A0A087Y7G8_POEFO Loading...

Gamma-aminobutyric acid type A receptor subunit alpha5

AlphaFold DB , UniProt , Accession A0A087Y7G8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 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	44.1	Very low	48.2	Very low	255 Å²	255	134.2 Å²	134.2	100%	1.256	80%	0.8	S	S	*	*				0	90.4	0	-80.2	159.2	158.8	0	0	106.9
2	G	44.8	Very low	48.6	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	80%	0.798	S	S	*	*			trans	-136.6	76.3	-167.4	0	0	0	0	0	110
3	D	45.4	Very low	48.9	Very low	172 Å²	172	144 Å²	144	92%	0.92	79%	0.792	S	S	*	*			trans	-128.3	122	166.3	-83.1	-43.5	0	0	0	106.6
4	G	44.6	Very low	49.3	Very low	77 Å²	77	142.6 Å²	142.6	79%	0.794	78%	0.782	S	S	*	*	S	Bend	trans	150	1.5	172.8	0	0	0	0	0	118.6
5	M	49.1	Very low	49.8	Very low	183 Å²	183	138.9 Å²	138.9	90%	0.901	77%	0.769	S	S	*	*	S	Bend	trans	-121.7	12.1	-178.1	-95.5	172.4	72.2	0	0	116.2
6	C	48.1	Very low	50.1	Low	116 Å²	116	139.9 Å²	139.9	78%	0.784	76%	0.763	S	S	*	*	S	Bend	trans	-99.6	-9.9	-179.9	-128.9	0	0	0	0	115.1
7	F	44.5	Very low	50.5	Low	192 Å²	192	136.4 Å²	136.4	84%	0.842	75%	0.75	S	S	*	*	H	α-helix	trans	-88.2	-17	-172.6	-118	-92.3	0	0	0	115.3
8	S	52.7	Low	50.9	Low	97 Å²	97	133.9 Å²	133.9	68%	0.678	74%	0.74	S	S	*	*	H	α-helix	trans	-86.8	-25.5	-174.8	-167.9	0	0	0	0	114
9	V	52.6	Low	51.2	Low	92 Å²	92	132.9 Å²	132.9	56%	0.558	73%	0.732	S	S	*	*	H	α-helix	trans	-83.3	-30.9	-177.8	-178.2	0	0	0	0	112.1	R13	V9-R13 PolarHBondContact O-N 2.96Å
10	A	51.8	Low	51.5	Low	64 Å²	64	131.6 Å²	131.6	53%	0.529	72%	0.724	S	S	.	*	H	α-helix	trans	-68.6	-37.6	179.1	0	0	0	0	0	112.7	R13 L14	A10-R13 PolarHBondContact O-N 3.42Å; A10-L14 PolarHBondContact O-N 3.08Å; A10-L14 VanDerWaalsContact O-N 3.17Å
11	M	52.1	Low	51.8	Low	151 Å²	151	130 Å²	130	74%	0.744	72%	0.717	S	S	*	*	H	α-helix	trans	-71.3	-34	-178.1	-139	179.2	-159.1	0	0	112.7	L14 C15	M11-L14 PolarHBondContact O-N 2.92Å; M11-C15 PolarHBondContact O-N 3.17Å
12	R	53.2	Low	52.3	Low	206 Å²	206	121 Å²	121	78%	0.777	68%	0.68	S	S	*	*	H	α-helix	trans	-69.5	-35.6	174.6	-99.3	-175.8	179.6	-148.4	0.4	113.2	F16	R12-F16 PolarHBondContact O-N 3.26Å
13	R	52.8	Low	52.7	Low	190 Å²	190	122 Å²	122	72%	0.717	67%	0.665	S	S	*	*	H	α-helix	trans	-71.1	-34	176.1	-72.1	-169.2	178.4	-139.4	1.4	112.1	V9 A10 F16 C17	V9-R13 PolarHBondContact O-N 2.96Å; A10-R13 PolarHBondContact O-N 3.42Å; R13-F16 PolarHBondContact O-N 3.15Å; R13-C17 PolarHBondContact O-N 3.43Å; R13-C17 VanDerWaalsContact O-N 3.14Å; R13-C17 PolarHBondContact O-SG 3.33Å
14	L	54.6	Low	53	Low	125 Å²	125	118 Å²	118	65%	0.654	65%	0.647	S	S	*	*	H	α-helix	trans	-67.6	-42.3	176.9	-145	78.8	0	0	0	112.1	A10 M11 F16 C17 V18	A10-L14 PolarHBondContact O-N 3.08Å; A10-L14 VanDerWaalsContact O-N 3.17Å; M11-L14 PolarHBondContact O-N 2.92Å; L14-F16 PolarHBondContact O-N 3.24Å; L14-C17 PolarHBondContact O-N 3.1Å; L14-V18 WeakPolarHBondContact O-CG2 3.47Å; L14-V18 PolarHBondContact O-N 3.3Å; L14-V18 VanDerWaalsContact O-N 3.09Å
15	C	55.8	Low	52.9	Low	86 Å²	86	118.3 Å²	118.3	58%	0.581	64%	0.637	S	S	*	*	H	α-helix	trans	-64.7	-37.2	175.4	-89.2	0	0	0	0	113.3	M11 V18 L19	M11-C15 PolarHBondContact O-N 3.17Å; C15-V18 PolarHBondContact O-N 3.49Å; C15-L19 PolarHBondContact O-N 3.11Å; C15-L19 VanDerWaalsContact O-N 3.12Å
16	F	56.1	Low	52.6	Low	155 Å²	155	119.6 Å²	119.6	68%	0.68	63%	0.632	S	S	*	*	H	α-helix	trans	-67	-38.5	176.3	-105.8	-86.7	0	0	0	112.4	R12 R13 L14 L20	R12-F16 PolarHBondContact O-N 3.26Å; R13-F16 PolarHBondContact O-N 3.15Å; L14-F16 PolarHBondContact O-N 3.24Å; F16-L20 WeakPolarHBondContact O-CB 3.47Å; F16-L20 PolarHBondContact O-N 3.1Å
17	C	55.7	Low	52.3	Low	81 Å²	81	120.6 Å²	120.6	55%	0.547	63%	0.628	S	S	.	*	H	α-helix	trans	-66.5	-38.5	174.9	-73.2	0	0	0	0	112.6	R13 L14 L20 V21	R13-C17 PolarHBondContact O-N 3.43Å; R13-C17 VanDerWaalsContact O-N 3.14Å; R13-C17 PolarHBondContact O-SG 3.33Å; L14-C17 PolarHBondContact O-N 3.1Å; C17-L20 PolarHBondContact O-N 2.96Å; C17-V21 VanDerWaalsContact O-CG2 3.29Å; C17-V21 WeakPolarHBondContact O-CG2 3.45Å; C17-V21 PolarHBondContact O-N 3.13Å
18	V	58.5	Low	52	Low	92 Å²	92	115.5 Å²	115.5	56%	0.558	62%	0.617	S	S	*	*	H	α-helix	trans	-69.3	-34.9	179	175.5	0	0	0	0	111.9	L14 C15 S22	L14-V18 WeakPolarHBondContact O-CG2 3.47Å; L14-V18 PolarHBondContact O-N 3.3Å; L14-V18 VanDerWaalsContact O-N 3.09Å; C15-V18 PolarHBondContact O-N 3.49Å; V18-S22 WeakPolarHBondContact O-CB 3.43Å; V18-S22 PolarHBondContact O-N 3.31Å; V18-S22 VanDerWaalsContact O-N 3.13Å; V18-S22 PolarHBondContact O-OG 3.01Å
19	L	56.8	Low	51.4	Low	114 Å²	114	118.1 Å²	118.1	60%	0.597	62%	0.622	S	S	*	*	H	α-helix	trans	-70.9	-39.8	173.9	-116.2	108.4	0	0	0	112.4	C15 S22 I23	C15-L19 PolarHBondContact O-N 3.11Å; C15-L19 VanDerWaalsContact O-N 3.12Å; L19-S22 PolarHBondContact O-N 3.31Å; L19-I23 HydrophobicContact CD2-CD1 4.34Å; L19-I23 VanDerWaalsContact O-CG1 3.32Å; L19-I23 WeakPolarHBondContact O-CG1 3.22Å; L19-I23 PolarHBondContact O-N 3Å
20	L	56.4	Low	51.2	Low	107 Å²	107	118.2 Å²	118.2	56%	0.56	63%	0.627	S	S	*	*	H	α-helix	trans	-65.1	-41.5	176.8	-98.5	144.8	0	0	0	112.1	F16 C17 S22 I23 T24	F16-L20 WeakPolarHBondContact O-CB 3.47Å; F16-L20 PolarHBondContact O-N 3.1Å; C17-L20 PolarHBondContact O-N 2.96Å; L20-S22 VanDerWaalsContact C-N 3.32Å; L20-S22 PolarHBondContact O-N 3.02Å; L20-I23 PolarHBondContact O-N 3.46Å; L20-T24 WeakPolarHBondContact O-CG2 3.32Å; L20-T24 PolarHBondContact O-N 3.42Å; L20-T24 PolarHBondContact O-OG1 3.05Å; L20-T24 VanDerWaalsContact O-OG1 3.1Å
21	V	57.2	Low	50.5	Low	97 Å²	97	123.4 Å²	123.4	59%	0.588	64%	0.64	S	S	*	*	H	α-helix	trans	-66.1	-35.1	175.3	173.5	0	0	0	0	111.6	C17 T24 C25	C17-V21 VanDerWaalsContact O-CG2 3.29Å; C17-V21 WeakPolarHBondContact O-CG2 3.45Å; C17-V21 PolarHBondContact O-N 3.13Å; V21-T24 WeakPolarHBondContact CA-OG1 3.29Å; V21-T24 PolarHBondContact O-OG1 3.12Å; V21-T24 VanDerWaalsContact O-OG1 3.11Å; V21-C25 WeakPolarHBondContact O-CB 3.36Å; V21-C25 PolarHBondContact O-N 3.49Å
22	S	54.5	Low	49.8	Very low	67 Å²	67	122.6 Å²	122.6	47%	0.469	64%	0.639	S	S	.	*	H	α-helix	trans	-71.8	-30.1	177.4	-59.9	0	0	0	0	112.9	V18 L19 L20 R26	V18-S22 WeakPolarHBondContact O-CB 3.43Å; V18-S22 PolarHBondContact O-N 3.31Å; V18-S22 VanDerWaalsContact O-N 3.13Å; V18-S22 PolarHBondContact O-OG 3.01Å; L19-S22 PolarHBondContact O-N 3.31Å; L20-S22 VanDerWaalsContact C-N 3.32Å; L20-S22 PolarHBondContact O-N 3.02Å; S22-R26 PolarHBondContact O-N 3.43Å
23	I	54.7	Low	49.3	Very low	97 Å²	97	122 Å²	122	50%	0.497	65%	0.65	S	S	.	*	H	α-helix	trans	-80.4	-37.5	176.7	-67.3	166.5	0	0	0	110.9	L19 L20 C25 R26 L27	L19-I23 HydrophobicContact CD2-CD1 4.34Å; L19-I23 VanDerWaalsContact O-CG1 3.32Å; L19-I23 WeakPolarHBondContact O-CG1 3.22Å; L19-I23 PolarHBondContact O-N 3Å; L20-I23 PolarHBondContact O-N 3.46Å; I23-C25 VanDerWaalsContact C-N 3.33Å; I23-C25 PolarHBondContact O-N 3.09Å; I23-R26 PolarHBondContact O-N 3.36Å; I23-L27 HydrophobicContact CG2-CD1 4.22Å; I23-L27 PolarHBondContact O-N 3.14Å; I23-L27 VanDerWaalsContact O-N 3.1Å
24	T	50.2	Low	48.7	Very low	88 Å²	88	116.2 Å²	116.2	54%	0.54	64%	0.643	S	S	.	*	H	α-helix	trans	-68.5	-31.8	173.3	53.2	0	0	0	0	112.4	L20 V21 L27 S28	L20-T24 WeakPolarHBondContact O-CG2 3.32Å; L20-T24 PolarHBondContact O-N 3.42Å; L20-T24 PolarHBondContact O-OG1 3.05Å; L20-T24 VanDerWaalsContact O-OG1 3.1Å; V21-T24 WeakPolarHBondContact CA-OG1 3.29Å; V21-T24 PolarHBondContact O-OG1 3.12Å; V21-T24 VanDerWaalsContact O-OG1 3.11Å; T24-L27 PolarHBondContact O-N 3.48Å; T24-S28 PolarHBondContact O-N 3.47Å; T24-S28 PolarHBondContact O-OG 3.29Å
25	C	43.8	Very low	48	Very low	85 Å²	85	113.5 Å²	113.5	57%	0.574	65%	0.645	S	S	*	*	H	α-helix	trans	-74.4	-24.3	176.1	-157.3	0	0	0	0	113	V21 I23 S28	V21-C25 WeakPolarHBondContact O-CB 3.36Å; V21-C25 PolarHBondContact O-N 3.49Å; I23-C25 VanDerWaalsContact C-N 3.33Å; I23-C25 PolarHBondContact O-N 3.09Å; C25-S28 PolarHBondContact O-OG 3.25Å
26	R	42.7	Very low	47.2	Very low	209 Å²	209	113.5 Å²	113.5	79%	0.789	64%	0.643	S	S	*	*	H	α-helix	trans	-85.5	-19.4	171.6	-74.1	-158.1	-168.6	-121.1	6.8	114.1	S22 I23	S22-R26 PolarHBondContact O-N 3.43Å; I23-R26 PolarHBondContact O-N 3.36Å
27	L	41	Very low	46.8	Very low	137 Å²	137	110.5 Å²	110.5	72%	0.717	64%	0.639	S	S	*	*	H	α-helix	trans	-86.3	-15.7	172.1	-100.5	91	0	0	0	113.9	I23 T24 L29	I23-L27 HydrophobicContact CG2-CD1 4.22Å; I23-L27 PolarHBondContact O-N 3.14Å; I23-L27 VanDerWaalsContact O-N 3.1Å; T24-L27 PolarHBondContact O-N 3.48Å; L27-L29 VanDerWaalsContact C-N 3.27Å
28	S	38.4	Very low	46.5	Very low	86 Å²	86	114.1 Å²	114.1	60%	0.601	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	4.6	170.7	52.7	0	0	0	0	114.2	T24 C25	T24-S28 PolarHBondContact O-N 3.47Å; T24-S28 PolarHBondContact O-OG 3.29Å; C25-S28 PolarHBondContact O-OG 3.25Å
29	L	41.1	Very low	45.9	Very low	151 Å²	151	115.2 Å²	115.2	79%	0.791	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	31.2	-180	-151.1	79.7	0	0	0	112.8	L27	L27-L29 VanDerWaalsContact C-N 3.27Å
30	S	47.5	Very low	45.7	Very low	94 Å²	94	112.2 Å²	112.2	66%	0.657	64%	0.636	S	S	*	*	S	Bend	trans	-147.5	58	176.7	-64.2	0	0	0	0	111.4
31	Q	37.6	Very low	45.6	Very low	173 Å²	173	113 Å²	113	81%	0.808	64%	0.637	S	S	*	*	S	Bend	trans	173.9	112.6	165.9	-100.2	163.8	-3.2	0	0	103.6
32	D	36.3	Very low	45.6	Very low	135 Å²	135	112.3 Å²	112.3	72%	0.722	63%	0.629	S	S	*	*			cis	-145.7	126.4	33.2	-76.8	-49.3	0	0	0	110.6	A34	D32-A34 HydrophobicContact CB-CB 3.99Å; D32-A34 PolarHBondContact O-N 3.17Å; D32-A34 VanDerWaalsContact O-N 3.17Å
33	L	43.7	Very low	45.9	Very low	193 Å²	193	113.2 Å²	113.2	100%	1.01	63%	0.629	S	S	*	*			trans	-81.6	59.8	150.5	-161.2	85.2	0	0	0	107.7
34	A	39.3	Very low	46.4	Very low	69 Å²	69	113.4 Å²	113.4	57%	0.57	63%	0.631	S	S	*	*			trans	-112.4	96.8	164.7	0	0	0	0	0	104.8	D32 T36	D32-A34 HydrophobicContact CB-CB 3.99Å; D32-A34 PolarHBondContact O-N 3.17Å; D32-A34 VanDerWaalsContact O-N 3.17Å; A34-T36 PolarHBondContact O-N 3.49Å
35	G	40.9	Very low	47.4	Very low	67 Å²	67	112.5 Å²	112.5	69%	0.691	62%	0.623	S	S	*	*			trans	-49.2	114.1	162.3	0	0	0	0	0	106.7	P37	G35-P37 WeakPolarHBondContact O-CD 3.36Å; G35-P37 VanDerWaalsContact O-N 3.09Å
36	T	38.3	Very low	49.2	Very low	86 Å²	86	113 Å²	113	53%	0.528	62%	0.619	S	S	.	*			trans	-47.2	121.7	166.8	37.2	0	0	0	0	106.6	A34 K38 Q39	A34-T36 PolarHBondContact O-N 3.49Å; T36-K38 PolarHBondContact O-N 3.21Å; T36-Q39 PolarHBondContact O-N 3.04Å
37	P	48.9	Very low	51.2	Low	93 Å²	93	107.5 Å²	107.5	60%	0.604	61%	0.608	S	S	*	*	H	α-helix	trans	-56.8	-25.5	-173.2	15.8	-27.4	0	0	0	112.1	G35 Q39 E41	G35-P37 WeakPolarHBondContact O-CD 3.36Å; G35-P37 VanDerWaalsContact O-N 3.09Å; P37-Q39 PolarHBondContact O-N 3.42Å; P37-E41 WeakPolarHBondContact O-CB 3.41Å; P37-E41 WeakPolarHBondContact O-CG 3.01Å; P37-E41 PolarHBondContact O-N 3.41Å; P37-E41 VanDerWaalsContact O-N 3.08Å
38	K	48	Very low	53.3	Low	156 Å²	156	103.8 Å²	103.8	68%	0.678	59%	0.589	S	S	*	*	H	α-helix	trans	-60.9	-36.4	172.5	-70.7	-175.4	175.1	-179.1	0	114.5	T36 I42	T36-K38 PolarHBondContact O-N 3.21Å; K38-I42 VanDerWaalsContact O-CB 3.29Å; K38-I42 WeakPolarHBondContact O-CB 3.29Å; K38-I42 WeakPolarHBondContact O-CD1 3.41Å; K38-I42 WeakPolarHBondContact O-CG1 3.45Å; K38-I42 PolarHBondContact O-N 3.23Å; K38-I42 VanDerWaalsContact O-N 3.12Å
39	Q	46.2	Very low	55.5	Low	115 Å²	115	103.2 Å²	103.2	54%	0.537	58%	0.575	S	S	.	*	H	α-helix	trans	-80.1	-32.6	-175.8	-149.6	76.5	22	0	0	112.2	T36 P37 N43	T36-Q39 PolarHBondContact O-N 3.04Å; P37-Q39 PolarHBondContact O-N 3.42Å; Q39-N43 WeakPolarHBondContact O-CB 3.43Å; Q39-N43 VanDerWaalsContact O-CG 3.25Å; Q39-N43 PolarHBondContact O-N 3.04Å; Q39-N43 VanDerWaalsContact O-N 3.17Å; Q39-N43 PolarHBondContact O-ND2 3.12Å
40	A	52.3	Low	57.6	Low	52 Å²	52	99.4 Å²	99.4	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-72.3	-46.1	174.5	0	0	0	0	0	111.2	I42 N43 D44	A40-I42 VanDerWaalsContact C-N 3.32Å; A40-I42 PolarHBondContact O-N 3.44Å; A40-N43 PolarHBondContact O-N 3.37Å; A40-D44 PolarHBondContact O-N 3.17Å
41	E	55.4	Low	59.5	Low	122 Å²	122	103.7 Å²	103.7	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-61.7	-37	175.2	-74.3	178.3	172.5	0	0	112.6	P37 N45	P37-E41 WeakPolarHBondContact O-CB 3.41Å; P37-E41 WeakPolarHBondContact O-CG 3.01Å; P37-E41 PolarHBondContact O-N 3.41Å; P37-E41 VanDerWaalsContact O-N 3.08Å; E41-N45 WeakPolarHBondContact O-CB 3.13Å; E41-N45 PolarHBondContact O-N 2.85Å; E41-N45 PolarHBondContact O-ND2 3.01Å
42	I	57.3	Low	62	Low	83 Å²	83	96.7 Å²	96.7	43%	0.426	53%	0.528	S	S	.	.	H	α-helix	trans	-69	-39.5	176.6	-70.7	166.4	0	0	0	111.7	K38 A40 N45 I46	K38-I42 VanDerWaalsContact O-CB 3.29Å; K38-I42 WeakPolarHBondContact O-CB 3.29Å; K38-I42 WeakPolarHBondContact O-CD1 3.41Å; K38-I42 WeakPolarHBondContact O-CG1 3.45Å; K38-I42 PolarHBondContact O-N 3.23Å; K38-I42 VanDerWaalsContact O-N 3.12Å; A40-I42 VanDerWaalsContact C-N 3.32Å; A40-I42 PolarHBondContact O-N 3.44Å; I42-N45 PolarHBondContact O-N 3.27Å; I42-I46 HydrophobicContact CG2-CD1 4.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.15Å; I42-I46 PolarHBondContact O-N 3Å; I42-I46 VanDerWaalsContact O-N 3.12Å
