5	Very high	70 Å²	70	34.1 Å²	34.1	28%	0.275	16%	0.155	S	C	.	.	H	α-helix	trans	-47	-46.7	174.8	-171.9	-94.5	0	0	0	114	H312 V313 K314 D334 A337 K338 Y342	Y310-H312 VanDerWaalsContact C-N 3.29Å; Y310-H312 PolarHBondContact O-N 3.23Å; Y310-V313 WeakPolarHBondContact O-CB 3.34Å; Y310-V313 PolarHBondContact O-N 2.86Å; Y310-K314 HydrophobicContact CD1-CD 4.17Å; Y310-K314 HydrophobicContact CD1-CG 4.41Å; Y310-K314 HydrophobicContact CE1-CD 3.57Å; Y310-K314 HydrophobicContact CE1-CG 4.02Å; Y310-K314 PolarHBondContact O-N 3.49Å; Y310-K314 VanDerWaalsContact O-N 3.1Å; Y310-D334 PolarHBondContact OH-O 3.46Å; Y310-D334 PolarHBondContact OH-OD1 3.45Å; Y310-A337 HydrophobicContact CD2-CB 4.16Å; Y310-A337 HydrophobicContact CE1-CB 4.34Å; Y310-A337 HydrophobicContact CE2-CB 3.49Å; Y310-A337 VanDerWaalsContact CE2-CB 3.49Å; Y310-K338 HydrophobicContact CE2-CG 4.33Å; Y310-Y342 HydrophobicContact CD2-CE1 4.11Å; Y310-Y342 HydrophobicContact CD2-CE2 4.19Å; Y310-Y342 AromaticContact CD2-CZ 3.6Å; Y310-Y342 WeakPolarHBondContact CD2-OH 3.29Å
311	R	95.3	Very high	95.7	Very high	112 Å²	112	31.7 Å²	31.7	42%	0.423	14%	0.141	S	C	.	.	H	α-helix	trans	-58.9	-38.7	179.2	61.4	177	173	142.3	3.5	112.7	E266 E309 K314 L315	E266-R311 IonicContact OE1-CZ 2.8Å; E266-R311 IonicContact OE1-NH1 3.6Å; E266-R311 PolarHBondContact OE1-NH1 2.77Å; E266-R311 IonicContact OE1-NH2 3.37Å; E266-R311 PolarHBondContact OE1-NH2 3.4Å; E266-R311 IonicContact OE2-NH2 3.51Å; E309-R311 VanDerWaalsContact C-N 3.29Å; E309-R311 HydrophobicContact CB-CG 4.22Å; E309-R311 PolarHBondContact O-N 2.98Å; E309-R311 IonicContact OE1-NH2 3.96Å; E309-R311 IonicContact OE2-CZ 3.94Å; E309-R311 IonicContact OE2-NE 3.96Å; E309-R311 PolarHBondContact OE2-NE 3.12Å; E309-R311 IonicContact OE2-NH2 3.06Å; E309-R311 PolarHBondContact OE2-NH2 2.72Å; R311-K314 PolarHBondContact O-N 3.38Å; R311-L315 WeakPolarHBondContact O-CG 3.5Å; R311-L315 PolarHBondContact O-N 3.46Å
312	H	97.3	Very high	95.8	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.032	15%	0.149	C	C	.	.	H	α-helix	trans	-72.3	-36.4	179.2	-53	124.7	0	0	0	111.6	H107 G108 L308 E309 Y310 K314 L315 C316	H107-H312 HydrophobicContact CB-CB 4.39Å; G108-H312 VanDerWaalsContact CA-CD2 3.44Å; G108-H312 WeakPolarHBondContact CA-CD2 3.36Å; G108-H312 VanDerWaalsContact CA-NE2 3.27Å; G108-H312 WeakPolarHBondContact CA-NE2 3.18Å; L308-H312 HydrophobicContact CB-CB 4.2Å; L308-H312 HydrophobicContact CD2-CB 4.06Å; E309-H312 PolarHBondContact N-ND1 3.11Å; E309-H312 WeakPolarHBondContact O-CB 3.29Å; E309-H312 PolarHBondContact O-N 2.85Å; E309-H312 IonicContact OE2-CE1 2.71Å; Y310-H312 VanDerWaalsContact C-N 3.29Å; Y310-H312 PolarHBondContact O-N 3.23Å; H312-K314 VanDerWaalsContact C-N 3.32Å; H312-K314 PolarHBondContact O-N 2.91Å; H312-L315 PolarHBondContact O-N 3.32Å; H312-C316 PolarHBondContact O-N 2.99Å; H312-C316 PolarHBondContact O-SG 2.95Å; H312-C316 VanDerWaalsContact O-SG 3.34Å
313	V	96.8	Very high	95.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-41.3	175.4	176.8	0	0	0	0	111.1	E309 Y310 L315 C316 A317 A337 M340 I358	E309-V313 PolarHBondContact O-N 3.41Å; Y310-V313 WeakPolarHBondContact O-CB 3.34Å; Y310-V313 PolarHBondContact O-N 2.86Å; V313-L315 VanDerWaalsContact C-N 3.35Å; V313-L315 PolarHBondContact O-N 3.47Å; V313-C316 WeakPolarHBondContact O-CB 3.43Å; V313-C316 PolarHBondContact O-N 3.49Å; V313-A317 PolarHBondContact O-N 3.03Å; V313-A337 HydrophobicContact CG1-CB 4.11Å; V313-M340 HydrophobicContact CG1-CG 3.96Å; V313-I358 HydrophobicContact CG1-CD1 3.71Å; V313-I358 HydrophobicContact CG1-CG1 4.37Å
314	K	96.4	Very high	95.8	Very high	44 Å²	44	39.6 Å²	39.6	19%	0.191	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-43.3	173.5	-75.2	-169.9	60.4	172.9	0	112.4	Y310 R311 H312 A317 R318 E330 A337	Y310-K314 HydrophobicContact CD1-CD 4.17Å; Y310-K314 HydrophobicContact CD1-CG 4.41Å; Y310-K314 HydrophobicContact CE1-CD 3.57Å; Y310-K314 HydrophobicContact CE1-CG 4.02Å; Y310-K314 PolarHBondContact O-N 3.49Å; Y310-K314 VanDerWaalsContact O-N 3.1Å; R311-K314 PolarHBondContact O-N 3.38Å; H312-K314 VanDerWaalsContact C-N 3.32Å; H312-K314 PolarHBondContact O-N 2.91Å; K314-A317 WeakPolarHBondContact O-CB 3.39Å; K314-A317 PolarHBondContact O-N 2.88Å; K314-R318 PolarHBondContact O-N 3.1Å; K314-E330 WeakPolarHBondContact CE-OE2 3.4Å; K314-E330 IonicContact NZ-OE2 2.69Å; K314-E330 PolarHBondContact NZ-OE2 3.36Å; K314-A337 HydrophobicContact CG-CB 3.67Å
315	L	96.8	Very high	95.7	Very high	60 Å²	60	43 Å²	43	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-43.6	176.4	-65.7	171.8	0	0	0	111.7	H107 R311 H312 V313 A317 R318 D319	H107-L315 HydrophobicContact CB-CB 4.36Å; H107-L315 HydrophobicContact CB-CD1 4.18Å; R311-L315 WeakPolarHBondContact O-CG 3.5Å; R311-L315 PolarHBondContact O-N 3.46Å; H312-L315 PolarHBondContact O-N 3.32Å; V313-L315 VanDerWaalsContact C-N 3.35Å; V313-L315 PolarHBondContact O-N 3.47Å; L315-A317 VanDerWaalsContact C-N 3.3Å; L315-A317 PolarHBondContact O-N 3.37Å; L315-R318 WeakPolarHBondContact O-CB 3.47Å; L315-R318 PolarHBondContact O-N 3.1Å; L315-D319 PolarHBondContact O-N 2.97Å
316	C	96.4	Very high	95.5	Very high	24 Å²	24	46.3 Å²	46.3	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-38.9	173.1	-66.7	0	0	0	0	112.8	H312 V313 D319 A320 C355	H312-C316 PolarHBondContact O-N 2.99Å; H312-C316 PolarHBondContact O-SG 2.95Å; H312-C316 VanDerWaalsContact O-SG 3.34Å; V313-C316 WeakPolarHBondContact O-CB 3.43Å; V313-C316 PolarHBondContact O-N 3.49Å; C316-D319 PolarHBondContact O-N 2.78Å; C316-A320 WeakPolarHBondContact O-CB 3.01Å; C316-A320 PolarHBondContact O-N 3.06Å; C316-C355 HydrophobicContact CB-CB 3.58Å; C316-C355 WeakPolarHBondContact CB-SG 3.42Å; C316-C355 WeakPolarHBondContact SG-CB 3.17Å; C316-C355 CovalentContact SG-SG 2.03Å; C316-C355 PolarHBondContact SG-SG 3.4Å
317	A	96.3	Very high	95.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-45.8	175.9	0	0	0	0	0	110.6	V313 K314 L315 D319 A320 Y321 L333 V336 I358	V313-A317 PolarHBondContact O-N 3.03Å; K314-A317 WeakPolarHBondContact O-CB 3.39Å; K314-A317 PolarHBondContact O-N 2.88Å; L315-A317 VanDerWaalsContact C-N 3.3Å; L315-A317 PolarHBondContact O-N 3.37Å; A317-D319 VanDerWaalsContact C-N 3.33Å; A317-D319 PolarHBondContact O-N 3.28Å; A317-A320 WeakPolarHBondContact O-CB 3.37Å; A317-A320 PolarHBondContact O-N 2.92Å; A317-A320 VanDerWaalsContact O-N 3.09Å; A317-Y321 VanDerWaalsContact O-CD2 3.27Å; A317-Y321 WeakPolarHBondContact O-CD2 3.31Å; A317-Y321 PolarHBondContact O-N 3.29Å; A317-L333 HydrophobicContact CB-CD2 3.87Å; A317-V336 HydrophobicContact CB-CB 4.41Å; A317-V336 HydrophobicContact CB-CG1 3.91Å; A317-I358 HydrophobicContact CB-CG2 4.04Å
318	R	96	Very high	94.9	Very high	121 Å²	121	57 Å²	57	46%	0.457	30%	0.304	S	S	.	.	H	α-helix	trans	-54.6	-50.2	175.3	-167.8	-175.7	78.6	173.3	5.5	111.4	K314 L315 A320 Y321 T322 L333	K314-R318 PolarHBondContact O-N 3.1Å; L315-R318 WeakPolarHBondContact O-CB 3.47Å; L315-R318 PolarHBondContact O-N 3.1Å; R318-A320 VanDerWaalsContact C-N 3.27Å; R318-A320 PolarHBondContact O-N 3.37Å; R318-Y321 PolarHBondContact O-N 2.82Å; R318-Y321 VanDerWaalsContact O-N 3.15Å; R318-T322 PolarHBondContact O-N 3.48Å; R318-T322 PolarHBondContact O-OG1 3.03Å; R318-T322 VanDerWaalsContact O-OG1 3.1Å; R318-L333 HydrophobicContact CB-CD1 4.02Å; R318-L333 HydrophobicContact CB-CD2 4.21Å; R318-L333 HydrophobicContact CG-CD1 4.24Å
319	D	95.4	Very high	94.7	Very high	50 Å²	50	61 Å²	61	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-34.5	179.6	-66.9	-7.1	0	0	0	112.1	H107 L315 C316 A317 T322 A323	H107-D319 IonicContact CD2-OD2 3.93Å; H107-D319 IonicContact CE1-OD2 3.76Å; H107-D319 IonicContact NE2-OD2 3.03Å; H107-D319 PolarHBondContact NE2-OD2 3.04Å; L315-D319 PolarHBondContact O-N 2.97Å; C316-D319 PolarHBondContact O-N 2.78Å; A317-D319 VanDerWaalsContact C-N 3.33Å; A317-D319 PolarHBondContact O-N 3.28Å; D319-T322 PolarHBondContact O-N 2.86Å; D319-A323 VanDerWaalsContact O-CB 3.31Å; D319-A323 WeakPolarHBondContact O-CB 3.47Å; D319-A323 PolarHBondContact O-N 3.35Å
320	A	94.8	Very high	94.6	Very high	12 Å²	12	65.2 Å²	65.2	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-68.2	-34.7	175.9	0	0	0	0	0	113	C316 A317 R318 I358 I362	C316-A320 WeakPolarHBondContact O-CB 3.01Å; C316-A320 PolarHBondContact O-N 3.06Å; A317-A320 WeakPolarHBondContact O-CB 3.37Å; A317-A320 PolarHBondContact O-N 2.92Å; A317-A320 VanDerWaalsContact O-N 3.09Å; R318-A320 VanDerWaalsContact C-N 3.27Å; R318-A320 PolarHBondContact O-N 3.37Å; A320-I358 HydrophobicContact CB-CG2 4.01Å; A320-I362 HydrophobicContact CB-CD1 3.89Å; A320-I362 HydrophobicContact CB-CG2 4.46Å