43	N	60.1	Low	64.4	Low	87 Å²	87	92.7 Å²	92.7	47%	0.465	51%	0.506	S	S	.	.	H	α-helix	trans	-69.3	-38	177.1	-75.9	-10.4	0	0	0	112.2	Q39 A40 N45 I46 T47	Q39-N43 WeakPolarHBondContact O-CB 3.43Å; Q39-N43 VanDerWaalsContact O-CG 3.25Å; Q39-N43 PolarHBondContact O-N 3.04Å; Q39-N43 VanDerWaalsContact O-N 3.17Å; Q39-N43 PolarHBondContact O-ND2 3.12Å; A40-N43 PolarHBondContact O-N 3.37Å; N43-N45 VanDerWaalsContact C-N 3.32Å; N43-I46 PolarHBondContact O-N 3.19Å; N43-T47 PolarHBondContact O-N 3.37Å; N43-T47 VanDerWaalsContact O-N 3.16Å; N43-T47 PolarHBondContact O-OG1 2.95Å
44	D	65.6	Low	66.4	Low	101 Å²	101	89.2 Å²	89.2	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-43.9	172.7	-71.8	-18.4	0	0	0	110.7	A40 I46 T47 I48	A40-D44 PolarHBondContact O-N 3.17Å; D44-I46 PolarHBondContact O-N 2.8Å; D44-T47 PolarHBondContact O-N 2.86Å; D44-I48 WeakPolarHBondContact O-CD1 3.38Å; D44-I48 WeakPolarHBondContact O-CG1 3.49Å; D44-I48 PolarHBondContact O-N 3.45Å
45	N	72.2	Confident	68.8	Low	68 Å²	68	88.2 Å²	88.2	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-57.5	-53.3	176.7	-74	-29.1	0	0	0	111.4	E41 I42 N43 T47 I48 F49	E41-N45 WeakPolarHBondContact O-CB 3.13Å; E41-N45 PolarHBondContact O-N 2.85Å; E41-N45 PolarHBondContact O-ND2 3.01Å; I42-N45 PolarHBondContact O-N 3.27Å; N43-N45 VanDerWaalsContact C-N 3.32Å; N45-T47 VanDerWaalsContact C-N 3.29Å; N45-T47 PolarHBondContact O-N 3.24Å; N45-I48 WeakPolarHBondContact O-CA 3.34Å; N45-I48 WeakPolarHBondContact O-CB 3.3Å; N45-I48 PolarHBondContact O-N 3.32Å; N45-F49 HydrophobicContact CB-CE2 4.2Å; N45-F49 WeakPolarHBondContact O-CD2 3.26Å; N45-F49 PolarHBondContact O-N 3.12Å
46	I	80.4	Confident	71.1	Confident	97 Å²	97	85.6 Å²	85.6	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-56.2	-42.8	180	-65.2	167.9	0	0	0	111.7	I42 N43 D44 I48 F49 T50	I42-I46 HydrophobicContact CG2-CD1 4.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.15Å; I42-I46 PolarHBondContact O-N 3Å; I42-I46 VanDerWaalsContact O-N 3.12Å; N43-I46 PolarHBondContact O-N 3.19Å; D44-I46 PolarHBondContact O-N 2.8Å; I46-I48 VanDerWaalsContact C-N 3.31Å; I46-I48 PolarHBondContact O-N 3.32Å; I46-F49 WeakPolarHBondContact O-CB 3.04Å; I46-F49 PolarHBondContact O-N 3.45Å; I46-T50 PolarHBondContact O-N 3.28Å; I46-T50 VanDerWaalsContact O-N 3.12Å; I46-T50 PolarHBondContact O-OG1 3.03Å
47	T	84.1	Confident	73.5	Confident	93 Å²	93	83.8 Å²	83.8	57%	0.571	44%	0.442	S	S	*	.	H	α-helix	trans	-67.1	-34.6	179.7	-46	0	0	0	0	111.4	N43 D44 N45 R51	N43-T47 PolarHBondContact O-N 3.37Å; N43-T47 VanDerWaalsContact O-N 3.16Å; N43-T47 PolarHBondContact O-OG1 2.95Å; D44-T47 PolarHBondContact O-N 2.86Å; N45-T47 VanDerWaalsContact C-N 3.29Å; N45-T47 PolarHBondContact O-N 3.24Å; T47-R51 WeakPolarHBondContact O-CB 2.95Å; T47-R51 PolarHBondContact O-N 3.16Å
48	I	85	Confident	75.5	Confident	59 Å²	59	86.3 Å²	86.3	30%	0.303	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-42.1	172	-67.6	161.1	0	0	0	111	D44 N45 I46 R51 I52	D44-I48 WeakPolarHBondContact O-CD1 3.38Å; D44-I48 WeakPolarHBondContact O-CG1 3.49Å; D44-I48 PolarHBondContact O-N 3.45Å; N45-I48 WeakPolarHBondContact O-CA 3.34Å; N45-I48 WeakPolarHBondContact O-CB 3.3Å; N45-I48 PolarHBondContact O-N 3.32Å; I46-I48 VanDerWaalsContact C-N 3.31Å; I46-I48 PolarHBondContact O-N 3.32Å; I48-R51 PolarHBondContact O-N 3.5Å; I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 HydrophobicContact CG2-CG1 4.37Å; I48-I52 VanDerWaalsContact O-CG1 3.26Å; I48-I52 WeakPolarHBondContact O-CG1 3.33Å; I48-I52 PolarHBondContact O-N 2.59Å
49	F	84.4	Confident	77.6	Confident	73 Å²	73	82.7 Å²	82.7	32%	0.32	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-48.3	176.3	-72.8	-96.3	0	0	0	111.6	N45 I46 R51 I52 L53 M115 L118	N45-F49 HydrophobicContact CB-CE2 4.2Å; N45-F49 WeakPolarHBondContact O-CD2 3.26Å; N45-F49 PolarHBondContact O-N 3.12Å; I46-F49 WeakPolarHBondContact O-CB 3.04Å; I46-F49 PolarHBondContact O-N 3.45Å; F49-R51 VanDerWaalsContact C-N 3.33Å; F49-R51 PolarHBondContact O-N 3.39Å; F49-I52 PolarHBondContact O-N 3.32Å; F49-L53 WeakPolarHBondContact O-CG 3.45Å; F49-L53 PolarHBondContact O-N 2.93Å; F49-M115 HydrophobicContact CD1-CE 3.2Å; F49-M115 HydrophobicContact CD1-SD 3.38Å; F49-M115 WeakPolarHBondContact CD1-SD 3.42Å; F49-M115 HydrophobicContact CD2-CE 4.41Å; F49-M115 HydrophobicContact CE1-CE 3Å; F49-M115 HydrophobicContact CE1-CG 4.42Å; F49-M115 HydrophobicContact CE1-SD 3.04Å; F49-M115 WeakPolarHBondContact CE1-SD 3.21Å; F49-M115 HydrophobicContact CE2-CE 4.2Å; F49-M115 HydrophobicContact CG-CE 3.93Å; F49-M115 HydrophobicContact CZ-CE 3.49Å; F49-M115 VanDerWaalsContact CZ-CE 3.49Å; F49-M115 HydrophobicContact CZ-SD 3.98Å; F49-L118 HydrophobicContact CD1-CD2 3.98Å; F49-L118 HydrophobicContact CE1-CD2 4.4Å
50	T	86.6	Confident	79.8	Confident	71 Å²	71	78.8 Å²	78.8	44%	0.436	44%	0.438	S	S	.	.	H	α-helix	trans	-61.5	-43.7	179.8	-51	0	0	0	0	110.8	I46 I52 L53 D54	I46-T50 PolarHBondContact O-N 3.28Å; I46-T50 VanDerWaalsContact O-N 3.12Å; I46-T50 PolarHBondContact O-OG1 3.03Å; T50-I52 VanDerWaalsContact C-N 3.32Å; T50-I52 PolarHBondContact O-N 3.14Å; T50-L53 PolarHBondContact O-N 2.91Å; T50-D54 PolarHBondContact O-N 2.8Å
51	R	88.1	Confident	81.8	Confident	185 Å²	185	78.2 Å²	78.2	70%	0.698	43%	0.428	S	S	*	.	H	α-helix	trans	-62.9	-37.6	177	-168	178.8	71.8	168.2	1.7	112.8	T47 I48 F49 G55	T47-R51 WeakPolarHBondContact O-CB 2.95Å; T47-R51 PolarHBondContact O-N 3.16Å; I48-R51 PolarHBondContact O-N 3.5Å; F49-R51 VanDerWaalsContact C-N 3.33Å; F49-R51 PolarHBondContact O-N 3.39Å; R51-G55 PolarHBondContact O-N 2.94Å; R51-G55 VanDerWaalsContact O-N 3.07Å
52	I	88.5	Confident	83.6	Confident	25 Å²	25	75.7 Å²	75.7	13%	0.128	42%	0.419	C	S	.	.	H	α-helix	trans	-65	-46	174.6	-70.3	166.9	0	0	0	110	I48 F49 T50 G55 L56 F111 M115 L118	I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 HydrophobicContact CG2-CG1 4.37Å; I48-I52 VanDerWaalsContact O-CG1 3.26Å; I48-I52 WeakPolarHBondContact O-CG1 3.33Å; I48-I52 PolarHBondContact O-N 2.59Å; F49-I52 PolarHBondContact O-N 3.32Å; T50-I52 VanDerWaalsContact C-N 3.32Å; T50-I52 PolarHBondContact O-N 3.14Å; I52-G55 PolarHBondContact O-N 3.37Å; I52-L56 WeakPolarHBondContact O-CB 3.17Å; I52-L56 PolarHBondContact O-N 3.42Å; I52-F111 HydrophobicContact CG2-CB 3.89Å; I52-F111 HydrophobicContact CG2-CD2 3.94Å; I52-F111 HydrophobicContact CG2-CG 4.05Å; I52-M115 HydrophobicContact CD1-CE 4.26Å; I52-L118 HydrophobicContact CG2-CD1 4.42Å
53	L	86.3	Confident	85.3	Confident	51 Å²	51	80.8 Å²	80.8	27%	0.267	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-43.2	-179.3	-72.7	168.4	0	0	0	112.6	F49 T50 G55 L56 L118 L120 L124	F49-L53 WeakPolarHBondContact O-CG 3.45Å; F49-L53 PolarHBondContact O-N 2.93Å; T50-L53 PolarHBondContact O-N 2.91Å; L53-G55 VanDerWaalsContact C-N 3.35Å; L53-L56 WeakPolarHBondContact O-CB 3.45Å; L53-L56 PolarHBondContact O-N 2.9Å; L53-L118 HydrophobicContact CD2-CD1 4.48Å; L53-L120 HydrophobicContact CD2-CD2 3.54Å; L53-L124 HydrophobicContact CD2-CD2 3.98Å
54	D	86.6	Confident	86.9	Confident	120 Å²	120	80.2 Å²	80.2	64%	0.642	43%	0.429	S	S	*	.	H	α-helix	trans	-66.4	-38.9	177.8	-68.5	-23.1	0	0	0	111.4	T50 L56	T50-D54 PolarHBondContact O-N 2.8Å; D54-L56 VanDerWaalsContact C-N 3.34Å
55	G	88.8	Confident	88.3	Confident	49 Å²	49	76.3 Å²	76.3	51%	0.505	41%	0.407	S	S	.	.	H	α-helix	trans	-72.6	-23.3	175.6	0	0	0	0	0	114.2	R51 I52 L53 L57 D58	R51-G55 PolarHBondContact O-N 2.94Å; R51-G55 VanDerWaalsContact O-N 3.07Å; I52-G55 PolarHBondContact O-N 3.37Å; L53-G55 VanDerWaalsContact C-N 3.35Å; G55-L57 VanDerWaalsContact C-N 3.32Å; G55-L57 PolarHBondContact O-N 3.49Å; G55-D58 PolarHBondContact O-N 3.06Å
56	L	89.3	Confident	89.4	Confident	12 Å²	12	73.3 Å²	73.3	6%	0.063	39%	0.391	C	S	.	.	H	α-helix	trans	-66.3	-33.8	-176.5	-165.8	77.3	0	0	0	112.8	I52 L53 D54 L109 F111 L155	I52-L56 WeakPolarHBondContact O-CB 3.17Å; I52-L56 PolarHBondContact O-N 3.42Å; L53-L56 WeakPolarHBondContact O-CB 3.45Å; L53-L56 PolarHBondContact O-N 2.9Å; D54-L56 VanDerWaalsContact C-N 3.34Å; L56-L109 HydrophobicContact CD1-CB 4.32Å; L56-L109 HydrophobicContact CD1-CD2 4.33Å; L56-L109 WeakPolarHBondContact CD1-O 3.41Å; L56-L109 HydrophobicContact CD2-CD2 3.99Å; L56-L109 HydrophobicContact CG-CD2 3.76Å; L56-F111 HydrophobicContact CD1-CB 4.2Å; L56-L155 HydrophobicContact CD1-CD2 4.15Å; L56-L155 HydrophobicContact CD2-CD2 3.59Å
57	L	89.4	Confident	89.9	Confident	47 Å²	47	69.6 Å²	69.6	25%	0.246	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.3	-178.3	-66.9	-172.3	0	0	0	113.5	G55 G59 Y60 L124 N127 I128	G55-L57 VanDerWaalsContact C-N 3.32Å; G55-L57 PolarHBondContact O-N 3.49Å; L57-G59 PolarHBondContact O-N 2.86Å; L57-Y60 HydrophobicContact CD2-CD1 4.3Å; L57-Y60 HydrophobicContact CD2-CG 4.34Å; L57-Y60 PolarHBondContact O-N 2.79Å; L57-L124 HydrophobicContact CD1-CD1 3.38Å; L57-L124 HydrophobicContact CD1-CG 4.45Å; L57-L124 HydrophobicContact CG-CD1 4.19Å; L57-N127 HydrophobicContact CD1-CB 4.08Å; L57-I128 HydrophobicContact CD2-CG1 4.23Å
58	D	91.9	Very high	90.3	Very high	146 Å²	146	69.7 Å²	69.7	78%	0.781	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	120.9	177.3	-167.3	14.4	0	0	0	110.2	G55 Y60	G55-D58 PolarHBondContact O-N 3.06Å; D58-Y60 PolarHBondContact O-N 3.18Å
59	G	90.4	Very high	90.5	Very high	80 Å²	80	70.7 Å²	70.7	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	8.8	-174.9	0	0	0	0	0	115.9	L57	L57-G59 PolarHBondContact O-N 2.86Å
60	Y	94.3	Very high	90.7	Very high	33 Å²	33	74.5 Å²	74.5	13%	0.129	42%	0.417	C	S	.	.			trans	-80.5	121.1	178.1	-171.1	-90.9	0	0	0	112	L57 D58 N62 D106 R108 L109 W129	L57-Y60 HydrophobicContact CD2-CD1 4.3Å; L57-Y60 HydrophobicContact CD2-CG 4.34Å; L57-Y60 PolarHBondContact O-N 2.79Å; D58-Y60 PolarHBondContact O-N 3.18Å; Y60-N62 HydrophobicContact CD1-CB 4.31Å; Y60-N62 HydrophobicContact CE1-CB 3.88Å; Y60-D106 VanDerWaalsContact CE2-OD2 3.3Å; Y60-D106 WeakPolarHBondContact CE2-OD2 3.39Å; Y60-D106 PolarHBondContact OH-OD2 2.86Å; Y60-R108 HydrophobicContact CD2-CB 3.99Å; Y60-R108 HydrophobicContact CE2-CB 4.07Å; Y60-R108 PolarHBondContact OH-NH2 3.06Å; Y60-L109 HydrophobicContact CD2-CD2 3.79Å; Y60-L109 HydrophobicContact CD2-CG 4.29Å; Y60-L109 HydrophobicContact CE2-CD1 4.11Å; Y60-L109 HydrophobicContact CE2-CD2 3.77Å; Y60-L109 HydrophobicContact CE2-CG 3.83Å; Y60-L109 HydrophobicContact CG-CD2 4.48Å; Y60-W129 WeakPolarHBondContact OH-CB 3.45Å; Y60-W129 PolarHBondContact OH-N 3.49Å
61	D	93.5	Very high	91.1	Very high	41 Å²	41	75.6 Å²	75.6	22%	0.219	42%	0.415	C	S	.	.			trans	-103.2	112.4	170.5	-165.9	-19.2	0	0	0	110.7	R63 L64 R108	D61-R63 VanDerWaalsContact C-N 3.27Å; D61-R63 PolarHBondContact O-N 2.89Å; D61-R63 VanDerWaalsContact OD1-CB 3.28Å; D61-R63 WeakPolarHBondContact OD1-CB 3.29Å; D61-R63 WeakPolarHBondContact OD1-CG 3.11Å; D61-R63 IonicContact OD1-CZ 3.52Å; D61-R63 PolarHBondContact OD1-N 3.38Å; D61-R63 IonicContact OD1-NE 3.49Å; D61-R63 PolarHBondContact OD1-NE 3.18Å; D61-R63 IonicContact OD1-NH2 3.83Å; D61-R63 IonicContact OD2-CZ 3.47Å; D61-R63 IonicContact OD2-NE 3.1Å; D61-R63 PolarHBondContact OD2-NE 3.39Å; D61-R63 IonicContact OD2-NH2 3.51Å; D61-R63 PolarHBondContact OD2-NH2 2.95Å; D61-L64 HydrophobicContact CB-CD1 4.21Å; D61-L64 HydrophobicContact CB-CG 4.34Å; D61-L64 PolarHBondContact O-N 2.93Å; D61-R108 PolarHBondContact O-NH1 3.14Å; D61-R108 VanDerWaalsContact O-NH1 3.16Å
62	N	93.1	Very high	91.4	Very high	69 Å²	69	69.7 Å²	69.7	37%	0.369	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.1	-179.3	68.8	-9.4	0	0	0	114	Y60 L64 N127	Y60-N62 HydrophobicContact CD1-CB 4.31Å; Y60-N62 HydrophobicContact CE1-CB 3.88Å; N62-L64 VanDerWaalsContact C-N 3.3Å; N62-N127 WeakPolarHBondContact CB-O 3.25Å
63	R	93	Very high	91.8	Very high	190 Å²	190	68.9 Å²	68.9	72%	0.717	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.1	176.7	-57.1	172.9	-64.7	173.7	3.8	112	D61	D61-R63 VanDerWaalsContact C-N 3.27Å; D61-R63 PolarHBondContact O-N 2.89Å; D61-R63 VanDerWaalsContact OD1-CB 3.28Å; D61-R63 WeakPolarHBondContact OD1-CB 3.29Å; D61-R63 WeakPolarHBondContact OD1-CG 3.11Å; D61-R63 IonicContact OD1-CZ 3.52Å; D61-R63 PolarHBondContact OD1-N 3.38Å; D61-R63 IonicContact OD1-NE 3.49Å; D61-R63 PolarHBondContact OD1-NE 3.18Å; D61-R63 IonicContact OD1-NH2 3.83Å; D61-R63 IonicContact OD2-CZ 3.47Å; D61-R63 IonicContact OD2-NE 3.1Å; D61-R63 PolarHBondContact OD2-NE 3.39Å; D61-R63 IonicContact OD2-NH2 3.51Å; D61-R63 PolarHBondContact OD2-NH2 2.95Å