321	Y	95.3	Very high	94.5	Very high	10 Å²	10	64.5 Å²	64.5	4%	0.039	35%	0.353	C	S	.	.	H	α-helix	trans	-68.7	-47	170.5	-83.8	-84.3	0	0	0	111.3	A317 R318 A323 R324 G325 L326 A328 T332 L333 V336 I362 L366	A317-Y321 VanDerWaalsContact O-CD2 3.27Å; A317-Y321 WeakPolarHBondContact O-CD2 3.31Å; A317-Y321 PolarHBondContact O-N 3.29Å; R318-Y321 PolarHBondContact O-N 2.82Å; R318-Y321 VanDerWaalsContact O-N 3.15Å; Y321-A323 VanDerWaalsContact C-N 3.27Å; Y321-A323 PolarHBondContact O-N 2.66Å; Y321-R324 CarbonylContact O-C 3.58Å; Y321-R324 WeakPolarHBondContact O-CA 3.13Å; Y321-R324 WeakPolarHBondContact O-CB 3.47Å; Y321-R324 PolarHBondContact O-N 2.88Å; Y321-G325 PolarHBondContact O-N 3.44Å; Y321-L326 CarbonylContact C-O 3.59Å; Y321-L326 VanDerWaalsContact C-O 3.24Å; Y321-L326 HydrophobicContact CD1-CB 3.98Å; Y321-L326 HydrophobicContact CD1-CD1 4.23Å; Y321-L326 PolarHBondContact O-N 3.45Å; Y321-L326 VanDerWaalsContact O-N 3.08Å; Y321-A328 HydrophobicContact CD1-CB 3.87Å; Y321-A328 HydrophobicContact CD2-CB 3.59Å; Y321-A328 HydrophobicContact CE1-CB 4.12Å; Y321-A328 HydrophobicContact CE2-CB 3.9Å; Y321-A328 HydrophobicContact CG-CB 3.6Å; Y321-T332 HydrophobicContact CE2-CG2 4.34Å; Y321-T332 WeakPolarHBondContact OH-CG2 3.11Å; Y321-L333 HydrophobicContact CD2-CD2 3.92Å; Y321-L333 HydrophobicContact CE2-CD2 4.2Å; Y321-V336 HydrophobicContact CE2-CG2 4.32Å; Y321-I362 HydrophobicContact CD2-CG2 4.07Å; Y321-I362 HydrophobicContact CE2-CB 4.04Å; Y321-I362 HydrophobicContact CE2-CG2 3.58Å; Y321-L366 HydrophobicContact CD1-CD2 4.44Å; Y321-L366 HydrophobicContact CE1-CD2 3.82Å
322	T	94.4	Very high	94.4	Very high	90 Å²	90	60.6 Å²	60.6	55%	0.552	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-37.3	178.3	-56.2	0	0	0	0	111.9	R318 D319 R324 G325 L326	R318-T322 PolarHBondContact O-N 3.48Å; R318-T322 PolarHBondContact O-OG1 3.03Å; R318-T322 VanDerWaalsContact O-OG1 3.1Å; D319-T322 PolarHBondContact O-N 2.86Å; T322-R324 PolarHBondContact O-N 2.74Å; T322-R324 VanDerWaalsContact O-N 3.13Å; T322-G325 PolarHBondContact O-N 3.16Å; T322-L326 PolarHBondContact N-O 3.43Å
323	A	92.6	Very high	94.3	Very high	89 Å²	89	60.4 Å²	60.4	74%	0.736	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.7	174.8	0	0	0	0	0	113.7	D319 Y321	D319-A323 VanDerWaalsContact O-CB 3.31Å; D319-A323 WeakPolarHBondContact O-CB 3.47Å; D319-A323 PolarHBondContact O-N 3.35Å; Y321-A323 VanDerWaalsContact C-N 3.27Å; Y321-A323 PolarHBondContact O-N 2.66Å
324	R	92	Very high	94.3	Very high	104 Å²	104	62.2 Å²	62.2	39%	0.392	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	5	174	-62.5	-174.5	-179.9	-162	7.2	113.5	Y321 T322 L326 P359 N363	Y321-R324 CarbonylContact O-C 3.58Å; Y321-R324 WeakPolarHBondContact O-CA 3.13Å; Y321-R324 WeakPolarHBondContact O-CB 3.47Å; Y321-R324 PolarHBondContact O-N 2.88Å; T322-R324 PolarHBondContact O-N 2.74Å; T322-R324 VanDerWaalsContact O-N 3.13Å; R324-L326 HydrophobicContact CB-CD1 4.21Å; R324-L326 HydrophobicContact CB-CG 4.22Å; R324-L326 PolarHBondContact O-N 3.28Å; R324-P359 PolarHBondContact NH2-O 3.39Å; R324-N363 PolarHBondContact NH1-OD1 3.15Å; R324-N363 PolarHBondContact NH2-OD1 2.93Å
325	G	93.6	Very high	94.2	Very high	72 Å²	72	65.2 Å²	65.2	74%	0.742	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	23.6	-174.8	0	0	0	0	0	113.4	Y321 T322	Y321-G325 PolarHBondContact O-N 3.44Å; T322-G325 PolarHBondContact O-N 3.16Å
326	L	93.3	Very high	94.1	Very high	69 Å²	69	62.4 Å²	62.4	36%	0.361	35%	0.351	S	S	.	.			trans	-107.3	146.5	177.5	-61	174.4	0	0	0	110	Y321 T322 R324 L366	Y321-L326 CarbonylContact C-O 3.59Å; Y321-L326 VanDerWaalsContact C-O 3.24Å; Y321-L326 HydrophobicContact CD1-CB 3.98Å; Y321-L326 HydrophobicContact CD1-CD1 4.23Å; Y321-L326 PolarHBondContact O-N 3.45Å; Y321-L326 VanDerWaalsContact O-N 3.08Å; T322-L326 PolarHBondContact N-O 3.43Å; R324-L326 HydrophobicContact CB-CD1 4.21Å; R324-L326 HydrophobicContact CB-CG 4.22Å; R324-L326 PolarHBondContact O-N 3.28Å; L326-L366 HydrophobicContact CD1-CD2 3.39Å
327	E	91.3	Very high	94	Very high	198 Å²	198	61.2 Å²	61.2	93%	0.925	34%	0.343	S	S	*	.			trans	-103.6	128.7	166.9	-65.2	-168.4	163	0	0	108.6
328	A	89.8	Confident	93.8	Very high	29 Å²	29	67.9 Å²	67.9	24%	0.24	37%	0.372	C	S	.	.			trans	-106	138.7	174.8	0	0	0	0	0	109.3	Y321 L333	Y321-A328 HydrophobicContact CD1-CB 3.87Å; Y321-A328 HydrophobicContact CD2-CB 3.59Å; Y321-A328 HydrophobicContact CE1-CB 4.12Å; Y321-A328 HydrophobicContact CE2-CB 3.9Å; Y321-A328 HydrophobicContact CG-CB 3.6Å; A328-L333 HydrophobicContact CB-CD2 3.72Å; A328-L333 HydrophobicContact CB-CG 3.96Å
329	D	92.9	Very high	93.7	Very high	90 Å²	90	64 Å²	64	48%	0.481	37%	0.365	S	S	.	.			trans	-73.9	159.8	170.3	67.5	-41.8	0	0	0	110.9	A331 T332 L333	D329-A331 PolarHBondContact O-N 3.49Å; D329-A331 VanDerWaalsContact O-N 3.16Å; D329-A331 WeakPolarHBondContact OD2-CB 2.77Å; D329-T332 PolarHBondContact O-N 2.95Å; D329-T332 WeakPolarHBondContact OD1-CB 2.99Å; D329-T332 PolarHBondContact OD1-N 2.01Å; D329-T332 PolarHBondContact OD1-OG1 3.08Å; D329-L333 WeakPolarHBondContact O-CG 3.36Å; D329-L333 PolarHBondContact O-N 2.99Å; D329-L333 VanDerWaalsContact O-N 3.11Å