64	L	94.2	Very high	92.2	Very high	75 Å²	75	70 Å²	70	39%	0.393	40%	0.4	S	S	.	.	S	Bend	trans	-103.5	131.1	-175.9	-55.3	178.6	0	0	0	110.5	D61 N62 L68 R108	D61-L64 HydrophobicContact CB-CD1 4.21Å; D61-L64 HydrophobicContact CB-CG 4.34Å; D61-L64 PolarHBondContact O-N 2.93Å; N62-L64 VanDerWaalsContact C-N 3.3Å; L64-L68 HydrophobicContact CD2-CD2 3.99Å; L64-R108 PolarHBondContact O-NH1 3.22Å; L64-R108 PolarHBondContact O-NH2 2.86Å
65	R	94.8	Very high	92.7	Very high	18 Å²	18	64.3 Å²	64.3	7%	0.068	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-65.6	150.4	174.1	75	176.4	-179.7	84.3	1.3	111.4	G67 L68 K71 T73 W129 Y196 E200	R65-G67 PolarHBondContact O-N 2.89Å; R65-L68 HydrophobicContact CG-CB 4.39Å; R65-L68 HydrophobicContact CG-CD1 4.32Å; R65-L68 PolarHBondContact O-N 3.45Å; R65-K71 PolarHBondContact NH1-O 2.98Å; R65-T73 PolarHBondContact NH1-OG1 2.75Å; R65-W129 HydrophobicContact CB-CD2 4.4Å; R65-W129 HydrophobicContact CB-CH2 4.35Å; R65-W129 HydrophobicContact CB-CZ2 3.63Å; R65-Y196 HydrophobicContact CB-CE1 4.45Å; R65-E200 IonicContact NE-OE2 3.58Å; R65-E200 PolarHBondContact NE-OE2 3.07Å; R65-E200 VanDerWaalsContact NE-OE2 3.1Å; R65-E200 PolarHBondContact NH1-O 2.97Å; R65-E200 VanDerWaalsContact NH1-O 3.14Å
66	P	95.1	Very high	93.1	Very high	6 Å²	6	66.2 Å²	66.2	4%	0.039	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	132.9	174.4	-17.5	29.4	0	0	0	111.4	T73 D106 W129	P66-T73 PolarHBondContact O-OG1 3.37Å; P66-D106 HydrophobicContact CB-CB 4.13Å; P66-D106 HydrophobicContact CG-CB 3.88Å; P66-W129 VanDerWaalsContact CD-CE3 3.4Å; P66-W129 HydrophobicContact CG-CD2 4.5Å; P66-W129 HydrophobicContact CG-CE3 3.91Å; P66-W129 HydrophobicContact CG-CZ3 4.2Å
67	G	90.9	Very high	93.4	Very high	18 Å²	18	65.7 Å²	65.7	19%	0.186	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	25.3	178.4	0	0	0	0	0	114.6	R65 G69 E70 K71	R65-G67 PolarHBondContact O-N 2.89Å; G67-G69 PolarHBondContact O-N 3.24Å; G67-E70 PolarHBondContact O-N 3.12Å; G67-K71 PolarHBondContact O-N 3.11Å; G67-K71 VanDerWaalsContact O-N 3.11Å; G67-K71 VanDerWaalsContact O-O 3.11Å
68	L	92.1	Very high	93.6	Very high	96 Å²	96	64.5 Å²	64.5	50%	0.503	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	120.8	174.1	-176.1	68.2	0	0	0	110.7	L64 R65 E70	L64-L68 HydrophobicContact CD2-CD2 3.99Å; R65-L68 HydrophobicContact CG-CB 4.39Å; R65-L68 HydrophobicContact CG-CD1 4.32Å; R65-L68 PolarHBondContact O-N 3.45Å; L68-E70 VanDerWaalsContact C-N 3.29Å; L68-E70 PolarHBondContact O-N 3.06Å
69	G	88.5	Confident	93.8	Very high	80 Å²	80	57.6 Å²	57.6	83%	0.825	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-3.8	-177.8	0	0	0	0	0	115.3	G67	G67-G69 PolarHBondContact O-N 3.24Å
70	E	90.4	Very high	94	Very high	152 Å²	152	56.8 Å²	56.8	71%	0.71	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-64.1	-178	-62.9	178.8	172.7	0	0	111.9	G67 L68	G67-E70 PolarHBondContact O-N 3.12Å; L68-E70 VanDerWaalsContact C-N 3.29Å; L68-E70 PolarHBondContact O-N 3.06Å
71	K	93.6	Very high	94	Very high	95 Å²	95	55.2 Å²	55.2	41%	0.413	29%	0.285	S	S	.	.			trans	-139.8	157.6	-172.2	63.5	-176.1	172.3	-166	0	112.3	R65 G67 E107	R65-K71 PolarHBondContact NH1-O 2.98Å; G67-K71 PolarHBondContact O-N 3.11Å; G67-K71 VanDerWaalsContact O-N 3.11Å; G67-K71 VanDerWaalsContact O-O 3.11Å; K71-E107 IonicContact NZ-OE1 2.59Å; K71-E107 PolarHBondContact NZ-OE1 3.5Å; K71-E107 IonicContact NZ-OE2 3.85Å
72	V	95.2	Very high	94	Very high	61 Å²	61	54.8 Å²	54.8	37%	0.37	28%	0.284	S	S	.	.			trans	-71.2	133.9	171.9	-172.1	0	0	0	0	108.7	E74 E200 I202	V72-E74 PolarHBondContact O-N 2.86Å; V72-E200 WeakPolarHBondContact CG1-O 3.49Å; V72-I202 HydrophobicContact CG1-CB 4.3Å; V72-I202 HydrophobicContact CG1-CD1 3.75Å; V72-I202 HydrophobicContact CG1-CG1 3.69Å
73	T	96.1	Very high	94	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.043	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	111.5	178.3	-46.1	0	0	0	0	108.9	R65 P66 W129 E200 V201 I202	R65-T73 PolarHBondContact NH1-OG1 2.75Å; P66-T73 PolarHBondContact O-OG1 3.37Å; T73-W129 HydrophobicContact CG2-CH2 4.21Å; T73-W129 HydrophobicContact CG2-CZ3 4.25Å; T73-E200 PolarHBondContact N-O 2.99Å; T73-V201 WeakPolarHBondContact O-CA 3.46Å; T73-I202 PolarHBondContact O-N 3.1Å
74	E	95.8	Very high	93.9	Very high	76 Å²	76	44.7 Å²	44.7	36%	0.355	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.3	175.5	-174.2	178.3	135	0	0	110.6	V72 K76 I202 K204	V72-E74 PolarHBondContact O-N 2.86Å; E74-K76 WeakPolarHBondContact OE1-CE 3.32Å; E74-I202 WeakPolarHBondContact CA-O 3.1Å; E74-K204 HydrophobicContact CG-CD 4.07Å; E74-K204 HydrophobicContact CG-CG 4.33Å; E74-K204 IonicContact OE1-NZ 3.88Å; E74-K204 IonicContact OE2-NZ 3.84Å; E74-K204 PolarHBondContact OE2-NZ 2.87Å
75	I	96.9	Very high	93.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	112.9	177.2	-54.4	167.5	0	0	0	108.8	T77 Q102 W104 P131 V201 I202 Y203 K204	I75-T77 HydrophobicContact CG2-CG2 4.08Å; I75-Q102 HydrophobicContact CG2-CB 4.21Å; I75-W104 HydrophobicContact CG1-CB 4.31Å; I75-P131 HydrophobicContact CD1-CB 3.31Å; I75-P131 HydrophobicContact CD1-CG 3.87Å; I75-P131 HydrophobicContact CG1-CB 4.44Å; I75-P131 HydrophobicContact CG2-CG 4.45Å; I75-V201 HydrophobicContact CD1-CG1 3.26Å; I75-V201 HydrophobicContact CG1-CG1 4.02Å; I75-I202 PolarHBondContact N-O 3.29Å; I75-Y203 HydrophobicContact CB-CD1 4.05Å; I75-Y203 HydrophobicContact CB-CE1 4.14Å; I75-Y203 HydrophobicContact CD1-CD1 4.47Å; I75-Y203 HydrophobicContact CD1-CE1 3.87Å; I75-Y203 HydrophobicContact CD1-CE2 4.23Å; I75-Y203 HydrophobicContact CG2-CD1 4.06Å; I75-Y203 HydrophobicContact CG2-CE1 3.93Å; I75-Y203 CarbonylContact O-C 3.52Å; I75-Y203 WeakPolarHBondContact O-CA 3.39Å; I75-K204 PolarHBondContact O-N 3.44Å
76	K	96.3	Very high	93.6	Very high	89 Å²	89	45.8 Å²	45.8	39%	0.387	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	130.6	173.3	-62.8	-174.6	-179.4	-175.8	0	110.1	E74 Q102 S103 K204 T206	E74-K76 WeakPolarHBondContact OE1-CE 3.32Å; K76-Q102 CarbonylContact O-C 3.56Å; K76-Q102 WeakPolarHBondContact O-CA 3.45Å; K76-S103 PolarHBondContact N-O 3.46Å; K76-S103 PolarHBondContact O-N 3.3Å; K76-K204 CarbonylContact C-O 3.55Å; K76-K204 WeakPolarHBondContact CA-O 3.18Å; K76-T206 HydrophobicContact CB-CG2 4.38Å
77	T	96.1	Very high	93.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.2	-174.4	55.1	0	0	0	0	111.8	I75 F100 R101 Q102 F191 Y203 K204 T206	I75-T77 HydrophobicContact CG2-CG2 4.08Å; T77-F100 HydrophobicContact CG2-CZ 4.38Å; T77-R101 WeakPolarHBondContact CA-O 3.48Å; T77-Q102 HydrophobicContact CG2-CG 4.34Å; T77-F191 HydrophobicContact CG2-CE2 4.1Å; T77-Y203 HydrophobicContact CG2-CD1 3.65Å; T77-Y203 HydrophobicContact CG2-CE1 4.18Å; T77-K204 PolarHBondContact N-O 2.59Å; T77-K204 PolarHBondContact OG1-O 3.37Å; T77-T206 PolarHBondContact N-OG1 2.88Å; T77-T206 PolarHBondContact O-N 2.84Å; T77-T206 PolarHBondContact O-OG1 2.88Å; T77-T206 VanDerWaalsContact O-OG1 3.09Å
78	N	94.7	Very high	93.6	Very high	22 Å²	22	46.6 Å²	46.6	12%	0.118	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	136.7	179	175.3	-103	0	0	0	108.9	R101 S212	N78-R101 HydrophobicContact CB-CB 4.16Å; N78-R101 PolarHBondContact N-O 3.07Å; N78-R101 WeakPolarHBondContact O-CB 3.49Å; N78-R101 PolarHBondContact O-N 3.39Å; N78-R101 PolarHBondContact OD1-NH1 2.99Å; N78-S212 PolarHBondContact ND2-O 2.53Å
79	I	95.3	Very high	93.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.5	-178.4	-60.5	-176.6	0	0	0	108.3	V81 V98 F100 L189 F191 W205 S212 V213 V214	I79-V81 HydrophobicContact CG2-CG2 4.07Å; I79-V98 HydrophobicContact CG2-CB 4.07Å; I79-V98 HydrophobicContact CG2-CG1 3.93Å; I79-F100 HydrophobicContact CD1-CD2 4.18Å; I79-F100 HydrophobicContact CD1-CE2 4.15Å; I79-F100 HydrophobicContact CG1-CD2 3.9Å; I79-F100 HydrophobicContact CG1-CE2 4.1Å; I79-L189 HydrophobicContact CD1-CD2 4.26Å; I79-F191 HydrophobicContact CD1-CD1 4.32Å; I79-F191 HydrophobicContact CD1-CE1 3.51Å; I79-F191 HydrophobicContact CD1-CZ 3.94Å; I79-W205 HydrophobicContact CD1-CH2 4.13Å; I79-W205 HydrophobicContact CD1-CZ3 4.25Å; I79-W205 HydrophobicContact CG1-CZ3 4.18Å; I79-S212 PolarHBondContact N-O 2.72Å; I79-V213 HydrophobicContact CB-CG2 4.44Å; I79-V213 WeakPolarHBondContact O-CA 3.42Å; I79-V214 PolarHBondContact O-N 2.9Å; I79-V214 VanDerWaalsContact O-N 3.07Å
80	F	94.4	Very high	93.6	Very high	63 Å²	63	43.4 Å²	43.4	28%	0.276	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	112.3	167.5	-177.8	-90.7	0	0	0	109.1	T82 V98 F99 V214 A216	F80-T82 HydrophobicContact CD1-CG2 4.03Å; F80-T82 HydrophobicContact CE1-CG2 4.05Å; F80-T82 PolarHBondContact O-N 2.77Å; F80-V98 CarbonylContact O-C 3.55Å; F80-V98 WeakPolarHBondContact O-CA 3.3Å; F80-F99 HydrophobicContact CB-CB 4.32Å; F80-F99 AromaticContact CD1-CD2 3.98Å; F80-F99 HydrophobicContact CD1-CD2 3.98Å; F80-F99 PolarHBondContact N-O 2.86Å; F80-F99 PolarHBondContact O-N 3.29Å; F80-V214 WeakPolarHBondContact CA-O 3.33Å; F80-V214 HydrophobicContact CD2-CB 4.1Å; F80-V214 HydrophobicContact CD2-CG1 4.18Å; F80-V214 HydrophobicContact CE2-CG1 4.12Å; F80-A216 HydrophobicContact CE1-CB 4.36Å; F80-A216 HydrophobicContact CZ-CB 4.02Å
81	V	94.8	Very high	93.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.7	178.5	-177.1	0	0	0	0	108.5	I79 I96 V98 V214 V215 A216 F251	I79-V81 HydrophobicContact CG2-CG2 4.07Å; V81-I96 HydrophobicContact CB-CD1 4.39Å; V81-I96 HydrophobicContact CG1-CD1 3.72Å; V81-I96 HydrophobicContact CG1-CG1 3.65Å; V81-I96 HydrophobicContact CG2-CD1 3.77Å; V81-I96 HydrophobicContact CG2-CG1 4.48Å; V81-V98 HydrophobicContact CG2-CG1 4.09Å; V81-V214 PolarHBondContact N-O 3.32Å; V81-V215 HydrophobicContact CB-CB 4.37Å; V81-V215 HydrophobicContact CB-CG1 4.28Å; V81-V215 HydrophobicContact CB-CG2 4.08Å; V81-V215 HydrophobicContact CG1-CG1 4.28Å; V81-V215 HydrophobicContact CG2-CG2 4.13Å; V81-A216 WeakPolarHBondContact O-CB 3.27Å; V81-A216 PolarHBondContact O-N 3.02Å; V81-F251 HydrophobicContact CG2-CE1 4.11Å; V81-F251 HydrophobicContact CG2-CZ 4.04Å
82	T	92.9	Very high	93.5	Very high	32 Å²	32	39.8 Å²	39.8	20%	0.196	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-42.3	177.7	54.6	0	0	0	0	111.3	F80 D97 F99 G219	F80-T82 HydrophobicContact CD1-CG2 4.03Å; F80-T82 HydrophobicContact CE1-CG2 4.05Å; F80-T82 PolarHBondContact O-N 2.77Å; T82-D97 PolarHBondContact N-O 2.91Å; T82-D97 VanDerWaalsContact OG1-CB 3.22Å; T82-D97 WeakPolarHBondContact OG1-CB 3.36Å; T82-D97 PolarHBondContact OG1-O 2.8Å; T82-D97 VanDerWaalsContact OG1-O 3.14Å; T82-F99 HydrophobicContact CG2-CD2 3.37Å; T82-F99 HydrophobicContact CG2-CE2 3.33Å; T82-F99 HydrophobicContact CG2-CG 4.47Å; T82-F99 HydrophobicContact CG2-CZ 4.4Å; T82-G219 WeakPolarHBondContact O-CA 3.29Å
83	S	92.4	Very high	93.5	Very high	37 Å²	37	38.5 Å²	38.5	26%	0.259	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	136.1	-178.2	32.1	0	0	0	0	109.5	D97	S83-D97 PolarHBondContact O-N 2.8Å; S83-D97 WeakPolarHBondContact OG-CB 3.12Å; S83-D97 PolarHBondContact OG-OD2 3.22Å
84	F	92.5	Very high	93.5	Very high	10 Å²	10	38.2 Å²	38.2	4%	0.044	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119	165.3	-151.4	-79.6	0	0	0	107.8	V87 Y94 I96 G219 L222 F251 L253	F84-V87 HydrophobicContact CE1-CG2 3.84Å; F84-Y94 AromaticContact CE1-CD2 3.79Å; F84-Y94 HydrophobicContact CE1-CD2 3.79Å; F84-Y94 HydrophobicContact CE1-CG 4.28Å; F84-Y94 AromaticContact CE2-CD2 3.98Å; F84-Y94 HydrophobicContact CE2-CD2 3.98Å; F84-Y94 HydrophobicContact CE2-CE2 4.11Å; F84-Y94 AromaticContact CZ-CD2 3.3Å; F84-Y94 HydrophobicContact CZ-CD2 3.3Å; F84-Y94 AromaticContact CZ-CE2 3.8Å; F84-Y94 HydrophobicContact CZ-CE2 3.8Å; F84-Y94 HydrophobicContact CZ-CG 4.01Å; F84-I96 HydrophobicContact CD2-CD1 4.02Å; F84-I96 HydrophobicContact CD2-CG1 4.19Å; F84-I96 HydrophobicContact CE2-CD1 4.08Å; F84-G219 PolarHBondContact N-O 3.24Å; F84-L222 HydrophobicContact CB-CD1 4.45Å; F84-L222 HydrophobicContact CB-CD2 4.28Å; F84-L222 HydrophobicContact CB-CG 4.47Å; F84-L222 HydrophobicContact CD1-CD1 3.62Å; F84-L222 HydrophobicContact CD1-CD2 3.77Å; F84-L222 HydrophobicContact CD1-CG 4.19Å; F84-L222 HydrophobicContact CE1-CD1 4.14Å; F84-L222 HydrophobicContact CG-CD1 4.23Å; F84-L222 HydrophobicContact CG-CD2 4.48Å; F84-L222 WeakPolarHBondContact O-CD2 3.4Å; F84-F251 HydrophobicContact CE2-CB 3.89Å; F84-F251 HydrophobicContact CE2-CD1 4.08Å; F84-F251 HydrophobicContact CE2-CD2 4.05Å; F84-F251 AromaticContact CE2-CG 3.73Å; F84-F251 HydrophobicContact CE2-CG 3.73Å; F84-F251 HydrophobicContact CZ-CB 4.31Å; F84-L253 HydrophobicContact CE1-CD1 4.08Å; F84-L253 HydrophobicContact CE1-CD2 4.22Å; F84-L253 HydrophobicContact CZ-CD1 4.06Å; F84-L253 HydrophobicContact CZ-CD2 4.2Å
85	G	90.3	Very high	93.4	Very high	14 Å²	14	36 Å²	36	14%	0.144	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-176.6	-178.2	0	0	0	0	0	112.7	T95 L222	G85-T95 VanDerWaalsContact C-OG1 3.25Å; G85-T95 VanDerWaalsContact CA-O 3.26Å; G85-T95 WeakPolarHBondContact CA-O 3.5Å; G85-T95 VanDerWaalsContact CA-OG1 3.27Å; G85-T95 WeakPolarHBondContact CA-OG1 3.33Å; G85-T95 PolarHBondContact N-O 3.13Å; G85-L222 WeakPolarHBondContact O-CD2 3.02Å