330	E	94.3	Very high	93.6	Very high	119 Å²	119	62.1 Å²	62.1	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-59.7	-28.5	-178.5	-78.7	-65.5	153.7	0	0	113.1	K314 D334	K314-E330 WeakPolarHBondContact CE-OE2 3.4Å; K314-E330 IonicContact NZ-OE2 2.69Å; K314-E330 PolarHBondContact NZ-OE2 3.36Å; E330-D334 WeakPolarHBondContact O-CB 3.34Å; E330-D334 PolarHBondContact O-N 3.33Å; E330-D334 VanDerWaalsContact O-N 3.07Å
331	A	94.1	Very high	93.6	Very high	54 Å²	54	67 Å²	67	45%	0.446	38%	0.379	S	S	.	.	H	α-helix	trans	-71.1	-46.4	177.7	0	0	0	0	0	111.6	D329 L333 D334 E335	D329-A331 PolarHBondContact O-N 3.49Å; D329-A331 VanDerWaalsContact O-N 3.16Å; D329-A331 WeakPolarHBondContact OD2-CB 2.77Å; A331-L333 VanDerWaalsContact C-N 3.31Å; A331-L333 PolarHBondContact O-N 2.98Å; A331-D334 WeakPolarHBondContact O-CB 3.44Å; A331-D334 PolarHBondContact O-N 3.4Å; A331-D334 VanDerWaalsContact O-N 3.12Å; A331-E335 WeakPolarHBondContact O-CG 3.36Å; A331-E335 PolarHBondContact O-N 2.85Å
332	T	93.6	Very high	93.6	Very high	30 Å²	30	67.9 Å²	67.9	18%	0.184	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-40.8	175.4	-60	0	0	0	0	111.6	Y321 D329 D334 E335 V336 F365	Y321-T332 HydrophobicContact CE2-CG2 4.34Å; Y321-T332 WeakPolarHBondContact OH-CG2 3.11Å; D329-T332 PolarHBondContact O-N 2.95Å; D329-T332 WeakPolarHBondContact OD1-CB 2.99Å; D329-T332 PolarHBondContact OD1-N 2.01Å; D329-T332 PolarHBondContact OD1-OG1 3.08Å; T332-D334 VanDerWaalsContact C-N 3.27Å; T332-D334 PolarHBondContact O-N 3.29Å; T332-E335 PolarHBondContact O-N 2.78Å; T332-V336 WeakPolarHBondContact O-CG2 3.15Å; T332-V336 PolarHBondContact O-N 3.22Å; T332-F365 HydrophobicContact CG2-CB 4.19Å
333	L	95.2	Very high	93.5	Very high	3 Å²	3	65.4 Å²	65.4	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-38.1	175.6	-65.2	179.9	0	0	0	112.2	A317 R318 Y321 A328 D329 A331 A337	A317-L333 HydrophobicContact CB-CD2 3.87Å; R318-L333 HydrophobicContact CB-CD1 4.02Å; R318-L333 HydrophobicContact CB-CD2 4.21Å; R318-L333 HydrophobicContact CG-CD1 4.24Å; Y321-L333 HydrophobicContact CD2-CD2 3.92Å; Y321-L333 HydrophobicContact CE2-CD2 4.2Å; A328-L333 HydrophobicContact CB-CD2 3.72Å; A328-L333 HydrophobicContact CB-CG 3.96Å; D329-L333 WeakPolarHBondContact O-CG 3.36Å; D329-L333 PolarHBondContact O-N 2.99Å; D329-L333 VanDerWaalsContact O-N 3.11Å; A331-L333 VanDerWaalsContact C-N 3.31Å; A331-L333 PolarHBondContact O-N 2.98Å; L333-A337 WeakPolarHBondContact O-CB 3.4Å; L333-A337 PolarHBondContact O-N 2.59Å
334	D	95.2	Very high	93.5	Very high	39 Å²	39	62.9 Å²	62.9	21%	0.209	34%	0.343	C	S	.	.	H	α-helix	trans	-68	-40.5	176.5	-163.3	69.8	0	0	0	112	Y310 E330 A331 T332 A337 K338	Y310-D334 PolarHBondContact OH-O 3.46Å; Y310-D334 PolarHBondContact OH-OD1 3.45Å; E330-D334 WeakPolarHBondContact O-CB 3.34Å; E330-D334 PolarHBondContact O-N 3.33Å; E330-D334 VanDerWaalsContact O-N 3.07Å; A331-D334 WeakPolarHBondContact O-CB 3.44Å; A331-D334 PolarHBondContact O-N 3.4Å; A331-D334 VanDerWaalsContact O-N 3.12Å; T332-D334 VanDerWaalsContact C-N 3.27Å; T332-D334 PolarHBondContact O-N 3.29Å; D334-A337 PolarHBondContact O-N 2.82Å; D334-K338 WeakPolarHBondContact O-CB 3.4Å; D334-K338 WeakPolarHBondContact O-CG 3.4Å; D334-K338 PolarHBondContact O-N 3.43Å; D334-K338 WeakPolarHBondContact OD2-CE 3.41Å; D334-K338 IonicContact OD2-NZ 2.62Å; D334-K338 PolarHBondContact OD2-NZ 3.3Å
335	E	94.4	Very high	93.4	Very high	107 Å²	107	66.1 Å²	66.1	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-44.7	174.5	-71.5	-174.3	177.7	0	0	112.3	A331 T332 A337 K338 A339 F365	A331-E335 WeakPolarHBondContact O-CG 3.36Å; A331-E335 PolarHBondContact O-N 2.85Å; T332-E335 PolarHBondContact O-N 2.78Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.46Å; E335-K338 PolarHBondContact O-N 3.25Å; E335-A339 PolarHBondContact O-N 3.31Å; E335-F365 HydrophobicContact CB-CD1 4.13Å; E335-F365 HydrophobicContact CB-CE1 3.9Å
336	V	94.6	Very high	93.1	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-44.2	176.1	172.6	0	0	0	0	110.8	A317 Y321 T332 A339 I358 I362 F365	A317-V336 HydrophobicContact CB-CB 4.41Å; A317-V336 HydrophobicContact CB-CG1 3.91Å; Y321-V336 HydrophobicContact CE2-CG2 4.32Å; T332-V336 WeakPolarHBondContact O-CG2 3.15Å; T332-V336 PolarHBondContact O-N 3.22Å; V336-A339 PolarHBondContact O-N 3.44Å; V336-I358 HydrophobicContact CG1-CD1 3.94Å; V336-I362 HydrophobicContact CG1-CG2 4.19Å; V336-I362 HydrophobicContact CG2-CG2 4.37Å; V336-F365 HydrophobicContact CG2-CB 4.13Å; V336-F365 HydrophobicContact CG2-CD1 4.46Å; V336-F365 HydrophobicContact CG2-CD2 3.58Å; V336-F365 HydrophobicContact CG2-CE2 4.06Å; V336-F365 HydrophobicContact CG2-CG 3.81Å
337	A	94.6	Very high	92.9	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-45.2	178.5	0	0	0	0	0	111.6	Y310 V313 K314 L333 D334 E335 A339 M340 Y342	Y310-A337 HydrophobicContact CD2-CB 4.16Å; Y310-A337 HydrophobicContact CE1-CB 4.34Å; Y310-A337 HydrophobicContact CE2-CB 3.49Å; Y310-A337 VanDerWaalsContact CE2-CB 3.49Å; V313-A337 HydrophobicContact CG1-CB 4.11Å; K314-A337 HydrophobicContact CG-CB 3.67Å; L333-A337 WeakPolarHBondContact O-CB 3.4Å; L333-A337 PolarHBondContact O-N 2.59Å; D334-A337 PolarHBondContact O-N 2.82Å; E335-A337 VanDerWaalsContact C-N 3.33Å; E335-A337 PolarHBondContact O-N 3.46Å; A337-A339 PolarHBondContact O-N 2.86Å; A337-M340 VanDerWaalsContact O-CB 3.28Å; A337-M340 WeakPolarHBondContact O-CB 3.33Å; A337-M340 PolarHBondContact O-N 3.43Å; A337-Y342 WeakPolarHBondContact O-CE2 3.27Å; A337-Y342 PolarHBondContact O-OH 2.92Å; A337-Y342 VanDerWaalsContact O-OH 3.1Å
338	K	93.6	Very high	92.8	Very high	139 Å²	139	69.3 Å²	69.3	60%	0.604	35%	0.346	S	S	*	.	H	α-helix	trans	-58.6	-29	175.1	-79.9	167.8	173.8	164.7	0	113.8	Y310 D334 E335 M340	Y310-K338 HydrophobicContact CE2-CG 4.33Å; D334-K338 WeakPolarHBondContact O-CB 3.4Å; D334-K338 WeakPolarHBondContact O-CG 3.4Å; D334-K338 PolarHBondContact O-N 3.43Å; D334-K338 WeakPolarHBondContact OD2-CE 3.41Å; D334-K338 IonicContact OD2-NZ 2.62Å; D334-K338 PolarHBondContact OD2-NZ 3.3Å; E335-K338 PolarHBondContact O-N 3.25Å; K338-M340 PolarHBondContact O-N 2.81Å
339	A	92.8	Very high	93	Very high	39 Å²	39	69 Å²	69	32%	0.322	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.5	177.7	0	0	0	0	0	113.9	E335 V336 A337 R361 F365	E335-A339 PolarHBondContact O-N 3.31Å; V336-A339 PolarHBondContact O-N 3.44Å; A337-A339 PolarHBondContact O-N 2.86Å; A339-R361 PolarHBondContact O-NH1 3.12Å; A339-F365 HydrophobicContact CB-CE2 4.33Å; A339-F365 HydrophobicContact CB-CZ 3.91Å
340	M	94.1	Very high	93.1	Very high	12 Å²	12	65 Å²	65	6%	0.059	32%	0.319	C	S	.	.	S	Bend	trans	-82.4	158.3	177.3	-64.3	-68	-71.5	0	0	112.1	V313 A337 K338 Y342 G354 S357 I358 R361	V313-M340 HydrophobicContact CG1-CG 3.96Å; A337-M340 VanDerWaalsContact O-CB 3.28Å; A337-M340 WeakPolarHBondContact O-CB 3.33Å; A337-M340 PolarHBondContact O-N 3.43Å; K338-M340 PolarHBondContact O-N 2.81Å; M340-Y342 HydrophobicContact CB-CD2 4.49Å; M340-Y342 HydrophobicContact CB-CE2 3.73Å; M340-Y342 WeakPolarHBondContact O-CD2 3.24Å; M340-G354 VanDerWaalsContact CE-O 3.26Å; M340-G354 WeakPolarHBondContact CE-O 3.2Å; M340-S357 VanDerWaalsContact CE-OG 3.3Å; M340-S357 WeakPolarHBondContact CE-OG 3.5Å; M340-S357 PolarHBondContact SD-OG 3.49Å; M340-S357 VanDerWaalsContact SD-OG 3.34Å; M340-I358 HydrophobicContact CE-CD1 4.18Å; M340-I358 HydrophobicContact CE-CG1 4.41Å; M340-I358 HydrophobicContact CG-CD1 3.9Å; M340-I358 HydrophobicContact SD-CD1 3.7Å; M340-I358 HydrophobicContact SD-CG1 4.44Å; M340-R361 WeakPolarHBondContact SD-CD 3.33Å; M340-R361 PolarHBondContact SD-NE 3.48Å; M340-R361 VanDerWaalsContact SD-NE 3.41Å
341	L	94.1	Very high	93.2	Very high	115 Å²	115	59.5 Å²	59.5	60%	0.602	29%	0.294	S	S	*	.			trans	-92.5	128.5	176.2	-170	123.8	0	0	0	110.1	V343 A352	L341-V343 HydrophobicContact CD2-CG1 4.31Å; L341-A352 HydrophobicContact CD2-CB 3.46Å; L341-A352 VanDerWaalsContact CD2-CB 3.46Å; L341-A352 PolarHBondContact O-N 2.88Å
342	Y	95.2	Very high	93.2	Very high	27 Å²	27	57.8 Å²	57.8	11%	0.106	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	147.2	-178.9	-65.7	-94.2	0	0	0	112.4	Y310 A337 M340 R348 F350	Y310-Y342 HydrophobicContact CD2-CE1 4.11Å; Y310-Y342 HydrophobicContact CD2-CE2 4.19Å; Y310-Y342 AromaticContact CD2-CZ 3.6Å; Y310-Y342 WeakPolarHBondContact CD2-OH 3.29Å; A337-Y342 WeakPolarHBondContact O-CE2 3.27Å; A337-Y342 PolarHBondContact O-OH 2.92Å; A337-Y342 VanDerWaalsContact O-OH 3.1Å; M340-Y342 HydrophobicContact CB-CD2 4.49Å; M340-Y342 HydrophobicContact CB-CE2 3.73Å; M340-Y342 WeakPolarHBondContact O-CD2 3.24Å; Y342-R348 WeakPolarHBondContact CB-O 3.11Å; Y342-F350 CarbonylContact C-O 3.55Å; Y342-F350 WeakPolarHBondContact CA-O 3.19Å