86	P	91.8	Very high	93.3	Very high	103 Å²	103	36 Å²	36	67%	0.669	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	146.3	177.9	25.1	-35.8	0	0	0	112.7	T95	P86-T95 WeakPolarHBondContact CD-OG1 3.41Å; P86-T95 VanDerWaalsContact N-OG1 3.15Å; P86-T95 PolarHBondContact O-N 3.23Å; P86-T95 VanDerWaalsContact O-N 3.16Å; P86-T95 PolarHBondContact O-OG1 2.91Å
87	V	93.5	Very high	93.2	Very high	12 Å²	12	33.3 Å²	33.3	7%	0.073	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.3	172.1	-178.7	0	0	0	0	107.5	F84 M175 Y225 L253	F84-V87 HydrophobicContact CE1-CG2 3.84Å; V87-M175 HydrophobicContact CG1-CE 3.38Å; V87-Y225 HydrophobicContact CB-CD2 3.98Å; V87-Y225 HydrophobicContact CB-CE2 3.88Å; V87-Y225 HydrophobicContact CG1-CD2 4.28Å; V87-Y225 HydrophobicContact CG1-CE2 3.76Å; V87-Y225 HydrophobicContact CG2-CD2 4.18Å; V87-Y225 HydrophobicContact CG2-CE2 4.48Å; V87-L253 HydrophobicContact CG2-CD1 3.89Å
88	S	92.3	Very high	93.2	Very high	29 Å²	29	33.3 Å²	33.3	20%	0.203	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	105.8	179.9	-177.3	0	0	0	0	109.6	T90 E91 M92 E93	S88-T90 VanDerWaalsContact C-N 3.27Å; S88-T90 PolarHBondContact O-N 3.3Å; S88-T90 PolarHBondContact OG-OG1 3.01Å; S88-E91 PolarHBondContact OG-N 2.98Å; S88-M92 WeakPolarHBondContact O-CA 3.45Å; S88-M92 PolarHBondContact O-N 3.33Å; S88-E93 PolarHBondContact N-O 3.26Å; S88-E93 PolarHBondContact O-N 3.09Å
89	D	90.8	Very high	93.2	Very high	15 Å²	15	35.4 Å²	35.4	8%	0.08	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-34.5	174.5	-68.6	-37.9	0	0	0	111.5	Y225 R255 P312	D89-Y225 PolarHBondContact OD1-OH 3.28Å; D89-R255 VanDerWaalsContact CG-NH1 3.31Å; D89-R255 IonicContact OD1-CZ 3.45Å; D89-R255 IonicContact OD1-NH1 3.3Å; D89-R255 PolarHBondContact OD1-NH1 2.82Å; D89-R255 VanDerWaalsContact OD1-NH1 3.15Å; D89-R255 IonicContact OD1-NH2 3.82Å; D89-R255 PolarHBondContact OD1-NH2 3.29Å; D89-R255 IonicContact OD2-CZ 3.32Å; D89-R255 IonicContact OD2-NH1 3.73Å; D89-R255 PolarHBondContact OD2-NH1 3.43Å; D89-R255 IonicContact OD2-NH2 3.21Å; D89-R255 PolarHBondContact OD2-NH2 3.45Å; D89-P312 WeakPolarHBondContact O-CB 3.26Å; D89-P312 WeakPolarHBondContact O-CG 3.34Å
90	T	89.1	Confident	93.3	Very high	93 Å²	93	35.6 Å²	35.6	57%	0.571	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-37.5	-175.9	48.4	0	0	0	0	113.2	S88	S88-T90 VanDerWaalsContact C-N 3.27Å; S88-T90 PolarHBondContact O-N 3.3Å; S88-T90 PolarHBondContact OG-OG1 3.01Å
91	E	90.8	Very high	93.4	Very high	113 Å²	113	37 Å²	37	53%	0.528	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-0.7	-178.4	-65.9	177.9	159.4	0	0	112.5	S88 E93 K139	S88-E91 PolarHBondContact OG-N 2.98Å; E91-E93 VanDerWaalsContact C-N 3.27Å; E91-E93 HydrophobicContact CB-CG 3.86Å; E91-E93 PolarHBondContact O-N 3.4Å; E91-K139 PolarHBondContact O-NZ 2.95Å
92	M	92.5	Very high	93.5	Very high	58 Å²	58	37.1 Å²	37.1	29%	0.286	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	48.4	-176.6	-64.3	-177.6	171.9	0	0	111.6	S88 C173	S88-M92 WeakPolarHBondContact O-CA 3.45Å; S88-M92 PolarHBondContact O-N 3.33Å; M92-C173 PolarHBondContact O-N 3.35Å
93	E	94.7	Very high	93.6	Very high	35 Å²	35	36.8 Å²	36.8	16%	0.164	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159	-179.5	67.8	174.8	-128.6	0	0	111.8	S88 E91 K139 A171	S88-E93 PolarHBondContact N-O 3.26Å; S88-E93 PolarHBondContact O-N 3.09Å; E91-E93 VanDerWaalsContact C-N 3.27Å; E91-E93 HydrophobicContact CB-CG 3.86Å; E91-E93 PolarHBondContact O-N 3.4Å; E93-K139 HydrophobicContact CB-CD 4.47Å; E93-K139 VanDerWaalsContact OE2-CD 3.22Å; E93-K139 WeakPolarHBondContact OE2-CD 3.44Å; E93-K139 IonicContact OE2-NZ 3.23Å; E93-A171 VanDerWaalsContact CA-O 3.27Å; E93-A171 WeakPolarHBondContact CA-O 3.44Å; E93-A171 WeakPolarHBondContact CB-O 3.13Å
94	Y	95	Very high	93.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	153.2	172.8	69	-77.8	0	0	0	109.6	F84 I96 S170 A171 C173 C187 P188 L189 F251	F84-Y94 AromaticContact CE1-CD2 3.79Å; F84-Y94 HydrophobicContact CE1-CD2 3.79Å; F84-Y94 HydrophobicContact CE1-CG 4.28Å; F84-Y94 AromaticContact CE2-CD2 3.98Å; F84-Y94 HydrophobicContact CE2-CD2 3.98Å; F84-Y94 HydrophobicContact CE2-CE2 4.11Å; F84-Y94 AromaticContact CZ-CD2 3.3Å; F84-Y94 HydrophobicContact CZ-CD2 3.3Å; F84-Y94 AromaticContact CZ-CE2 3.8Å; F84-Y94 HydrophobicContact CZ-CE2 3.8Å; F84-Y94 HydrophobicContact CZ-CG 4.01Å; Y94-I96 HydrophobicContact CD2-CB 4.37Å; Y94-I96 HydrophobicContact CE2-CB 4.22Å; Y94-I96 HydrophobicContact CE2-CG2 4.16Å; Y94-S170 WeakPolarHBondContact O-CA 3.48Å; Y94-A171 HydrophobicContact CD1-CB 4.36Å; Y94-A171 VanDerWaalsContact CD1-O 3.3Å; Y94-A171 WeakPolarHBondContact CD1-O 3.33Å; Y94-A171 HydrophobicContact CE1-CB 3.67Å; Y94-A171 HydrophobicContact CE2-CB 4.4Å; Y94-A171 PolarHBondContact N-O 2.83Å; Y94-A171 PolarHBondContact O-N 2.78Å; Y94-C173 HydrophobicContact CD1-CB 3.61Å; Y94-C173 HydrophobicContact CE1-CB 3.94Å; Y94-C187 HydrophobicContact CD1-CB 3.91Å; Y94-C187 HydrophobicContact CE1-CB 3.67Å; Y94-P188 VanDerWaalsContact OH-C 3.24Å; Y94-P188 PolarHBondContact OH-O 3.2Å; Y94-L189 WeakPolarHBondContact OH-CB 3.38Å; Y94-F251 HydrophobicContact CE2-CD2 4.37Å
95	T	94.6	Very high	94	Very high	30 Å²	30	39.5 Å²	39.5	18%	0.184	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.7	177.1	49.2	0	0	0	0	109.9	G85 P86 I169 S170	G85-T95 VanDerWaalsContact C-OG1 3.25Å; G85-T95 VanDerWaalsContact CA-O 3.26Å; G85-T95 WeakPolarHBondContact CA-O 3.5Å; G85-T95 VanDerWaalsContact CA-OG1 3.27Å; G85-T95 WeakPolarHBondContact CA-OG1 3.33Å; G85-T95 PolarHBondContact N-O 3.13Å; P86-T95 WeakPolarHBondContact CD-OG1 3.41Å; P86-T95 VanDerWaalsContact N-OG1 3.15Å; P86-T95 PolarHBondContact O-N 3.23Å; P86-T95 VanDerWaalsContact O-N 3.16Å; P86-T95 PolarHBondContact O-OG1 2.91Å; T95-I169 CarbonylContact C-O 3.56Å; T95-I169 WeakPolarHBondContact CA-O 3.46Å; T95-S170 WeakPolarHBondContact CG2-OG 3.34Å
96	I	95	Very high	94.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133.8	179	-166.8	174.9	0	0	0	110.3	V81 F84 Y94 V98 T168 I169 F251	V81-I96 HydrophobicContact CB-CD1 4.39Å; V81-I96 HydrophobicContact CG1-CD1 3.72Å; V81-I96 HydrophobicContact CG1-CG1 3.65Å; V81-I96 HydrophobicContact CG2-CD1 3.77Å; V81-I96 HydrophobicContact CG2-CG1 4.48Å; F84-I96 HydrophobicContact CD2-CD1 4.02Å; F84-I96 HydrophobicContact CD2-CG1 4.19Å; F84-I96 HydrophobicContact CE2-CD1 4.08Å; Y94-I96 HydrophobicContact CD2-CB 4.37Å; Y94-I96 HydrophobicContact CE2-CB 4.22Å; Y94-I96 HydrophobicContact CE2-CG2 4.16Å; I96-V98 HydrophobicContact CD1-CG1 3.94Å; I96-V98 HydrophobicContact CG1-CG1 3.79Å; I96-V98 HydrophobicContact CG2-CG1 4.28Å; I96-T168 WeakPolarHBondContact O-CA 3.4Å; I96-I169 HydrophobicContact CG2-CB 3.94Å; I96-I169 PolarHBondContact N-O 2.7Å; I96-I169 PolarHBondContact O-N 2.76Å; I96-F251 HydrophobicContact CD1-CD2 4.45Å; I96-F251 HydrophobicContact CD1-CE1 4.2Å; I96-F251 HydrophobicContact CD1-CE2 3.69Å; I96-F251 HydrophobicContact CD1-CZ 3.54Å
97	D	94.6	Very high	94.3	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.171	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.7	173.6	-63.3	-38.8	0	0	0	109.4	T82 S83 L167 T168	T82-D97 PolarHBondContact N-O 2.91Å; T82-D97 VanDerWaalsContact OG1-CB 3.22Å; T82-D97 WeakPolarHBondContact OG1-CB 3.36Å; T82-D97 PolarHBondContact OG1-O 2.8Å; T82-D97 VanDerWaalsContact OG1-O 3.14Å; S83-D97 PolarHBondContact O-N 2.8Å; S83-D97 WeakPolarHBondContact OG-CB 3.12Å; S83-D97 PolarHBondContact OG-OD2 3.22Å; D97-L167 WeakPolarHBondContact CA-O 3.39Å; D97-T168 VanDerWaalsContact OD1-CB 3.28Å; D97-T168 WeakPolarHBondContact OD1-CB 3.4Å; D97-T168 VanDerWaalsContact OD1-CG2 3.27Å; D97-T168 WeakPolarHBondContact OD1-CG2 3.35Å; D97-T168 PolarHBondContact OD1-OG1 2.89Å
98	V	95.4	Very high	94.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.3	-174.3	-56.2	0	0	0	0	111.8	I79 F80 V81 I96 F100 R166 L167 I169	I79-V98 HydrophobicContact CG2-CB 4.07Å; I79-V98 HydrophobicContact CG2-CG1 3.93Å; F80-V98 CarbonylContact O-C 3.55Å; F80-V98 WeakPolarHBondContact O-CA 3.3Å; V81-V98 HydrophobicContact CG2-CG1 4.09Å; I96-V98 HydrophobicContact CD1-CG1 3.94Å; I96-V98 HydrophobicContact CG1-CG1 3.79Å; I96-V98 HydrophobicContact CG2-CG1 4.28Å; V98-F100 HydrophobicContact CG2-CB 4.34Å; V98-R166 WeakPolarHBondContact O-CA 3.25Å; V98-L167 HydrophobicContact CG2-CB 4.06Å; V98-L167 PolarHBondContact N-O 3.25Å; V98-L167 PolarHBondContact O-N 3.3Å; V98-I169 HydrophobicContact CG2-CD1 3.66Å
99	F	95.7	Very high	94.4	Very high	66 Å²	66	41.2 Å²	41.2	29%	0.289	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	106.8	152.1	-71.8	-69.1	0	0	0	108	F80 T82 T164 M165 R166	F80-F99 HydrophobicContact CB-CB 4.32Å; F80-F99 AromaticContact CD1-CD2 3.98Å; F80-F99 HydrophobicContact CD1-CD2 3.98Å; F80-F99 PolarHBondContact N-O 2.86Å; F80-F99 PolarHBondContact O-N 3.29Å; T82-F99 HydrophobicContact CG2-CD2 3.37Å; T82-F99 HydrophobicContact CG2-CE2 3.33Å; T82-F99 HydrophobicContact CG2-CG 4.47Å; T82-F99 HydrophobicContact CG2-CZ 4.4Å; F99-T164 HydrophobicContact CB-CG2 4.36Å; F99-T164 HydrophobicContact CD1-CG2 4.26Å; F99-M165 CarbonylContact C-O 3.53Å; F99-M165 WeakPolarHBondContact CA-O 3.4Å; F99-R166 HydrophobicContact CD1-CB 3.91Å; F99-R166 HydrophobicContact CD1-CG 4.23Å; F99-R166 HydrophobicContact CE1-CB 3.72Å; F99-R166 HydrophobicContact CE1-CG 3.92Å; F99-R166 HydrophobicContact CZ-CG 4.39Å
100	F	96.6	Very high	94.5	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.3	176.4	-170.5	-111.2	0	0	0	108.9	T77 I79 V98 Q102 T133 F135 T164 M165 L167 F191	T77-F100 HydrophobicContact CG2-CZ 4.38Å; I79-F100 HydrophobicContact CD1-CD2 4.18Å; I79-F100 HydrophobicContact CD1-CE2 4.15Å; I79-F100 HydrophobicContact CG1-CD2 3.9Å; I79-F100 HydrophobicContact CG1-CE2 4.1Å; V98-F100 HydrophobicContact CG2-CB 4.34Å; F100-Q102 HydrophobicContact CD1-CG 3.89Å; F100-Q102 HydrophobicContact CE1-CG 3.48Å; F100-Q102 VanDerWaalsContact CE1-CG 3.48Å; F100-Q102 HydrophobicContact CZ-CG 4.15Å; F100-T133 HydrophobicContact CE1-CG2 3.9Å; F100-T133 HydrophobicContact CZ-CG2 3.78Å; F100-F135 HydrophobicContact CD2-CZ 4.35Å; F100-F135 HydrophobicContact CE2-CZ 4.5Å; F100-T164 WeakPolarHBondContact O-CA 3.48Å; F100-M165 HydrophobicContact CB-CG 3.94Å; F100-M165 HydrophobicContact CD1-CG 4.32Å; F100-M165 HydrophobicContact CD1-SD 4.38Å; F100-M165 PolarHBondContact N-O 2.79Å; F100-M165 PolarHBondContact O-N 3.38Å; F100-L167 HydrophobicContact CB-CD1 4.12Å; F100-F191 AromaticContact CE2-CD2 3.94Å; F100-F191 HydrophobicContact CE2-CD2 3.94Å; F100-F191 HydrophobicContact CE2-CE1 4.33Å; F100-F191 AromaticContact CE2-CE2 3.69Å; F100-F191 HydrophobicContact CE2-CE2 3.69Å; F100-F191 HydrophobicContact CE2-CG 4.34Å; F100-F191 AromaticContact CE2-CZ 3.9Å; F100-F191 HydrophobicContact CE2-CZ 3.9Å; F100-F191 AromaticContact CZ-CD2 3.74Å; F100-F191 HydrophobicContact CZ-CD2 3.74Å; F100-F191 AromaticContact CZ-CE2 3.69Å; F100-F191 HydrophobicContact CZ-CE2 3.69Å; F100-F191 HydrophobicContact CZ-CG 4.44Å; F100-F191 HydrophobicContact CZ-CZ 4.36Å
101	R	95.8	Very high	94.7	Very high	94 Å²	94	40 Å²	40	36%	0.355	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.2	-176.4	-54	-175.1	-179.9	153.3	-4.9	110.1	T77 N78 Y163 T164	T77-R101 WeakPolarHBondContact CA-O 3.48Å; N78-R101 HydrophobicContact CB-CB 4.16Å; N78-R101 PolarHBondContact N-O 3.07Å; N78-R101 WeakPolarHBondContact O-CB 3.49Å; N78-R101 PolarHBondContact O-N 3.39Å; N78-R101 PolarHBondContact OD1-NH1 2.99Å; R101-Y163 WeakPolarHBondContact CA-O 3.45Å; R101-T164 HydrophobicContact CG-CG2 3.86Å; R101-T164 WeakPolarHBondContact CG-OG1 3.36Å
102	Q	96.4	Very high	94.6	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.009	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	139.6	179.6	-52.8	-171.9	-74.4	0	0	109.1	I75 K76 T77 F100 W104 T133 L162 Y163	I75-Q102 HydrophobicContact CG2-CB 4.21Å; K76-Q102 CarbonylContact O-C 3.56Å; K76-Q102 WeakPolarHBondContact O-CA 3.45Å; T77-Q102 HydrophobicContact CG2-CG 4.34Å; F100-Q102 HydrophobicContact CD1-CG 3.89Å; F100-Q102 HydrophobicContact CE1-CG 3.48Å; F100-Q102 VanDerWaalsContact CE1-CG 3.48Å; F100-Q102 HydrophobicContact CZ-CG 4.15Å; Q102-W104 HydrophobicContact CB-CE3 4.28Å; Q102-W104 HydrophobicContact CB-CZ3 4.01Å; Q102-T133 PolarHBondContact NE2-OG1 3.05Å; Q102-L162 WeakPolarHBondContact O-CA 3.47Å; Q102-Y163 PolarHBondContact N-O 3.42Å; Q102-Y163 PolarHBondContact O-N 2.99Å
103	S	96.5	Very high	94.3	Very high	25 Å²	25	43.3 Å²	43.3	18%	0.175	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.8	175.9	-172.8	0	0	0	0	110.4	K76 T160 L161	K76-S103 PolarHBondContact N-O 3.46Å; K76-S103 PolarHBondContact O-N 3.3Å; S103-T160 WeakPolarHBondContact OG-CG2 3.24Å; S103-L161 WeakPolarHBondContact CA-O 3.49Å; S103-L161 WeakPolarHBondContact CB-O 3.49Å; S103-L161 PolarHBondContact OG-O 3.46Å