343	V	93.5	Very high	93.1	Very high	38 Å²	38	60.8 Å²	60.8	23%	0.23	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.5	179.5	-67.9	0	0	0	0	110.5	W140 L341 L349 F350 A352	W140-V343 HydrophobicContact CH2-CG2 4.38Å; W140-V343 HydrophobicContact CZ2-CG2 4.37Å; L341-V343 HydrophobicContact CD2-CG1 4.31Å; V343-L349 PolarHBondContact O-N 2.81Å; V343-F350 HydrophobicContact CG2-CB 4.38Å; V343-F350 WeakPolarHBondContact CG2-O 3.32Å; V343-F350 PolarHBondContact N-O 3.4Å; V343-F350 PolarHBondContact O-N 3.13Å; V343-A352 HydrophobicContact CG1-CB 4.08Å; V343-A352 HydrophobicContact CG2-CB 4.27Å
344	P	92.4	Very high	93.1	Very high	36 Å²	36	60.7 Å²	60.7	23%	0.234	29%	0.291	C	S	.	.	S	Bend	cis	-65.3	169.7	-7.3	-7.3	22.7	0	0	0	112	L256 E346 E347 R348	L256-P344 HydrophobicContact CD1-CG 4.37Å; L256-P344 HydrophobicContact CD2-CG 4.14Å; P344-E346 VanDerWaalsContact C-N 3.26Å; P344-E346 PolarHBondContact O-N 3.43Å; P344-E347 VanDerWaalsContact CB-OE2 3.28Å; P344-E347 WeakPolarHBondContact CB-OE2 3.08Å; P344-E347 VanDerWaalsContact CG-OE2 3.26Å; P344-E347 WeakPolarHBondContact CG-OE2 3.29Å; P344-R348 VanDerWaalsContact O-CA 3.25Å; P344-R348 WeakPolarHBondContact O-CA 3.35Å; P344-R348 PolarHBondContact O-N 3.12Å
345	K	88.3	Confident	93.1	Very high	173 Å²	173	59.9 Å²	59.9	75%	0.752	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.4	-171.9	-74.2	-177.7	-179.3	175	0	112.2	R348	K345-R348 WeakPolarHBondContact O-CG 3.36Å
346	E	88	Confident	93.1	Very high	147 Å²	147	61.7 Å²	61.7	69%	0.687	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-51.7	-174.9	-61.1	69	-153.9	0	0	110	P344	P344-E346 VanDerWaalsContact C-N 3.26Å; P344-E346 PolarHBondContact O-N 3.43Å
347	E	88.7	Confident	93.1	Very high	78 Å²	78	62.2 Å²	62.2	36%	0.364	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-22.2	-177.4	-56.2	78.8	-172	0	0	113.6	W259 P344 L349	W259-E347 HydrophobicContact CH2-CB 4.33Å; W259-E347 HydrophobicContact CH2-CG 4.14Å; W259-E347 HydrophobicContact CZ3-CB 4.44Å; W259-E347 HydrophobicContact CZ3-CG 3.95Å; P344-E347 VanDerWaalsContact CB-OE2 3.28Å; P344-E347 WeakPolarHBondContact CB-OE2 3.08Å; P344-E347 VanDerWaalsContact CG-OE2 3.26Å; P344-E347 WeakPolarHBondContact CG-OE2 3.29Å; E347-L349 VanDerWaalsContact C-N 3.28Å; E347-L349 HydrophobicContact CB-CB 4.46Å; E347-L349 PolarHBondContact O-N 2.88Å
348	R	90.7	Very high	93.1	Very high	180 Å²	180	62.3 Å²	62.3	68%	0.679	30%	0.299	S	S	*	.			trans	49.7	45.7	-178	-62.2	-174.9	178.9	-173.8	-0.8	113.3	Y342 P344 K345	Y342-R348 WeakPolarHBondContact CB-O 3.11Å; P344-R348 VanDerWaalsContact O-CA 3.25Å; P344-R348 WeakPolarHBondContact O-CA 3.35Å; P344-R348 PolarHBondContact O-N 3.12Å; K345-R348 WeakPolarHBondContact O-CG 3.36Å
349	L	92	Very high	93	Very high	22 Å²	22	59 Å²	59	12%	0.115	29%	0.291	C	S	.	.			trans	-83.7	-50.2	-169.2	-174.5	61.4	0	0	0	113.5	L256 W259 V343 E347	L256-L349 HydrophobicContact CD1-CD2 4.06Å; W259-L349 HydrophobicContact CB-CD2 3.91Å; W259-L349 HydrophobicContact CD2-CD1 4.33Å; W259-L349 HydrophobicContact CD2-CD2 3.57Å; W259-L349 HydrophobicContact CE3-CD2 4.1Å; W259-L349 HydrophobicContact CG-CD1 4.33Å; W259-L349 HydrophobicContact CG-CD2 3.45Å; W259-L349 VanDerWaalsContact CG-CD2 3.45Å; W259-L349 HydrophobicContact CZ2-CD1 4.37Å; V343-L349 PolarHBondContact O-N 2.81Å; E347-L349 VanDerWaalsContact C-N 3.28Å; E347-L349 HydrophobicContact CB-CB 4.46Å; E347-L349 PolarHBondContact O-N 2.88Å
350	F	96	Very high	92.9	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.7	-171	-56.9	-51.8	0	0	0	112.3	A255 L256 P307 E309 Y342 V343 A352	A255-F350 HydrophobicContact CB-CE2 4.48Å; A255-F350 HydrophobicContact CB-CZ 3.9Å; L256-F350 HydrophobicContact CB-CE2 4.14Å; L256-F350 HydrophobicContact CD1-CE2 4.21Å; P307-F350 HydrophobicContact CB-CB 3.93Å; P307-F350 HydrophobicContact CB-CD1 3.83Å; P307-F350 HydrophobicContact CB-CD2 4.23Å; P307-F350 HydrophobicContact CB-CE1 4.41Å; P307-F350 HydrophobicContact CB-CG 3.73Å; P307-F350 HydrophobicContact CG-CD1 3.76Å; P307-F350 HydrophobicContact CG-CD2 4.03Å; P307-F350 HydrophobicContact CG-CE1 3.83Å; P307-F350 HydrophobicContact CG-CE2 4.07Å; P307-F350 HydrophobicContact CG-CG 3.87Å; P307-F350 HydrophobicContact CG-CZ 3.98Å; E309-F350 HydrophobicContact CG-CD1 4.07Å; E309-F350 HydrophobicContact CG-CE1 4.02Å; Y342-F350 CarbonylContact C-O 3.55Å; Y342-F350 WeakPolarHBondContact CA-O 3.19Å; V343-F350 HydrophobicContact CG2-CB 4.38Å; V343-F350 WeakPolarHBondContact CG2-O 3.32Å; V343-F350 PolarHBondContact N-O 3.4Å; V343-F350 PolarHBondContact O-N 3.13Å; F350-A352 PolarHBondContact O-N 3.46Å
351	S	95.9	Very high	92.7	Very high	4 Å²	4	66.8 Å²	66.8	3%	0.028	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	122	173.5	174.8	0	0	0	0	110.8	L308 Q353 G354	L308-S351 PolarHBondContact O-N 3.39Å; S351-Q353 PolarHBondContact O-N 2.8Å; S351-G354 PolarHBondContact O-N 3Å; S351-G354 VanDerWaalsContact O-N 3.16Å; S351-G354 WeakPolarHBondContact OG-CA 3.3Å; S351-G354 PolarHBondContact OG-N 3.49Å; S351-G354 VanDerWaalsContact OG-N 3.15Å; S351-G354 PolarHBondContact OG-O 2.97Å