104	W	96.6	Very high	93.9	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.015	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	164.9	176.9	67	96.8	0	0	0	108.9	I75 Q102 W129 T130 P131 L161 Y163	I75-W104 HydrophobicContact CG1-CB 4.31Å; Q102-W104 HydrophobicContact CB-CE3 4.28Å; Q102-W104 HydrophobicContact CB-CZ3 4.01Å; W104-W129 HydrophobicContact CG-CZ3 4.46Å; W104-W129 WeakPolarHBondContact CZ2-O 3.4Å; W104-W129 AromaticContact NE1-CE3 3.83Å; W104-W129 AromaticContact NE1-CZ3 3.89Å; W104-T130 HydrophobicContact CH2-CG2 4.09Å; W104-T130 HydrophobicContact CZ2-CG2 4.29Å; W104-P131 HydrophobicContact CE3-CG 4.3Å; W104-P131 HydrophobicContact CZ3-CG 4.16Å; W104-L161 HydrophobicContact CD2-CB 4.26Å; W104-L161 HydrophobicContact CH2-CB 4.49Å; W104-L161 HydrophobicContact CZ2-CB 4.1Å; W104-L161 HydrophobicContact CZ2-CD1 3.62Å; W104-L161 PolarHBondContact N-O 2.84Å; W104-L161 PolarHBondContact O-N 2.78Å; W104-Y163 HydrophobicContact CH2-CD1 4.28Å; W104-Y163 HydrophobicContact CH2-CG 4.13Å; W104-Y163 HydrophobicContact CZ3-CD1 4.38Å; W104-Y163 HydrophobicContact CZ3-CG 4.36Å
105	K	95.9	Very high	93.4	Very high	100 Å²	100	47.5 Å²	47.5	44%	0.435	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.1	178.4	-174.1	169.3	179.5	161.3	0	110.2	D158	K105-D158 VanDerWaalsContact CE-O 3.25Å; K105-D158 WeakPolarHBondContact CE-O 3.38Å
106	D	95.8	Very high	93.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.011	26%	0.264	C	S	.	.			trans	-121.8	107.3	171	-168.5	-13.1	0	0	0	109.2	Y60 P66 R108 L109 G159 L161	Y60-D106 VanDerWaalsContact CE2-OD2 3.3Å; Y60-D106 WeakPolarHBondContact CE2-OD2 3.39Å; Y60-D106 PolarHBondContact OH-OD2 2.86Å; P66-D106 HydrophobicContact CB-CB 4.13Å; P66-D106 HydrophobicContact CG-CB 3.88Å; D106-R108 PolarHBondContact O-N 2.87Å; D106-R108 WeakPolarHBondContact OD1-CB 3.39Å; D106-R108 IonicContact OD1-CZ 3.94Å; D106-R108 PolarHBondContact OD1-N 2.88Å; D106-R108 IonicContact OD1-NE 3.43Å; D106-R108 PolarHBondContact OD1-NE 3.22Å; D106-R108 IonicContact OD1-NH2 2.74Å; D106-R108 IonicContact OD2-CZ 2.91Å; D106-R108 IonicContact OD2-NE 2.75Å; D106-R108 IonicContact OD2-NH2 3.69Å; D106-R108 PolarHBondContact OD2-NH2 3.47Å; D106-L109 HydrophobicContact CB-CD1 4.12Å; D106-L109 HydrophobicContact CB-CG 4.41Å; D106-L109 PolarHBondContact O-N 2.92Å; D106-G159 PolarHBondContact N-O 2.94Å; D106-G159 WeakPolarHBondContact O-CA 3.5Å; D106-L161 HydrophobicContact CB-CD1 4.25Å
107	E	93.6	Very high	92.9	Very high	97 Å²	97	57.3 Å²	57.3	45%	0.453	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-67.3	-21.5	-174.8	-65.6	-178	174.4	0	0	112.9	K71 L109 C110	K71-E107 IonicContact NZ-OE1 2.59Å; K71-E107 PolarHBondContact NZ-OE1 3.5Å; K71-E107 IonicContact NZ-OE2 3.85Å; E107-L109 PolarHBondContact O-N 3.21Å; E107-C110 PolarHBondContact O-N 2.87Å; E107-C110 PolarHBondContact O-SG 3.07Å
108	R	94.1	Very high	92.7	Very high	95 Å²	95	56.4 Å²	56.4	36%	0.358	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-69.2	-20.3	177.8	-59	172.1	-67.5	177.2	2.4	112.6	Y60 D61 L64 D106	Y60-R108 HydrophobicContact CD2-CB 3.99Å; Y60-R108 HydrophobicContact CE2-CB 4.07Å; Y60-R108 PolarHBondContact OH-NH2 3.06Å; D61-R108 PolarHBondContact O-NH1 3.14Å; D61-R108 VanDerWaalsContact O-NH1 3.16Å; L64-R108 PolarHBondContact O-NH1 3.22Å; L64-R108 PolarHBondContact O-NH2 2.86Å; D106-R108 PolarHBondContact O-N 2.87Å; D106-R108 WeakPolarHBondContact OD1-CB 3.39Å; D106-R108 IonicContact OD1-CZ 3.94Å; D106-R108 PolarHBondContact OD1-N 2.88Å; D106-R108 IonicContact OD1-NE 3.43Å; D106-R108 PolarHBondContact OD1-NE 3.22Å; D106-R108 IonicContact OD1-NH2 2.74Å; D106-R108 IonicContact OD2-CZ 2.91Å; D106-R108 IonicContact OD2-NE 2.75Å; D106-R108 IonicContact OD2-NH2 3.69Å; D106-R108 PolarHBondContact OD2-NH2 3.47Å
109	L	93.9	Very high	92.4	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-102.5	15.7	-178.2	-59.2	172.7	0	0	0	112.3	L56 Y60 D106 E107 I128 L155 L161	L56-L109 HydrophobicContact CD1-CB 4.32Å; L56-L109 HydrophobicContact CD1-CD2 4.33Å; L56-L109 WeakPolarHBondContact CD1-O 3.41Å; L56-L109 HydrophobicContact CD2-CD2 3.99Å; L56-L109 HydrophobicContact CG-CD2 3.76Å; Y60-L109 HydrophobicContact CD2-CD2 3.79Å; Y60-L109 HydrophobicContact CD2-CG 4.29Å; Y60-L109 HydrophobicContact CE2-CD1 4.11Å; Y60-L109 HydrophobicContact CE2-CD2 3.77Å; Y60-L109 HydrophobicContact CE2-CG 3.83Å; Y60-L109 HydrophobicContact CG-CD2 4.48Å; D106-L109 HydrophobicContact CB-CD1 4.12Å; D106-L109 HydrophobicContact CB-CG 4.41Å; D106-L109 PolarHBondContact O-N 2.92Å; E107-L109 PolarHBondContact O-N 3.21Å; L109-I128 HydrophobicContact CD1-CD1 4.23Å; L109-I128 HydrophobicContact CD1-CG1 4.28Å; L109-I128 HydrophobicContact CD1-CG2 3.78Å; L109-L155 HydrophobicContact CB-CD1 3.91Å; L109-L155 HydrophobicContact CB-CD2 4.22Å; L109-L161 HydrophobicContact CD1-CD1 3.73Å; L109-L161 HydrophobicContact CD1-CD2 4.35Å; L109-L161 HydrophobicContact CD1-CG 4.38Å
110	C	93	Very high	92	Very high	65 Å²	65	57.5 Å²	57.5	44%	0.439	30%	0.298	S	S	.	.			trans	-65	137.2	170.9	-63.4	0	0	0	0	110	E107 D158	E107-C110 PolarHBondContact O-N 2.87Å; E107-C110 PolarHBondContact O-SG 3.07Å; C110-D158 PolarHBondContact SG-O 3.24Å
111	F	91.4	Very high	91.5	Very high	18 Å²	18	62.9 Å²	62.9	8%	0.079	33%	0.327	C	S	.	.			trans	-138.3	155.5	176.4	69.9	-84.6	0	0	0	110.7	I52 L56 M115 L118 L155 K156 D157	I52-F111 HydrophobicContact CG2-CB 3.89Å; I52-F111 HydrophobicContact CG2-CD2 3.94Å; I52-F111 HydrophobicContact CG2-CG 4.05Å; L56-F111 HydrophobicContact CD1-CB 4.2Å; F111-M115 HydrophobicContact CE2-CG 3.79Å; F111-M115 HydrophobicContact CE2-SD 4.26Å; F111-M115 HydrophobicContact CZ-CG 4.15Å; F111-L118 HydrophobicContact CD1-CD1 4.02Å; F111-L118 HydrophobicContact CD2-CD1 4.16Å; F111-L118 HydrophobicContact CE1-CD1 3.63Å; F111-L118 HydrophobicContact CE1-CG 4.21Å; F111-L118 HydrophobicContact CE2-CD1 3.79Å; F111-L118 HydrophobicContact CE2-CG 4.18Å; F111-L118 HydrophobicContact CG-CD1 4.27Å; F111-L118 HydrophobicContact CZ-CB 4.44Å; F111-L118 HydrophobicContact CZ-CD1 3.51Å; F111-L118 HydrophobicContact CZ-CG 3.75Å; F111-L155 HydrophobicContact CD1-CD2 3.94Å; F111-L155 HydrophobicContact CD1-CG 4.25Å; F111-L155 HydrophobicContact CE1-CD2 4Å; F111-L155 HydrophobicContact CE1-CG 3.92Å; F111-K156 WeakPolarHBondContact CE1-O 3.5Å; F111-D157 HydrophobicContact CE1-CB 4.45Å; F111-D157 HydrophobicContact CZ-CB 4.22Å; F111-D157 PolarHBondContact N-O 3.06Å
112	K	89.6	Confident	90.9	Very high	205 Å²	205	60 Å²	60	89%	0.891	32%	0.318	S	S	*	.			trans	-113.4	117.4	172.9	-67.9	-175.4	-179.9	180	0	108.7
113	G	85.9	Confident	90.3	Very high	35 Å²	35	66.2 Å²	66.2	36%	0.361	35%	0.351	S	S	.	.	S	Bend	trans	-155.1	175.7	179.4	0	0	0	0	0	111.6	M115	G113-M115 PolarHBondContact O-N 3.1Å
114	P	86.4	Confident	89.7	Confident	97 Å²	97	66.6 Å²	66.6	63%	0.63	35%	0.35	S	S	*	.	S	Bend	trans	-71.5	-4.8	178.2	29.8	-35.7	0	0	0	113.7
115	M	84.9	Confident	89.1	Confident	26 Å²	26	66.8 Å²	66.8	13%	0.128	35%	0.353	C	S	.	.			trans	-114	145.3	-177.5	73.9	-150.6	80.9	0	0	110.6	F49 I52 F111 G113 L118	F49-M115 HydrophobicContact CD1-CE 3.2Å; F49-M115 HydrophobicContact CD1-SD 3.38Å; F49-M115 WeakPolarHBondContact CD1-SD 3.42Å; F49-M115 HydrophobicContact CD2-CE 4.41Å; F49-M115 HydrophobicContact CE1-CE 3Å; F49-M115 HydrophobicContact CE1-CG 4.42Å; F49-M115 HydrophobicContact CE1-SD 3.04Å; F49-M115 WeakPolarHBondContact CE1-SD 3.21Å; F49-M115 HydrophobicContact CE2-CE 4.2Å; F49-M115 HydrophobicContact CG-CE 3.93Å; F49-M115 HydrophobicContact CZ-CE 3.49Å; F49-M115 VanDerWaalsContact CZ-CE 3.49Å; F49-M115 HydrophobicContact CZ-SD 3.98Å; I52-M115 HydrophobicContact CD1-CE 4.26Å; F111-M115 HydrophobicContact CE2-CG 3.79Å; F111-M115 HydrophobicContact CE2-SD 4.26Å; F111-M115 HydrophobicContact CZ-CG 4.15Å; G113-M115 PolarHBondContact O-N 3.1Å; M115-L118 HydrophobicContact CE-CD2 4.46Å; M115-L118 HydrophobicContact CG-CD2 4.46Å; M115-L118 HydrophobicContact CG-CG 4.27Å; M115-L118 HydrophobicContact SD-CD1 4.26Å; M115-L118 HydrophobicContact SD-CD2 3.15Å; M115-L118 WeakPolarHBondContact SD-CD2 3.37Å; M115-L118 HydrophobicContact SD-CG 3.49Å; M115-L118 WeakPolarHBondContact SD-CG 3.34Å
116	E	88	Confident	88.7	Confident	155 Å²	155	65.7 Å²	65.7	72%	0.724	36%	0.358	S	S	*	.	S	Bend	trans	-86	-23.4	174.7	-63.7	179.4	177.2	0	0	112.5	K156 D157	E116-K156 VanDerWaalsContact O-CA 3.3Å; E116-K156 WeakPolarHBondContact O-CA 3.35Å; E116-D157 PolarHBondContact O-N 3.27Å
117	M	90.3	Very high	88.4	Confident	81 Å²	81	69.1 Å²	69.1	40%	0.399	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	127.1	-174.6	-167.6	179.5	-69	0	0	112.5	R154 L155 K156	M117-R154 HydrophobicContact CG-CB 4.09Å; M117-R154 HydrophobicContact SD-CB 3.92Å; M117-R154 VanDerWaalsContact SD-CD 3.55Å; M117-R154 HydrophobicContact SD-CG 4.31Å; M117-L155 CarbonylContact C-O 3.53Å; M117-L155 VanDerWaalsContact CA-O 3.32Å; M117-L155 WeakPolarHBondContact CA-O 3.39Å; M117-K156 HydrophobicContact CE-CD 4.27Å; M117-K156 HydrophobicContact CE-CG 3.78Å
118	L	90.4	Very high	88.4	Confident	13 Å²	13	64.7 Å²	64.7	7%	0.068	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.1	174	-80.9	167.8	0	0	0	110.2	F49 I52 L53 F111 M115 L120 R154 L155	F49-L118 HydrophobicContact CD1-CD2 3.98Å; F49-L118 HydrophobicContact CE1-CD2 4.4Å; I52-L118 HydrophobicContact CG2-CD1 4.42Å; L53-L118 HydrophobicContact CD2-CD1 4.48Å; F111-L118 HydrophobicContact CD1-CD1 4.02Å; F111-L118 HydrophobicContact CD2-CD1 4.16Å; F111-L118 HydrophobicContact CE1-CD1 3.63Å; F111-L118 HydrophobicContact CE1-CG 4.21Å; F111-L118 HydrophobicContact CE2-CD1 3.79Å; F111-L118 HydrophobicContact CE2-CG 4.18Å; F111-L118 HydrophobicContact CG-CD1 4.27Å; F111-L118 HydrophobicContact CZ-CB 4.44Å; F111-L118 HydrophobicContact CZ-CD1 3.51Å; F111-L118 HydrophobicContact CZ-CG 3.75Å; M115-L118 HydrophobicContact CE-CD2 4.46Å; M115-L118 HydrophobicContact CG-CD2 4.46Å; M115-L118 HydrophobicContact CG-CG 4.27Å; M115-L118 HydrophobicContact SD-CD1 4.26Å; M115-L118 HydrophobicContact SD-CD2 3.15Å; M115-L118 WeakPolarHBondContact SD-CD2 3.37Å; M115-L118 HydrophobicContact SD-CG 3.49Å; M115-L118 WeakPolarHBondContact SD-CG 3.34Å; L118-L120 HydrophobicContact CB-CD2 4.03Å; L118-R154 CarbonylContact O-C 3.53Å; L118-R154 VanDerWaalsContact O-CA 3.27Å; L118-R154 WeakPolarHBondContact O-CA 3.32Å; L118-L155 HydrophobicContact CB-CB 4.37Å; L118-L155 PolarHBondContact N-O 3.29Å; L118-L155 PolarHBondContact O-N 2.83Å
119	A	89.8	Confident	88.5	Confident	76 Å²	76	60.6 Å²	60.6	63%	0.628	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	114.7	167.2	0	0	0	0	0	109
120	L	87.1	Confident	88.5	Confident	14 Å²	14	63 Å²	63	7%	0.073	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	146.8	-173.1	-57.2	174.5	0	0	0	110.9	L53 L118 L124 I128 L153 L155	L53-L120 HydrophobicContact CD2-CD2 3.54Å; L118-L120 HydrophobicContact CB-CD2 4.03Å; L120-L124 HydrophobicContact CB-CD2 4.23Å; L120-L124 HydrophobicContact CD1-CD2 3.94Å; L120-L124 HydrophobicContact CD2-CD2 3.65Å; L120-L124 HydrophobicContact CG-CD2 4.11Å; L120-I128 HydrophobicContact CD1-CD1 4.2Å; L120-L153 HydrophobicContact CB-CB 4.28Å; L120-L153 HydrophobicContact CB-CD2 4.45Å; L120-L153 HydrophobicContact CD1-CD2 3.82Å; L120-L153 HydrophobicContact CD1-CG 4.17Å; L120-L153 PolarHBondContact N-O 3.25Å; L120-L155 HydrophobicContact CD1-CB 3.96Å; L120-L155 HydrophobicContact CD1-CD2 4.46Å
121	N	85.9	Confident	88.7	Confident	117 Å²	117	60.4 Å²	60.4	63%	0.626	34%	0.337	S	S	*	.			trans	-75.2	158.5	175.1	-166.8	4.1	0	0	0	111.1	L123 L124 A125	N121-L123 PolarHBondContact O-N 3.16Å; N121-L124 PolarHBondContact O-N 2.99Å; N121-A125 PolarHBondContact O-N 3.21Å
122	N	82.9	Confident	88.8	Confident	32 Å²	32	61.8 Å²	61.8	17%	0.171	35%	0.346	C	S	.	.	H	α-helix	trans	-55.7	-33.1	179.1	-72.2	-26.9	0	0	0	114.1	L124 A125 S126 P149 K151	N122-L124 VanDerWaalsContact C-N 3.32Å; N122-L124 PolarHBondContact O-N 2.75Å; N122-A125 WeakPolarHBondContact O-CB 3.34Å; N122-A125 PolarHBondContact O-N 3.25Å; N122-S126 PolarHBondContact O-N 2.88Å; N122-P149 PolarHBondContact ND2-O 3.07Å; N122-K151 WeakPolarHBondContact OD1-CB 3.36Å; N122-K151 PolarHBondContact OD1-O 2.89Å
123	L	83.4	Confident	89.2	Confident	133 Å²	133	53.5 Å²	53.5	70%	0.696	31%	0.312	S	S	*	.	H	α-helix	trans	-64.1	-37.9	178.2	-176.2	67.4	0	0	0	112	N121 S126	N121-L123 PolarHBondContact O-N 3.16Å; L123-S126 PolarHBondContact O-OG 3.36Å
124	L	84.1	Confident	89.6	Confident	33 Å²	33	55.3 Å²	55.3	17%	0.173	31%	0.31	C	S	.	.	H	α-helix	trans	-76.3	-30.7	178.1	-161.4	71.5	0	0	0	111.1	L53 L57 L120 N121 N122 S126 N127 I128	L53-L124 HydrophobicContact CD2-CD2 3.98Å; L57-L124 HydrophobicContact CD1-CD1 3.38Å; L57-L124 HydrophobicContact CD1-CG 4.45Å; L57-L124 HydrophobicContact CG-CD1 4.19Å; L120-L124 HydrophobicContact CB-CD2 4.23Å; L120-L124 HydrophobicContact CD1-CD2 3.94Å; L120-L124 HydrophobicContact CD2-CD2 3.65Å; L120-L124 HydrophobicContact CG-CD2 4.11Å; N121-L124 PolarHBondContact O-N 2.99Å; N122-L124 VanDerWaalsContact C-N 3.32Å; N122-L124 PolarHBondContact O-N 2.75Å; L124-S126 PolarHBondContact O-N 2.86Å; L124-N127 PolarHBondContact O-N 3.16Å; L124-I128 HydrophobicContact CG-CD1 4.47Å
125	A	84.8	Confident	90.1	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-27	178.1	0	0	0	0	0	113.5	N121 N122 N127 L153	N121-A125 PolarHBondContact O-N 3.21Å; N122-A125 WeakPolarHBondContact O-CB 3.34Å; N122-A125 PolarHBondContact O-N 3.25Å; A125-N127 VanDerWaalsContact C-N 3.31Å; A125-L153 HydrophobicContact CB-CB 4.11Å; A125-L153 HydrophobicContact CB-CD2 3.92Å
126	S	86.8	Confident	90.6	Very high	77 Å²	77	53.7 Å²	53.7	54%	0.538	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-16.4	173.7	52.7	0	0	0	0	114.2	N122 L123 L124	N122-S126 PolarHBondContact O-N 2.88Å; L123-S126 PolarHBondContact O-OG 3.36Å; L124-S126 PolarHBondContact O-N 2.86Å
127	N	90.9	Very high	90.9	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	0.2	-179.3	-64	-15.5	0	0	0	112.6	L57 N62 L124 A125	L57-N127 HydrophobicContact CD1-CB 4.08Å; N62-N127 WeakPolarHBondContact CB-O 3.25Å; L124-N127 PolarHBondContact O-N 3.16Å; A125-N127 VanDerWaalsContact C-N 3.31Å
128	I	93.5	Very high	91.1	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	26%	0.261	C	S	.	.	S	Bend	trans	-109.2	144.8	178.9	-68.2	166.3	0	0	0	108.5	L57 L109 L120 L124 T130 L153 L161	L57-I128 HydrophobicContact CD2-CG1 4.23Å; L109-I128 HydrophobicContact CD1-CD1 4.23Å; L109-I128 HydrophobicContact CD1-CG1 4.28Å; L109-I128 HydrophobicContact CD1-CG2 3.78Å; L120-I128 HydrophobicContact CD1-CD1 4.2Å; L124-I128 HydrophobicContact CG-CD1 4.47Å; I128-T130 PolarHBondContact O-N 3.43Å; I128-L153 HydrophobicContact CD1-CD2 3.65Å; I128-L161 HydrophobicContact CG2-CD1 3.93Å
129	W	95.4	Very high	91.2	Very high	9 Å²	9	49.2 Å²	49.2	3%	0.034	28%	0.279	C	S	.	.			trans	-61.3	130.2	174.1	178.2	92.4	0	0	0	109.5	Y60 R65 P66 T73 W104 P131 Y196	Y60-W129 WeakPolarHBondContact OH-CB 3.45Å; Y60-W129 PolarHBondContact OH-N 3.49Å; R65-W129 HydrophobicContact CB-CD2 4.4Å; R65-W129 HydrophobicContact CB-CH2 4.35Å; R65-W129 HydrophobicContact CB-CZ2 3.63Å; P66-W129 VanDerWaalsContact CD-CE3 3.4Å; P66-W129 HydrophobicContact CG-CD2 4.5Å; P66-W129 HydrophobicContact CG-CE3 3.91Å; P66-W129 HydrophobicContact CG-CZ3 4.2Å; T73-W129 HydrophobicContact CG2-CH2 4.21Å; T73-W129 HydrophobicContact CG2-CZ3 4.25Å; W104-W129 HydrophobicContact CG-CZ3 4.46Å; W104-W129 WeakPolarHBondContact CZ2-O 3.4Å; W104-W129 AromaticContact NE1-CE3 3.83Å; W104-W129 AromaticContact NE1-CZ3 3.89Å; W129-P131 HydrophobicContact CH2-CB 4.01Å; W129-P131 HydrophobicContact CZ3-CB 4.36Å; W129-Y196 AromaticContact CZ2-CE2 3.99Å; W129-Y196 HydrophobicContact CZ2-CE2 3.99Å; W129-Y196 PolarHBondContact NE1-OH 3.01Å
130	T	94.8	Very high	91.3	Very high	51 Å²	51	52.1 Å²	52.1	31%	0.313	28%	0.278	S	S	.	.			trans	-126.4	143	175.1	51.7	0	0	0	0	109.2	W104 I128 Y163	W104-T130 HydrophobicContact CH2-CG2 4.09Å; W104-T130 HydrophobicContact CZ2-CG2 4.29Å; I128-T130 PolarHBondContact O-N 3.43Å; T130-Y163 HydrophobicContact CG2-CE1 4.35Å
131	P	96	Very high	91.6	Very high	10 Å²	10	54.3 Å²	54.3	7%	0.065	29%	0.294	C	S	.	.			trans	-67.3	143.8	-179.1	28.9	-35.6	0	0	0	111.7	I75 W104 W129 T133	I75-P131 HydrophobicContact CD1-CB 3.31Å; I75-P131 HydrophobicContact CD1-CG 3.87Å; I75-P131 HydrophobicContact CG1-CB 4.44Å; I75-P131 HydrophobicContact CG2-CG 4.45Å; W104-P131 HydrophobicContact CE3-CG 4.3Å; W104-P131 HydrophobicContact CZ3-CG 4.16Å; W129-P131 HydrophobicContact CH2-CB 4.01Å; W129-P131 HydrophobicContact CZ3-CB 4.36Å; P131-T133 PolarHBondContact O-N 3.44Å
132	D	94.9	Very high	92	Very high	48 Å²	48	52.8 Å²	52.8	26%	0.257	29%	0.285	S	S	.	.			trans	-84.2	52.1	-175.9	65.3	-20	0	0	0	112.2	F134 S193 Y194 A195 Y196	D132-F134 PolarHBondContact O-N 2.92Å; D132-S193 WeakPolarHBondContact OD1-CB 3.41Å; D132-S193 PolarHBondContact OD1-OG 3.3Å; D132-S193 PolarHBondContact OD2-OG 3.04Å; D132-Y194 PolarHBondContact O-N 3.21Å; D132-Y194 PolarHBondContact OD2-N 3.21Å; D132-A195 VanDerWaalsContact OD2-CB 3.23Å; D132-A195 WeakPolarHBondContact OD2-CB 3.26Å; D132-A195 PolarHBondContact OD2-N 2.99Å; D132-Y196 WeakPolarHBondContact OD1-CD2 3.22Å
133	T	96.3	Very high	92.5	Very high	30 Å²	30	54.1 Å²	54.1	18%	0.184	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	126.9	-177.9	-48.8	0	0	0	0	111.4	F100 Q102 P131 F191 G192 Y203	F100-T133 HydrophobicContact CE1-CG2 3.9Å; F100-T133 HydrophobicContact CZ-CG2 3.78Å; Q102-T133 PolarHBondContact NE2-OG1 3.05Å; P131-T133 PolarHBondContact O-N 3.44Å; T133-F191 HydrophobicContact CG2-CB 4.21Å; T133-F191 HydrophobicContact CG2-CD2 3.79Å; T133-F191 HydrophobicContact CG2-CG 4.44Å; T133-G192 WeakPolarHBondContact CA-O 3.32Å; T133-Y203 HydrophobicContact CG2-CE1 4.16Å; T133-Y203 WeakPolarHBondContact OG1-CE1 3.41Å; T133-Y203 PolarHBondContact OG1-OH 3.39Å
134	F	95.7	Very high	92.9	Very high	73 Å²	73	50.4 Å²	50.4	32%	0.32	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.4	175.5	81.8	-70.7	0	0	0	110.8	D132 L136 F191 G192 S193 Y194	D132-F134 PolarHBondContact O-N 2.92Å; F134-L136 HydrophobicContact CE1-CD1 4.13Å; F134-L136 HydrophobicContact CE2-CD1 4.14Å; F134-L136 HydrophobicContact CE2-CG 3.95Å; F134-L136 HydrophobicContact CZ-CD1 3.83Å; F134-L136 HydrophobicContact CZ-CG 3.79Å; F134-F191 WeakPolarHBondContact O-CA 3.46Å; F134-F191 WeakPolarHBondContact O-CB 3.45Å; F134-G192 VanDerWaalsContact CD1-O 3.31Å; F134-G192 WeakPolarHBondContact CD1-O 2.92Å; F134-G192 PolarHBondContact N-O 2.9Å; F134-G192 PolarHBondContact O-N 3.38Å; F134-G192 VanDerWaalsContact O-N 3.1Å; F134-S193 WeakPolarHBondContact CE1-O 3.23Å; F134-Y194 AromaticContact CD1-CD2 3.97Å; F134-Y194 HydrophobicContact CD1-CD2 3.97Å; F134-Y194 HydrophobicContact CD1-CG 4.31Å; F134-Y194 HydrophobicContact CD2-CD2 4.31Å; F134-Y194 VanDerWaalsContact CE1-CA 3.49Å; F134-Y194 AromaticContact CE1-CD2 3.92Å; F134-Y194 HydrophobicContact CE1-CD2 3.92Å; F134-Y194 HydrophobicContact CE1-CG 4.41Å; F134-Y194 HydrophobicContact CE2-CD2 4.24Å; F134-Y194 HydrophobicContact CG-CD2 4.17Å; F134-Y194 HydrophobicContact CZ-CD2 4.05Å
135	F	96.8	Very high	93.2	Very high	26 Å²	26	54.6 Å²	54.6	11%	0.114	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	119.1	176.6	-63.7	-83.4	0	0	0	109.4	F100 G138 L167 I169 L189 K190 F191	F100-F135 HydrophobicContact CD2-CZ 4.35Å; F100-F135 HydrophobicContact CE2-CZ 4.5Å; F135-G138 PolarHBondContact O-N 3.05Å; F135-L167 HydrophobicContact CE2-CD1 3.68Å; F135-L167 HydrophobicContact CZ-CD1 4.01Å; F135-I169 HydrophobicContact CD1-CD1 4.12Å; F135-I169 HydrophobicContact CD2-CD1 4.14Å; F135-I169 HydrophobicContact CD2-CG1 4.29Å; F135-I169 HydrophobicContact CE1-CD1 3.55Å; F135-I169 HydrophobicContact CE2-CD1 3.58Å; F135-I169 HydrophobicContact CE2-CG1 4.03Å; F135-I169 HydrophobicContact CG-CD1 4.4Å; F135-I169 HydrophobicContact CG-CG2 4.31Å; F135-I169 HydrophobicContact CZ-CD1 3.26Å; F135-I169 HydrophobicContact CZ-CG1 4.21Å; F135-L189 HydrophobicContact CD1-CD1 3.72Å; F135-L189 HydrophobicContact CD1-CG 4.18Å; F135-L189 HydrophobicContact CE1-CD1 4.1Å; F135-L189 HydrophobicContact CE1-CD2 4.32Å; F135-L189 HydrophobicContact CE1-CG 4.25Å; F135-K190 CarbonylContact C-O 3.6Å; F135-K190 VanDerWaalsContact CA-O 3.29Å; F135-K190 WeakPolarHBondContact CA-O 3.44Å; F135-F191 HydrophobicContact CD1-CB 3.69Å; F135-F191 HydrophobicContact CD1-CG 4.47Å; F135-F191 HydrophobicContact CE1-CB 3.83Å; F135-F191 HydrophobicContact CE1-CD1 4.19Å; F135-F191 HydrophobicContact CE1-CG 4.19Å; F135-F191 HydrophobicContact CG-CB 4.39Å
136	L	94.8	Very high	93.2	Very high	63 Å²	63	61.3 Å²	61.3	33%	0.33	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-38.9	-174.5	-77.4	73.3	0	0	0	111.7	F134 K190 I237 V246	F134-L136 HydrophobicContact CE1-CD1 4.13Å; F134-L136 HydrophobicContact CE2-CD1 4.14Å; F134-L136 HydrophobicContact CE2-CG 3.95Å; F134-L136 HydrophobicContact CZ-CD1 3.83Å; F134-L136 HydrophobicContact CZ-CG 3.79Å; L136-K190 HydrophobicContact CB-CB 4.08Å; L136-K190 PolarHBondContact N-O 2.92Å; L136-I237 HydrophobicContact CD2-CD1 3.81Å; L136-V246 HydrophobicContact CD1-CG1 4.42Å; L136-V246 HydrophobicContact CD2-CG1 4.13Å; L136-V246 HydrophobicContact CD2-CG2 3.76Å
137	N	95.5	Very high	93.1	Very high	24 Å²	24	63.9 Å²	63.9	13%	0.128	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	16.5	176.7	68.7	-39.4	0	0	0	112.8	K139 A171 E172 P188 K190	N137-K139 PolarHBondContact O-N 2.94Å; N137-A171 CarbonylContact O-C 3.52Å; N137-A171 WeakPolarHBondContact O-CA 3.4Å; N137-E172 HydrophobicContact CB-CB 4.46Å; N137-E172 PolarHBondContact ND2-O 2.84Å; N137-E172 PolarHBondContact O-N 3.43Å; N137-P188 PolarHBondContact ND2-O 2.78Å; N137-K190 PolarHBondContact OD1-N 3.43Å
138	G	93.7	Very high	92.9	Very high	27 Å²	27	64.6 Å²	64.6	28%	0.278	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	116.7	175.9	0	0	0	0	0	111.1	F135	F135-G138 PolarHBondContact O-N 3.05Å
139	K	92.4	Very high	92.5	Very high	104 Å²	104	67.4 Å²	67.4	45%	0.452	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-45.7	173.1	-73.7	178.2	174.2	176.4	0	111.4	E91 E93 N137 S170	E91-K139 PolarHBondContact O-NZ 2.95Å; E93-K139 HydrophobicContact CB-CD 4.47Å; E93-K139 VanDerWaalsContact OE2-CD 3.22Å; E93-K139 WeakPolarHBondContact OE2-CD 3.44Å; E93-K139 IonicContact OE2-NZ 3.23Å; N137-K139 PolarHBondContact O-N 2.94Å; K139-S170 PolarHBondContact N-O 3.17Å
140	K	92.5	Very high	92.1	Very high	138 Å²	138	69.5 Å²	69.5	60%	0.6	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	134.7	179.2	-174	175.9	179.5	179.9	0	108.7	S170	K140-S170 PolarHBondContact N-O 3.34Å; K140-S170 WeakPolarHBondContact O-CA 3.28Å; K140-S170 VanDerWaalsContact O-CB 3.3Å; K140-S170 WeakPolarHBondContact O-CB 3.5Å; K140-S170 PolarHBondContact O-N 3Å
141	S	92.8	Very high	91.8	Very high	60 Å²	60	71.4 Å²	71.4	42%	0.42	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.2	176.8	-63.7	0	0	0	0	109.6	T168	S141-T168 CarbonylContact C-O 3.6Å; S141-T168 WeakPolarHBondContact CA-O 3.46Å
142	I	94.1	Very high	91.5	Very high	85 Å²	85	74 Å²	74	44%	0.436	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.1	-178	-56.7	172.8	0	0	0	108	L167 T168	I142-L167 WeakPolarHBondContact O-CA 3.41Å; I142-T168 PolarHBondContact N-O 3.32Å; I142-T168 PolarHBondContact O-N 2.73Å
143	A	93.7	Very high	91.4	Very high	60 Å²	60	71.8 Å²	71.8	50%	0.496	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123	166.4	0	0	0	0	0	109.1	L167	A143-L167 HydrophobicContact CB-CD2 3.78Å
144	H	91.3	Very high	91.3	Very high	55 Å²	55	75.4 Å²	75.4	26%	0.255	40%	0.4	S	S	.	.			trans	-70.9	137.6	-177.8	-68.3	-84.3	0	0	0	111.6	N150 R166 T168	H144-N150 HydrophobicContact CB-CB 4.31Å; H144-N150 PolarHBondContact O-N 2.88Å; H144-N150 VanDerWaalsContact O-N 3.11Å; H144-N150 PolarHBondContact O-OD1 2.92Å; H144-R166 PolarHBondContact N-O 2.97Å; H144-T168 PolarHBondContact CE1-OG1 2.96Å; H144-T168 PolarHBondContact NE2-OG1 2.78Å
145	N	89.9	Confident	91.3	Very high	120 Å²	120	72 Å²	72	64%	0.642	38%	0.384	S	S	*	.			trans	-130.9	26.9	-173.8	68.5	-15.4	0	0	0	115	T148	N145-T148 CarbonylContact C-O 3.47Å
146	M	85.1	Confident	91.2	Very high	149 Å²	149	75.3 Å²	75.3	73%	0.734	40%	0.399	S	S	*	.	S	Bend	trans	-121.9	128.2	-172.6	-171.2	69.2	77	0	0	112	T148 N150	M146-T148 PolarHBondContact N-O 3.07Å; M146-N150 PolarHBondContact N-OD1 2.87Å; M146-N150 PolarHBondContact O-OD1 2.81Å
147	T	86.1	Confident	91.1	Very high	131 Å²	131	75.9 Å²	75.9	80%	0.804	40%	0.402	S	S	*	.	S	Bend	cis	-78.9	-17.9	-9	49.3	0	0	0	0	113.5
148	T	85.1	Confident	91.1	Very high	90 Å²	90	77.7 Å²	77.7	55%	0.552	41%	0.412	S	S	*	.	S	Bend	trans	-123.8	162.5	168.8	54.9	0	0	0	0	108.4	N145 M146 N150	N145-T148 CarbonylContact C-O 3.47Å; M146-T148 PolarHBondContact N-O 3.07Å; T148-N150 PolarHBondContact O-N 2.81Å; T148-N150 PolarHBondContact O-OD1 2.95Å
149	P	86.3	Confident	91.1	Very high	62 Å²	62	76.4 Å²	76.4	40%	0.403	40%	0.399	S	S	.	.			trans	-49.6	126.6	173.9	-28.1	35.5	0	0	0	111.7	N122 K151	N122-P149 PolarHBondContact ND2-O 3.07Å; P149-K151 PolarHBondContact O-N 2.8Å
150	N	85.8	Confident	91.2	Very high	54 Å²	54	72.8 Å²	72.8	29%	0.289	39%	0.386	S	S	.	.			trans	-79.3	57.7	-178.2	-63.2	62.9	0	0	0	110.5	H144 M146 T148 M165 R166	H144-N150 HydrophobicContact CB-CB 4.31Å; H144-N150 PolarHBondContact O-N 2.88Å; H144-N150 VanDerWaalsContact O-N 3.11Å; H144-N150 PolarHBondContact O-OD1 2.92Å; M146-N150 PolarHBondContact N-OD1 2.87Å; M146-N150 PolarHBondContact O-OD1 2.81Å; T148-N150 PolarHBondContact O-N 2.81Å; T148-N150 PolarHBondContact O-OD1 2.95Å; N150-M165 WeakPolarHBondContact O-CA 3.37Å; N150-R166 HydrophobicContact CB-CB 3.95Å; N150-R166 PolarHBondContact O-N 2.96Å