352	A	93.7	Very high	92.6	Very high	17 Å²	17	61.3 Å²	61.3	14%	0.14	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.4	-178.9	0	0	0	0	0	113.9	W140 L341 V343 F350	W140-A352 PolarHBondContact NE1-O 2.71Å; L341-A352 HydrophobicContact CD2-CB 3.46Å; L341-A352 VanDerWaalsContact CD2-CB 3.46Å; L341-A352 PolarHBondContact O-N 2.88Å; V343-A352 HydrophobicContact CG1-CB 4.08Å; V343-A352 HydrophobicContact CG2-CB 4.27Å; F350-A352 PolarHBondContact O-N 3.46Å
353	Q	92.6	Very high	92.4	Very high	93 Å²	93	64 Å²	64	44%	0.435	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	9.5	177.7	-63.4	-175.8	-12.7	0	0	112.5	T141 G142 S351 C355 K356	T141-Q353 CarbonylContact O-C 3.44Å; G142-Q353 WeakPolarHBondContact CA-O 3.25Å; S351-Q353 PolarHBondContact O-N 2.8Å; Q353-C355 PolarHBondContact O-N 2.07Å; Q353-K356 WeakPolarHBondContact O-CB 2.97Å; Q353-K356 PolarHBondContact O-N 3.16Å; Q353-K356 VanDerWaalsContact O-N 3.12Å
354	G	94.8	Very high	92.2	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.01	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	-127.9	-170.7	0	0	0	0	0	111.3	G142 M340 S351	G142-G354 WeakPolarHBondContact O-CA 3.35Å; M340-G354 VanDerWaalsContact CE-O 3.26Å; M340-G354 WeakPolarHBondContact CE-O 3.2Å; S351-G354 PolarHBondContact O-N 3Å; S351-G354 VanDerWaalsContact O-N 3.16Å; S351-G354 WeakPolarHBondContact OG-CA 3.3Å; S351-G354 PolarHBondContact OG-N 3.49Å; S351-G354 VanDerWaalsContact OG-N 3.15Å; S351-G354 PolarHBondContact OG-O 2.97Å
355	C	96.2	Very high	91.9	Very high	22 Å²	22	71.4 Å²	71.4	15%	0.149	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	7	177.1	-64.7	0	0	0	0	114.2	G142 L308 C316 Q353 S357 I358	G142-C355 PolarHBondContact O-N 3.29Å; L308-C355 HydrophobicContact CD1-CB 4.25Å; L308-C355 WeakPolarHBondContact CD1-SG 3.41Å; C316-C355 HydrophobicContact CB-CB 3.58Å; C316-C355 WeakPolarHBondContact CB-SG 3.42Å; C316-C355 WeakPolarHBondContact SG-CB 3.17Å; C316-C355 CovalentContact SG-SG 2.03Å; C316-C355 PolarHBondContact SG-SG 3.4Å; Q353-C355 PolarHBondContact O-N 2.07Å; C355-S357 PolarHBondContact O-N 2.95Å; C355-I358 HydrophobicContact CB-CG1 4.33Å; C355-I358 WeakPolarHBondContact O-CB 3.16Å; C355-I358 PolarHBondContact O-N 3.46Å
356	K	94.4	Very high	91.7	Very high	145 Å²	145	65.9 Å²	65.9	63%	0.63	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-41.2	-170	-173.1	173.8	-178	173.5	0	113.7	Q353	Q353-K356 WeakPolarHBondContact O-CB 2.97Å; Q353-K356 PolarHBondContact O-N 3.16Å; Q353-K356 VanDerWaalsContact O-N 3.12Å
357	S	93.4	Very high	90.6	Very high	12 Å²	12	68.1 Å²	68.1	8%	0.084	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.5	-177	62.1	0	0	0	0	114.4	M340 C355 Q360 R361	M340-S357 VanDerWaalsContact CE-OG 3.3Å; M340-S357 WeakPolarHBondContact CE-OG 3.5Å; M340-S357 PolarHBondContact SD-OG 3.49Å; M340-S357 VanDerWaalsContact SD-OG 3.34Å; C355-S357 PolarHBondContact O-N 2.95Å; S357-Q360 PolarHBondContact O-N 3.45Å; S357-R361 WeakPolarHBondContact O-CB 3.42Å; S357-R361 WeakPolarHBondContact O-CG 3.4Å; S357-R361 PolarHBondContact O-N 3.11Å; S357-R361 WeakPolarHBondContact OG-CD 3.2Å; S357-R361 PolarHBondContact OG-NE 3.09Å; S357-R361 VanDerWaalsContact OG-NE 3.1Å
358	I	94.2	Very high	90.7	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-47.7	-171.9	-66.4	-69.4	0	0	0	112.6	V313 A317 A320 V336 M340 C355 Q360 R361 I362	V313-I358 HydrophobicContact CG1-CD1 3.71Å; V313-I358 HydrophobicContact CG1-CG1 4.37Å; A317-I358 HydrophobicContact CB-CG2 4.04Å; A320-I358 HydrophobicContact CB-CG2 4.01Å; V336-I358 HydrophobicContact CG1-CD1 3.94Å; M340-I358 HydrophobicContact CE-CD1 4.18Å; M340-I358 HydrophobicContact CE-CG1 4.41Å; M340-I358 HydrophobicContact CG-CD1 3.9Å; M340-I358 HydrophobicContact SD-CD1 3.7Å; M340-I358 HydrophobicContact SD-CG1 4.44Å; C355-I358 HydrophobicContact CB-CG1 4.33Å; C355-I358 WeakPolarHBondContact O-CB 3.16Å; C355-I358 PolarHBondContact O-N 3.46Å; I358-Q360 PolarHBondContact O-N 3.45Å; I358-Q360 VanDerWaalsContact O-N 3.07Å; I358-R361 PolarHBondContact O-N 3.46Å; I358-I362 HydrophobicContact CG2-CG2 4.26Å; I358-I362 PolarHBondContact O-N 2.92Å
359	P	92.1	Very high	90.7	Very high	69 Å²	69	61.7 Å²	61.7	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-25.8	-179.2	-26	35.9	0	0	0	114.6	R324 I362	R324-P359 PolarHBondContact NH2-O 3.39Å; P359-I362 WeakPolarHBondContact O-CG1 3.19Å