151	K	89	Confident	91.4	Very high	91 Å²	91	66.2 Å²	66.2	40%	0.396	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.3	175.1	-66.1	176.9	176.4	-168.9	0	107.9	N122 P149 Y163 T164 M165	N122-K151 WeakPolarHBondContact OD1-CB 3.36Å; N122-K151 PolarHBondContact OD1-O 2.89Å; P149-K151 PolarHBondContact O-N 2.8Å; K151-Y163 HydrophobicContact CB-CE2 4.15Å; K151-Y163 HydrophobicContact CD-CE2 4.21Å; K151-Y163 WeakPolarHBondContact CD-OH 3.23Å; K151-Y163 VanDerWaalsContact CE-OH 3.28Å; K151-Y163 WeakPolarHBondContact CE-OH 3.33Å; K151-Y163 HydrophobicContact CG-CE2 4.26Å; K151-Y163 PolarHBondContact NZ-OH 2.82Å; K151-T164 CarbonylContact C-O 3.57Å; K151-T164 WeakPolarHBondContact CA-O 3.39Å; K151-M165 HydrophobicContact CG-CB 4.49Å
152	L	89.5	Confident	91.5	Very high	65 Å²	65	66.2 Å²	66.2	34%	0.34	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122.7	174.9	174.3	66.5	0	0	0	107.1	R154 Y163 T164	L152-R154 HydrophobicContact CD1-CG 4.24Å; L152-R154 HydrophobicContact CD2-CG 4.49Å; L152-R154 HydrophobicContact CG-CG 4.2Å; L152-Y163 CarbonylContact O-C 3.56Å; L152-Y163 WeakPolarHBondContact O-CA 3.3Å; L152-T164 PolarHBondContact N-O 3.31Å; L152-T164 PolarHBondContact O-N 2.69Å
153	L	93.4	Very high	91.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.2	172.8	-170.9	67.2	0	0	0	108.6	L120 A125 I128 L161 L162 Y163	L120-L153 HydrophobicContact CB-CB 4.28Å; L120-L153 HydrophobicContact CB-CD2 4.45Å; L120-L153 HydrophobicContact CD1-CD2 3.82Å; L120-L153 HydrophobicContact CD1-CG 4.17Å; L120-L153 PolarHBondContact N-O 3.25Å; A125-L153 HydrophobicContact CB-CB 4.11Å; A125-L153 HydrophobicContact CB-CD2 3.92Å; I128-L153 HydrophobicContact CD1-CD2 3.65Å; L153-L161 HydrophobicContact CD1-CB 4.48Å; L153-L161 HydrophobicContact CD1-CD2 3.93Å; L153-L161 HydrophobicContact CD2-CD2 4.32Å; L153-L161 HydrophobicContact CG-CD2 4.14Å; L153-L162 CarbonylContact C-O 3.59Å; L153-L162 WeakPolarHBondContact CA-O 3.45Å; L153-Y163 HydrophobicContact CD1-CD2 4.02Å; L153-Y163 HydrophobicContact CD1-CG 4.37Å
154	R	93.9	Very high	91.6	Very high	107 Å²	107	60.7 Å²	60.7	40%	0.404	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	171.6	-61.5	-171.3	179.6	-178.1	-1	109.1	M117 L118 L152 L161 L162	M117-R154 HydrophobicContact CG-CB 4.09Å; M117-R154 HydrophobicContact SD-CB 3.92Å; M117-R154 VanDerWaalsContact SD-CD 3.55Å; M117-R154 HydrophobicContact SD-CG 4.31Å; L118-R154 CarbonylContact O-C 3.53Å; L118-R154 VanDerWaalsContact O-CA 3.27Å; L118-R154 WeakPolarHBondContact O-CA 3.32Å; L152-R154 HydrophobicContact CD1-CG 4.24Å; L152-R154 HydrophobicContact CD2-CG 4.49Å; L152-R154 HydrophobicContact CG-CG 4.2Å; R154-L161 CarbonylContact O-C 3.48Å; R154-L161 WeakPolarHBondContact O-CA 3.22Å; R154-L162 HydrophobicContact CB-CB 4.34Å; R154-L162 PolarHBondContact N-O 2.98Å; R154-L162 PolarHBondContact O-N 2.97Å
155	L	95	Very high	91.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.8	178.8	173.9	65.2	0	0	0	108.7	L56 L109 F111 M117 L118 L120 L161	L56-L155 HydrophobicContact CD1-CD2 4.15Å; L56-L155 HydrophobicContact CD2-CD2 3.59Å; L109-L155 HydrophobicContact CB-CD1 3.91Å; L109-L155 HydrophobicContact CB-CD2 4.22Å; F111-L155 HydrophobicContact CD1-CD2 3.94Å; F111-L155 HydrophobicContact CD1-CG 4.25Å; F111-L155 HydrophobicContact CE1-CD2 4Å; F111-L155 HydrophobicContact CE1-CG 3.92Å; M117-L155 CarbonylContact C-O 3.53Å; M117-L155 VanDerWaalsContact CA-O 3.32Å; M117-L155 WeakPolarHBondContact CA-O 3.39Å; L118-L155 HydrophobicContact CB-CB 4.37Å; L118-L155 PolarHBondContact N-O 3.29Å; L118-L155 PolarHBondContact O-N 2.83Å; L120-L155 HydrophobicContact CD1-CB 3.96Å; L120-L155 HydrophobicContact CD1-CD2 4.46Å; L155-L161 HydrophobicContact CB-CD2 3.85Å; L155-L161 HydrophobicContact CD1-CD2 3.52Å; L155-L161 HydrophobicContact CD1-CG 3.96Å; L155-L161 HydrophobicContact CG-CD2 4.21Å
156	K	95.6	Very high	91.9	Very high	96 Å²	96	58 Å²	58	42%	0.417	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	157	169.2	-70.8	-172.7	179.5	-174.6	0	111.2	F111 E116 M117 D158 G159 T160	F111-K156 WeakPolarHBondContact CE1-O 3.5Å; E116-K156 VanDerWaalsContact O-CA 3.3Å; E116-K156 WeakPolarHBondContact O-CA 3.35Å; M117-K156 HydrophobicContact CE-CD 4.27Å; M117-K156 HydrophobicContact CE-CG 3.78Å; K156-D158 WeakPolarHBondContact CB-OD1 3.33Å; K156-D158 PolarHBondContact O-N 3.18Å; K156-G159 PolarHBondContact O-N 2.91Å; K156-T160 PolarHBondContact N-O 2.98Å
157	D	93.4	Very high	92.4	Very high	76 Å²	76	51.5 Å²	51.5	41%	0.406	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-34.8	176.3	64.5	-22.8	0	0	0	113.7	F111 E116 G159	F111-D157 HydrophobicContact CE1-CB 4.45Å; F111-D157 HydrophobicContact CZ-CB 4.22Å; F111-D157 PolarHBondContact N-O 3.06Å; E116-D157 PolarHBondContact O-N 3.27Å; D157-G159 PolarHBondContact O-N 3.49Å
158	D	94.1	Very high	92.9	Very high	62 Å²	62	46.5 Å²	46.5	33%	0.332	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	1.8	177.4	81.5	-30.4	0	0	0	115.3	K105 C110 K156 T160	K105-D158 VanDerWaalsContact CE-O 3.25Å; K105-D158 WeakPolarHBondContact CE-O 3.38Å; C110-D158 PolarHBondContact SG-O 3.24Å; K156-D158 WeakPolarHBondContact CB-OD1 3.33Å; K156-D158 PolarHBondContact O-N 3.18Å; D158-T160 VanDerWaalsContact CG-OG1 3.25Å; D158-T160 WeakPolarHBondContact OD1-CB 3.45Å; D158-T160 PolarHBondContact OD1-N 3.11Å; D158-T160 PolarHBondContact OD1-OG1 2.84Å; D158-T160 PolarHBondContact OD2-OG1 2.94Å
159	G	93.8	Very high	93.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	84.1	5.5	-176.6	0	0	0	0	0	114.3	D106 K156 D157 L161	D106-G159 PolarHBondContact N-O 2.94Å; D106-G159 WeakPolarHBondContact O-CA 3.5Å; K156-G159 PolarHBondContact O-N 2.91Å; D157-G159 PolarHBondContact O-N 3.49Å; G159-L161 PolarHBondContact O-N 2.89Å
160	T	95.9	Very high	93.9	Very high	28 Å²	28	40.1 Å²	40.1	17%	0.172	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.3	174.8	-60	0	0	0	0	110.5	S103 K156 D158	S103-T160 WeakPolarHBondContact OG-CG2 3.24Å; K156-T160 PolarHBondContact N-O 2.98Å; D158-T160 VanDerWaalsContact CG-OG1 3.25Å; D158-T160 WeakPolarHBondContact OD1-CB 3.45Å; D158-T160 PolarHBondContact OD1-N 3.11Å; D158-T160 PolarHBondContact OD1-OG1 2.84Å; D158-T160 PolarHBondContact OD2-OG1 2.94Å
161	L	95.4	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	143	174.9	-71.4	165.9	0	0	0	110.5	S103 W104 D106 L109 I128 L153 R154 L155 G159	S103-L161 WeakPolarHBondContact CA-O 3.49Å; S103-L161 WeakPolarHBondContact CB-O 3.49Å; S103-L161 PolarHBondContact OG-O 3.46Å; W104-L161 HydrophobicContact CD2-CB 4.26Å; W104-L161 HydrophobicContact CH2-CB 4.49Å; W104-L161 HydrophobicContact CZ2-CB 4.1Å; W104-L161 HydrophobicContact CZ2-CD1 3.62Å; W104-L161 PolarHBondContact N-O 2.84Å; W104-L161 PolarHBondContact O-N 2.78Å; D106-L161 HydrophobicContact CB-CD1 4.25Å; L109-L161 HydrophobicContact CD1-CD1 3.73Å; L109-L161 HydrophobicContact CD1-CD2 4.35Å; L109-L161 HydrophobicContact CD1-CG 4.38Å; I128-L161 HydrophobicContact CG2-CD1 3.93Å; L153-L161 HydrophobicContact CD1-CB 4.48Å; L153-L161 HydrophobicContact CD1-CD2 3.93Å; L153-L161 HydrophobicContact CD2-CD2 4.32Å; L153-L161 HydrophobicContact CG-CD2 4.14Å; R154-L161 CarbonylContact O-C 3.48Å; R154-L161 WeakPolarHBondContact O-CA 3.22Å; L155-L161 HydrophobicContact CB-CD2 3.85Å; L155-L161 HydrophobicContact CD1-CD2 3.52Å; L155-L161 HydrophobicContact CD1-CG 3.96Å; L155-L161 HydrophobicContact CG-CD2 4.21Å; G159-L161 PolarHBondContact O-N 2.89Å
162	L	95.2	Very high	94.7	Very high	59 Å²	59	37.4 Å²	37.4	31%	0.309	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	113	165.2	173.7	67.5	0	0	0	107.8	Q102 L153 R154	Q102-L162 WeakPolarHBondContact O-CA 3.47Å; L153-L162 CarbonylContact C-O 3.59Å; L153-L162 WeakPolarHBondContact CA-O 3.45Å; R154-L162 HydrophobicContact CB-CB 4.34Å; R154-L162 PolarHBondContact N-O 2.98Å; R154-L162 PolarHBondContact O-N 2.97Å
163	Y	95.2	Very high	95	Very high	12 Å²	12	34.3 Å²	34.3	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.8	177.1	-177.7	-127.6	0	0	0	109.2	R101 Q102 W104 T130 K151 L152 L153 M165	R101-Y163 WeakPolarHBondContact CA-O 3.45Å; Q102-Y163 PolarHBondContact N-O 3.42Å; Q102-Y163 PolarHBondContact O-N 2.99Å; W104-Y163 HydrophobicContact CH2-CD1 4.28Å; W104-Y163 HydrophobicContact CH2-CG 4.13Å; W104-Y163 HydrophobicContact CZ3-CD1 4.38Å; W104-Y163 HydrophobicContact CZ3-CG 4.36Å; T130-Y163 HydrophobicContact CG2-CE1 4.35Å; K151-Y163 HydrophobicContact CB-CE2 4.15Å; K151-Y163 HydrophobicContact CD-CE2 4.21Å; K151-Y163 WeakPolarHBondContact CD-OH 3.23Å; K151-Y163 VanDerWaalsContact CE-OH 3.28Å; K151-Y163 WeakPolarHBondContact CE-OH 3.33Å; K151-Y163 HydrophobicContact CG-CE2 4.26Å; K151-Y163 PolarHBondContact NZ-OH 2.82Å; L152-Y163 CarbonylContact O-C 3.56Å; L152-Y163 WeakPolarHBondContact O-CA 3.3Å; L153-Y163 HydrophobicContact CD1-CD2 4.02Å; L153-Y163 HydrophobicContact CD1-CG 4.37Å; Y163-M165 HydrophobicContact CD1-CE 3.88Å; Y163-M165 HydrophobicContact CE1-CE 3.08Å
164	T	94.6	Very high	94.9	Very high	17 Å²	17	38.6 Å²	38.6	10%	0.104	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.1	178.4	-60.9	0	0	0	0	109.5	F99 F100 R101 K151 L152	F99-T164 HydrophobicContact CB-CG2 4.36Å; F99-T164 HydrophobicContact CD1-CG2 4.26Å; F100-T164 WeakPolarHBondContact O-CA 3.48Å; R101-T164 HydrophobicContact CG-CG2 3.86Å; R101-T164 WeakPolarHBondContact CG-OG1 3.36Å; K151-T164 CarbonylContact C-O 3.57Å; K151-T164 WeakPolarHBondContact CA-O 3.39Å; L152-T164 PolarHBondContact N-O 3.31Å; L152-T164 PolarHBondContact O-N 2.69Å
165	M	93.4	Very high	94.8	Very high	32 Å²	32	33.9 Å²	33.9	16%	0.158	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.1	173.4	60.5	177.1	79.2	0	0	111	F99 F100 N150 K151 Y163 L167	F99-M165 CarbonylContact C-O 3.53Å; F99-M165 WeakPolarHBondContact CA-O 3.4Å; F100-M165 HydrophobicContact CB-CG 3.94Å; F100-M165 HydrophobicContact CD1-CG 4.32Å; F100-M165 HydrophobicContact CD1-SD 4.38Å; F100-M165 PolarHBondContact N-O 2.79Å; F100-M165 PolarHBondContact O-N 3.38Å; N150-M165 WeakPolarHBondContact O-CA 3.37Å; K151-M165 HydrophobicContact CG-CB 4.49Å; Y163-M165 HydrophobicContact CD1-CE 3.88Å; Y163-M165 HydrophobicContact CE1-CE 3.08Å; M165-L167 HydrophobicContact CG-CD1 4.1Å; M165-L167 HydrophobicContact CG-CD2 4.18Å; M165-L167 HydrophobicContact CG-CG 3.89Å; M165-L167 HydrophobicContact SD-CD1 3.66Å; M165-L167 HydrophobicContact SD-CD2 3.72Å; M165-L167 HydrophobicContact SD-CG 3.82Å
166	R	94.6	Very high	94.6	Very high	86 Å²	86	38.6 Å²	38.6	33%	0.325	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	121.5	169.1	-170.4	-175.7	171.2	-176.3	-2.4	109.7	V98 F99 H144 N150	V98-R166 WeakPolarHBondContact O-CA 3.25Å; F99-R166 HydrophobicContact CD1-CB 3.91Å; F99-R166 HydrophobicContact CD1-CG 4.23Å; F99-R166 HydrophobicContact CE1-CB 3.72Å; F99-R166 HydrophobicContact CE1-CG 3.92Å; F99-R166 HydrophobicContact CZ-CG 4.39Å; H144-R166 PolarHBondContact N-O 2.97Å; N150-R166 HydrophobicContact CB-CB 3.95Å; N150-R166 PolarHBondContact O-N 2.96Å
167	L	95.4	Very high	94.4	Very high	14 Å²	14	34 Å²	34	7%	0.073	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.8	-179.7	-60	178.8	0	0	0	110.8	D97 V98 F100 F135 I142 A143 M165 I169	D97-L167 WeakPolarHBondContact CA-O 3.39Å; V98-L167 HydrophobicContact CG2-CB 4.06Å; V98-L167 PolarHBondContact N-O 3.25Å; V98-L167 PolarHBondContact O-N 3.3Å; F100-L167 HydrophobicContact CB-CD1 4.12Å; F135-L167 HydrophobicContact CE2-CD1 3.68Å; F135-L167 HydrophobicContact CZ-CD1 4.01Å; I142-L167 WeakPolarHBondContact O-CA 3.41Å; A143-L167 HydrophobicContact CB-CD2 3.78Å; M165-L167 HydrophobicContact CG-CD1 4.1Å; M165-L167 HydrophobicContact CG-CD2 4.18Å; M165-L167 HydrophobicContact CG-CG 3.89Å; M165-L167 HydrophobicContact SD-CD1 3.66Å; M165-L167 HydrophobicContact SD-CD2 3.72Å; M165-L167 HydrophobicContact SD-CG 3.82Å; L167-I169 HydrophobicContact CB-CD1 4.2Å; L167-I169 HydrophobicContact CB-CG1 4.02Å; L167-I169 HydrophobicContact CD1-CD1 4.34Å
168	T	95.6	Very high	94.3	Very high	25 Å²	25	34.7 Å²	34.7	15%	0.153	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.4	158.5	-62.8	0	0	0	0	107.7	I96 D97 S141 I142 H144	I96-T168 WeakPolarHBondContact O-CA 3.4Å; D97-T168 VanDerWaalsContact OD1-CB 3.28Å; D97-T168 WeakPolarHBondContact OD1-CB 3.4Å; D97-T168 VanDerWaalsContact OD1-CG2 3.27Å; D97-T168 WeakPolarHBondContact OD1-CG2 3.35Å; D97-T168 PolarHBondContact OD1-OG1 2.89Å; S141-T168 CarbonylContact C-O 3.6Å; S141-T168 WeakPolarHBondContact CA-O 3.46Å; I142-T168 PolarHBondContact N-O 3.32Å; I142-T168 PolarHBondContact O-N 2.73Å; H144-T168 PolarHBondContact CE1-OG1 2.96Å; H144-T168 PolarHBondContact NE2-OG1 2.78Å