360	Q	91.3	Very high	90.6	Very high	141 Å²	141	63.9 Å²	63.9	66%	0.659	33%	0.329	S	S	*	.	H	α-helix	trans	-85.8	-36.8	175.6	-67.2	173.2	-15.5	0	0	111.6	S357 I358 N363	S357-Q360 PolarHBondContact O-N 3.45Å; I358-Q360 PolarHBondContact O-N 3.45Å; I358-Q360 VanDerWaalsContact O-N 3.07Å; Q360-N363 VanDerWaalsContact O-CB 3.31Å; Q360-N363 WeakPolarHBondContact O-CB 3.47Å; Q360-N363 PolarHBondContact O-N 2.96Å; Q360-N363 PolarHBondContact O-ND2 2.93Å; Q360-N363 VanDerWaalsContact O-ND2 3.12Å
361	R	89.7	Confident	90.3	Very high	73 Å²	73	67.3 Å²	67.3	28%	0.275	35%	0.346	S	S	.	.	H	α-helix	trans	-70.1	-34.6	-177.4	-78.3	177	177.1	-96.7	6	113.6	A339 M340 S357 I358 N363 F364 F365	A339-R361 PolarHBondContact O-NH1 3.12Å; M340-R361 WeakPolarHBondContact SD-CD 3.33Å; M340-R361 PolarHBondContact SD-NE 3.48Å; M340-R361 VanDerWaalsContact SD-NE 3.41Å; S357-R361 WeakPolarHBondContact O-CB 3.42Å; S357-R361 WeakPolarHBondContact O-CG 3.4Å; S357-R361 PolarHBondContact O-N 3.11Å; S357-R361 WeakPolarHBondContact OG-CD 3.2Å; S357-R361 PolarHBondContact OG-NE 3.09Å; S357-R361 VanDerWaalsContact OG-NE 3.1Å; I358-R361 PolarHBondContact O-N 3.46Å; R361-N363 PolarHBondContact O-N 2.83Å; R361-F364 WeakPolarHBondContact O-CD2 3.15Å; R361-F364 PolarHBondContact O-N 2.91Å; R361-F365 WeakPolarHBondContact O-CD2 3.49Å
362	I	91.9	Very high	90	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-56.6	-24	177.6	58.7	168.9	0	0	0	112.5	A320 Y321 V336 I358 P359 F364 F365 L366	A320-I362 HydrophobicContact CB-CD1 3.89Å; A320-I362 HydrophobicContact CB-CG2 4.46Å; Y321-I362 HydrophobicContact CD2-CG2 4.07Å; Y321-I362 HydrophobicContact CE2-CB 4.04Å; Y321-I362 HydrophobicContact CE2-CG2 3.58Å; V336-I362 HydrophobicContact CG1-CG2 4.19Å; V336-I362 HydrophobicContact CG2-CG2 4.37Å; I358-I362 HydrophobicContact CG2-CG2 4.26Å; I358-I362 PolarHBondContact O-N 2.92Å; P359-I362 WeakPolarHBondContact O-CG1 3.19Å; I362-F364 PolarHBondContact O-N 3Å; I362-F365 CarbonylContact O-C 3.6Å; I362-F365 PolarHBondContact O-N 3.22Å; I362-F365 VanDerWaalsContact O-N 3.07Å; I362-L366 WeakPolarHBondContact O-CG 3.45Å; I362-L366 PolarHBondContact O-N 3.09Å
363	N	90.3	Very high	89.7	Confident	83 Å²	83	74.9 Å²	74.9	44%	0.444	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-58.4	-29.4	174.7	-67.6	-31.1	0	0	0	113.9	R324 Q360 R361 F365	R324-N363 PolarHBondContact NH1-OD1 3.15Å; R324-N363 PolarHBondContact NH2-OD1 2.93Å; Q360-N363 VanDerWaalsContact O-CB 3.31Å; Q360-N363 WeakPolarHBondContact O-CB 3.47Å; Q360-N363 PolarHBondContact O-N 2.96Å; Q360-N363 PolarHBondContact O-ND2 2.93Å; Q360-N363 VanDerWaalsContact O-ND2 3.12Å; R361-N363 PolarHBondContact O-N 2.83Å; N363-F365 VanDerWaalsContact C-N 3.25Å; N363-F365 PolarHBondContact O-N 3.09Å
364	F	89.2	Confident	89.5	Confident	172 Å²	172	73.6 Å²	73.6	75%	0.754	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-78.2	-13.5	-180	-63.2	-70.4	0	0	0	113.2	R361 I362	R361-F364 WeakPolarHBondContact O-CD2 3.15Å; R361-F364 PolarHBondContact O-N 2.91Å; I362-F364 PolarHBondContact O-N 3Å
365	F	86.9	Confident	89.1	Confident	59 Å²	59	79.2 Å²	79.2	26%	0.259	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-117.8	10	-176.9	-56.7	-90.3	0	0	0	111.5	T332 E335 V336 A339 R361 I362 N363	T332-F365 HydrophobicContact CG2-CB 4.19Å; E335-F365 HydrophobicContact CB-CD1 4.13Å; E335-F365 HydrophobicContact CB-CE1 3.9Å; V336-F365 HydrophobicContact CG2-CB 4.13Å; V336-F365 HydrophobicContact CG2-CD1 4.46Å; V336-F365 HydrophobicContact CG2-CD2 3.58Å; V336-F365 HydrophobicContact CG2-CE2 4.06Å; V336-F365 HydrophobicContact CG2-CG 3.81Å; A339-F365 HydrophobicContact CB-CE2 4.33Å; A339-F365 HydrophobicContact CB-CZ 3.91Å; R361-F365 WeakPolarHBondContact O-CD2 3.49Å; I362-F365 CarbonylContact O-C 3.6Å; I362-F365 PolarHBondContact O-N 3.22Å; I362-F365 VanDerWaalsContact O-N 3.07Å; N363-F365 VanDerWaalsContact C-N 3.25Å; N363-F365 PolarHBondContact O-N 3.09Å
366	L	82.9	Confident	88.5	Confident	56 Å²	56	83.9 Å²	83.9	29%	0.293	43%	0.427	S	S	.	.			trans	-74.8	143.4	168.1	-70.3	-178.1	0	0	0	109.3	Y321 L326 I362	Y321-L366 HydrophobicContact CD1-CD2 4.44Å; Y321-L366 HydrophobicContact CE1-CD2 3.82Å; L326-L366 HydrophobicContact CD1-CD2 3.39Å; I362-L366 WeakPolarHBondContact O-CG 3.45Å; I362-L366 PolarHBondContact O-N 3.09Å
367	P	66.2	Low	88	Confident	195 Å²	195	78.4 Å²	78.4	100%	1.266	41%	0.408	S	S	*	.			trans	-64.2	0	177.8	27.3	-34.7	0	0	0	113.6

Retrieved 367 of 367 residues in 298.2 ms (Link to these results)

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