169	I	96.2	Very high	94.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.1	-174.6	-58.1	156.4	0	0	0	108.2	T95 I96 V98 F135 L167 A171 L189	T95-I169 CarbonylContact C-O 3.56Å; T95-I169 WeakPolarHBondContact CA-O 3.46Å; I96-I169 HydrophobicContact CG2-CB 3.94Å; I96-I169 PolarHBondContact N-O 2.7Å; I96-I169 PolarHBondContact O-N 2.76Å; V98-I169 HydrophobicContact CG2-CD1 3.66Å; F135-I169 HydrophobicContact CD1-CD1 4.12Å; F135-I169 HydrophobicContact CD2-CD1 4.14Å; F135-I169 HydrophobicContact CD2-CG1 4.29Å; F135-I169 HydrophobicContact CE1-CD1 3.55Å; F135-I169 HydrophobicContact CE2-CD1 3.58Å; F135-I169 HydrophobicContact CE2-CG1 4.03Å; F135-I169 HydrophobicContact CG-CD1 4.4Å; F135-I169 HydrophobicContact CG-CG2 4.31Å; F135-I169 HydrophobicContact CZ-CD1 3.26Å; F135-I169 HydrophobicContact CZ-CG1 4.21Å; L167-I169 HydrophobicContact CB-CD1 4.2Å; L167-I169 HydrophobicContact CB-CG1 4.02Å; L167-I169 HydrophobicContact CD1-CD1 4.34Å; I169-A171 HydrophobicContact CG2-CB 4.21Å; I169-L189 HydrophobicContact CG2-CD1 4.12Å
170	S	96.1	Very high	94.2	Very high	18 Å²	18	33.4 Å²	33.4	13%	0.126	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	106	163.7	-61	0	0	0	0	107.9	Y94 T95 K139 K140	Y94-S170 WeakPolarHBondContact O-CA 3.48Å; T95-S170 WeakPolarHBondContact CG2-OG 3.34Å; K139-S170 PolarHBondContact N-O 3.17Å; K140-S170 PolarHBondContact N-O 3.34Å; K140-S170 WeakPolarHBondContact O-CA 3.28Å; K140-S170 VanDerWaalsContact O-CB 3.3Å; K140-S170 WeakPolarHBondContact O-CB 3.5Å; K140-S170 PolarHBondContact O-N 3Å
171	A	96.4	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	144.6	-179	0	0	0	0	0	111.1	E93 Y94 N137 I169 L189	E93-A171 VanDerWaalsContact CA-O 3.27Å; E93-A171 WeakPolarHBondContact CA-O 3.44Å; E93-A171 WeakPolarHBondContact CB-O 3.13Å; Y94-A171 HydrophobicContact CD1-CB 4.36Å; Y94-A171 VanDerWaalsContact CD1-O 3.3Å; Y94-A171 WeakPolarHBondContact CD1-O 3.33Å; Y94-A171 HydrophobicContact CE1-CB 3.67Å; Y94-A171 HydrophobicContact CE2-CB 4.4Å; Y94-A171 PolarHBondContact N-O 2.83Å; Y94-A171 PolarHBondContact O-N 2.78Å; N137-A171 CarbonylContact O-C 3.52Å; N137-A171 WeakPolarHBondContact O-CA 3.4Å; I169-A171 HydrophobicContact CG2-CB 4.21Å; A171-L189 HydrophobicContact CB-CD1 4.08Å
172	E	96.1	Very high	93.9	Very high	88 Å²	88	33.5 Å²	33.5	41%	0.411	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	133.5	173.9	-173	175.3	172.3	0	0	110.4	N137	N137-E172 HydrophobicContact CB-CB 4.46Å; N137-E172 PolarHBondContact ND2-O 2.84Å; N137-E172 PolarHBondContact O-N 3.43Å
173	C	95.3	Very high	93.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.			trans	-125.3	104.9	172.9	177.4	0	0	0	0	108.9	M92 Y94 M175 C187	M92-C173 PolarHBondContact O-N 3.35Å; Y94-C173 HydrophobicContact CD1-CB 3.61Å; Y94-C173 HydrophobicContact CE1-CB 3.94Å; C173-M175 HydrophobicContact CB-CE 4.21Å; C173-M175 PolarHBondContact O-N 3.02Å; C173-M175 VanDerWaalsContact O-N 3.09Å; C173-C187 HydrophobicContact CB-CB 3.68Å; C173-C187 WeakPolarHBondContact CB-SG 3.39Å; C173-C187 WeakPolarHBondContact SG-CA 3.41Å; C173-C187 WeakPolarHBondContact SG-CB 3.36Å; C173-C187 CovalentContact SG-SG 2.04Å; C173-C187 PolarHBondContact SG-SG 3.11Å
174	P	92.1	Very high	93.6	Very high	90 Å²	90	31.2 Å²	31.2	58%	0.584	16%	0.16	S	C	*	.			trans	-69	109.5	176.4	27.9	-32.5	0	0	0	109.3
175	M	91	Very high	93.5	Very high	9 Å²	9	30.9 Å²	30.9	4%	0.044	16%	0.157	C	C	.	.			trans	-99.6	138	-179	-62.8	176.7	-164.2	0	0	111	V87 C173 L177	V87-M175 HydrophobicContact CG1-CE 3.38Å; C173-M175 HydrophobicContact CB-CE 4.21Å; C173-M175 PolarHBondContact O-N 3.02Å; C173-M175 VanDerWaalsContact O-N 3.09Å; M175-L177 HydrophobicContact CB-CD2 4.14Å; M175-L177 HydrophobicContact CB-CG 4.38Å
176	Q	90.8	Very high	93.5	Very high	99 Å²	99	30.1 Å²	30.1	46%	0.463	16%	0.156	S	C	.	.			trans	-102.4	113.7	168	-166.8	65	8.1	0	0	109.3	E178 H185 Y316	Q176-E178 HydrophobicContact CG-CG 4.05Å; Q176-E178 PolarHBondContact NE2-OE1 2.88Å; Q176-H185 PolarHBondContact O-CE1 2.93Å; Q176-H185 VanDerWaalsContact O-CE1 3.29Å; Q176-Y316 PolarHBondContact OE1-OH 2.91Å
177	L	91.9	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.			trans	-101.6	20.7	-170.6	-59.8	175.9	0	0	0	112.8	M175 D179 F180 D183 P312 V314 Y316 T318	M175-L177 HydrophobicContact CB-CD2 4.14Å; M175-L177 HydrophobicContact CB-CG 4.38Å; L177-D179 VanDerWaalsContact C-N 3.3Å; L177-D179 PolarHBondContact O-N 3.14Å; L177-F180 HydrophobicContact CB-CB 4.22Å; L177-F180 HydrophobicContact CD2-CD2 4.27Å; L177-F180 VanDerWaalsContact O-CB 3.26Å; L177-F180 WeakPolarHBondContact O-CB 3.33Å; L177-F180 PolarHBondContact O-N 3.44Å; L177-D183 VanDerWaalsContact CD2-OD2 3.31Å; L177-D183 WeakPolarHBondContact CD2-OD2 3.48Å; L177-P312 HydrophobicContact CD1-CG 3.29Å; L177-V314 HydrophobicContact CD1-CG1 4.03Å; L177-Y316 HydrophobicContact CB-CE2 4.3Å; L177-Y316 PolarHBondContact N-OH 3.48Å; L177-T318 WeakPolarHBondContact O-CG2 3.24Å
178	E	91.6	Very high	93.6	Very high	90 Å²	90	26.1 Å²	26.1	42%	0.421	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-46.1	178.9	-74.5	176.5	-156.5	0	0	111.3	Q176 F180 Y316 T318 A319	Q176-E178 HydrophobicContact CG-CG 4.05Å; Q176-E178 PolarHBondContact NE2-OE1 2.88Å; E178-F180 VanDerWaalsContact C-N 3.3Å; E178-F180 PolarHBondContact O-N 2.8Å; E178-Y316 HydrophobicContact CG-CD2 4.06Å; E178-Y316 HydrophobicContact CG-CE2 3.95Å; E178-T318 CarbonylContact O-C 3.38Å; E178-A319 PolarHBondContact O-N 2.89Å
179	D	92.6	Very high	93.6	Very high	33 Å²	33	25 Å²	25	18%	0.176	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	16.6	-178.8	-66.1	-45.6	0	0	0	113	L177 M182 Y448 R451	L177-D179 VanDerWaalsContact C-N 3.3Å; L177-D179 PolarHBondContact O-N 3.14Å; D179-M182 CarbonylContact O-C 3.56Å; D179-M182 WeakPolarHBondContact O-CA 3.36Å; D179-M182 PolarHBondContact O-N 3.21Å; D179-Y448 WeakPolarHBondContact OD1-CD1 3.28Å; D179-Y448 WeakPolarHBondContact OD1-CE1 3.42Å; D179-R451 IonicContact OD1-CZ 3.79Å; D179-R451 IonicContact OD1-NH1 2.97Å; D179-R451 PolarHBondContact OD1-NH1 3.06Å; D179-R451 IonicContact OD2-CZ 2.87Å; D179-R451 IonicContact OD2-NE 2.88Å; D179-R451 IonicContact OD2-NH1 2.7Å; D179-R451 PolarHBondContact OD2-NH1 2.87Å
180	F	92.6	Very high	93.6	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	131.4	-179.1	178.1	-86.6	0	0	0	111.6	L177 E178 F260 L311 T318 M320	L177-F180 HydrophobicContact CB-CB 4.22Å; L177-F180 HydrophobicContact CD2-CD2 4.27Å; L177-F180 VanDerWaalsContact O-CB 3.26Å; L177-F180 WeakPolarHBondContact O-CB 3.33Å; L177-F180 PolarHBondContact O-N 3.44Å; E178-F180 VanDerWaalsContact C-N 3.3Å; E178-F180 PolarHBondContact O-N 2.8Å; F180-F260 HydrophobicContact CE1-CD1 4.41Å; F180-F260 HydrophobicContact CE1-CE1 4.01Å; F180-F260 HydrophobicContact CE1-CZ 4.34Å; F180-F260 HydrophobicContact CE2-CE1 4.47Å; F180-F260 HydrophobicContact CE2-CZ 4.05Å; F180-F260 HydrophobicContact CZ-CD1 4.29Å; F180-F260 AromaticContact CZ-CE1 3.49Å; F180-F260 HydrophobicContact CZ-CE1 3.49Å; F180-F260 VanDerWaalsContact CZ-CE1 3.49Å; F180-F260 HydrophobicContact CZ-CE2 4.3Å; F180-F260 AromaticContact CZ-CZ 3.48Å; F180-F260 HydrophobicContact CZ-CZ 3.48Å; F180-F260 VanDerWaalsContact CZ-CZ 3.48Å; F180-L311 HydrophobicContact CD1-CD1 4.44Å; F180-L311 HydrophobicContact CD1-CD2 3.36Å; F180-L311 HydrophobicContact CD1-CG 4.07Å; F180-L311 HydrophobicContact CD2-CD2 4.41Å; F180-L311 HydrophobicContact CE1-CD1 3.61Å; F180-L311 HydrophobicContact CE1-CD2 3.35Å; F180-L311 HydrophobicContact CE1-CG 3.52Å; F180-L311 HydrophobicContact CE2-CD2 4.38Å; F180-L311 HydrophobicContact CE2-CG 4.28Å; F180-L311 HydrophobicContact CG-CD2 3.91Å; F180-L311 HydrophobicContact CZ-CD1 3.93Å; F180-L311 HydrophobicContact CZ-CD2 3.88Å; F180-L311 HydrophobicContact CZ-CG 3.63Å; F180-T318 HydrophobicContact CB-CG2 4.32Å; F180-M320 HydrophobicContact CD1-CB 4.15Å; F180-M320 HydrophobicContact CD1-CE 3.95Å; F180-M320 HydrophobicContact CD1-SD 4.39Å; F180-M320 HydrophobicContact CE1-CE 3.41Å; F180-M320 VanDerWaalsContact CE1-CE 3.41Å; F180-M320 HydrophobicContact CE1-SD 3.93Å; F180-M320 HydrophobicContact CZ-CE 4.42Å; F180-M320 PolarHBondContact O-N 3.29Å; F180-M320 VanDerWaalsContact O-N 3.11Å
181	P	93.3	Very high	93.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	cis	-102.5	20.4	5.7	32.6	-22.7	0	0	0	114.7	D183 I257 F260 Y265 M320	P181-D183 VanDerWaalsContact C-N 3.26Å; P181-I257 HydrophobicContact CB-CD1 4.2Å; P181-I257 HydrophobicContact CG-CD1 3.51Å; P181-F260 HydrophobicContact CB-CB 4.44Å; P181-F260 HydrophobicContact CB-CD1 4.44Å; P181-F260 HydrophobicContact CB-CD2 3.46Å; P181-F260 VanDerWaalsContact CB-CD2 3.46Å; P181-F260 HydrophobicContact CB-CE2 3.72Å; P181-F260 HydrophobicContact CB-CG 3.86Å; P181-F260 HydrophobicContact CB-CZ 4.29Å; P181-F260 HydrophobicContact CG-CB 3.81Å; P181-F260 HydrophobicContact CG-CD1 4.39Å; P181-F260 HydrophobicContact CG-CD2 3.8Å; P181-F260 HydrophobicContact CG-CE2 4.5Å; P181-F260 HydrophobicContact CG-CG 3.73Å; P181-Y265 WeakPolarHBondContact CD-OH 3.32Å; P181-Y265 HydrophobicContact CG-CE2 4.19Å; P181-M320 HydrophobicContact CB-CE 4.48Å; P181-M320 HydrophobicContact CG-CE 3.68Å
182	M	92.4	Very high	93.6	Very high	30 Å²	30	27 Å²	27	15%	0.148	14%	0.142	C	C	.	.	S	Bend	trans	-95.5	29.1	177.7	-69.5	163.2	-81.3	0	0	111.6	D179 I257 Y444 W445 Y448 L449	D179-M182 CarbonylContact O-C 3.56Å; D179-M182 WeakPolarHBondContact O-CA 3.36Å; D179-M182 PolarHBondContact O-N 3.21Å; M182-I257 HydrophobicContact CG-CD1 3.9Å; M182-I257 HydrophobicContact CG-CG1 4.32Å; M182-Y444 HydrophobicContact CE-CE1 3.98Å; M182-W445 HydrophobicContact CE-CZ3 4.49Å; M182-W445 HydrophobicContact SD-CE3 4.23Å; M182-W445 HydrophobicContact SD-CZ3 4.01Å; M182-Y448 HydrophobicContact CE-CG 4.13Å; M182-Y448 VanDerWaalsContact SD-CB 3.58Å; M182-L449 HydrophobicContact CG-CD2 4.19Å; M182-L449 HydrophobicContact SD-CD2 3.73Å; M182-L449 HydrophobicContact SD-CG 4.18Å
183	D	92.1	Very high	93.6	Very high	7 Å²	7	23.1 Å²	23.1	4%	0.037	13%	0.125	C	C	.	.			trans	-90	157	-173.9	51.5	-4.8	0	0	0	113.1	L177 P181 H185 R255	L177-D183 VanDerWaalsContact CD2-OD2 3.31Å; L177-D183 WeakPolarHBondContact CD2-OD2 3.48Å; P181-D183 VanDerWaalsContact C-N 3.26Å; D183-H185 IonicContact OD2-CE1 3.83Å; D183-H185 PolarHBondContact OD2-CE1 3.4Å; D183-H185 VanDerWaalsContact OD2-CE1 3.23Å; D183-H185 IonicContact OD2-NE2 3.6Å; D183-H185 PolarHBondContact OD2-NE2 3.15Å; D183-H185 VanDerWaalsContact OD2-NE2 3.12Å; D183-R255 PolarHBondContact O-N 2.78Å; D183-R255 WeakPolarHBondContact OD1-CB 3.43Å; D183-R255 WeakPolarHBondContact OD1-CD 3.38Å; D183-R255 IonicContact OD1-CZ 2.73Å; D183-R255 IonicContact OD1-NE 3.12Å; D183-R255 PolarHBondContact OD1-NE 3.4Å; D183-R255 IonicContact OD2-CZ 3.15Å; D183-R255 IonicContact OD2-NE 3.73Å; D183-R255 IonicContact OD2-NH2 2.82Å; D183-R255 PolarHBondContact OD2-NH2 3.16Å
184	A	91.9	Very high	93.5	Very high	16 Å²	16	30 Å²	30	13%	0.132	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	148.2	164.2	0	0	0	0	0	109.8	L253 K254 P453	A184-L253 CarbonylContact C-O 3.57Å; A184-L253 VanDerWaalsContact CA-O 3.23Å; A184-L253 WeakPolarHBondContact CA-O 3.27Å; A184-L253 WeakPolarHBondContact CB-O 3.44Å; A184-K254 HydrophobicContact CB-CB 4.22Å; A184-P453 HydrophobicContact CB-CB 3.53Å; A184-P453 HydrophobicContact CB-CG 3.95Å
185	H	92.4	Very high	93.6	Very high	11 Å²	11	28.2 Å²	28.2	5%	0.051	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.5	-173.7	-47.6	-54.1	0	0	0	110.3	Q176 D183 Y252 L253	Q176-H185 PolarHBondContact O-CE1 2.93Å; Q176-H185 VanDerWaalsContact O-CE1 3.29Å; D183-H185 IonicContact OD2-CE1 3.83Å; D183-H185 PolarHBondContact OD2-CE1 3.4Å; D183-H185 VanDerWaalsContact OD2-CE1 3.23Å; D183-H185 IonicContact OD2-NE2 3.6Å; D183-H185 PolarHBondContact OD2-NE2 3.15Å; D183-H185 VanDerWaalsContact OD2-NE2 3.12Å; H185-Y252 WeakPolarHBondContact O-CA 3.47Å; H185-L253 PolarHBondContact N-O 2.73Å; H185-L253 PolarHBondContact O-N 3.42Å
186	A	93.6	Very high	93.8	Very high	16 Å²	16	30 Å²	30	13%	0.132	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.5	163.3	0	0	0	0	0	108.7	P188 H250 Y252 I455	A186-P188 WeakPolarHBondContact O-CD 3.4Å; A186-H250 HydrophobicContact CB-CB 4.48Å; A186-Y252 HydrophobicContact CB-CD1 3.84Å; A186-Y252 HydrophobicContact CB-CE1 3.82Å; A186-I455 HydrophobicContact CB-CG2 3.36Å
187	C	95.4	Very high	94	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	114.6	175.5	-68.6	0	0	0	0	109.9	Y94 C173 F251 L253	Y94-C187 HydrophobicContact CD1-CB 3.91Å; Y94-C187 HydrophobicContact CE1-CB 3.67Å; C173-C187 HydrophobicContact CB-CB 3.68Å; C173-C187 WeakPolarHBondContact CB-SG 3.39Å; C173-C187 WeakPolarHBondContact SG-CA 3.41Å; C173-C187 WeakPolarHBondContact SG-CB 3.36Å; C173-C187 CovalentContact SG-SG 2.04Å; C173-C187 PolarHBondContact SG-SG 3.11Å; C187-F251 PolarHBondContact N-O 3.16Å; C187-F251 PolarHBondContact O-N 2.98Å; C187-L253 HydrophobicContact CB-CD1 4.46Å
188	P	95.6	Very high	94.1	Very high	16 Å²	16	27.7 Å²	27.7	10%	0.104	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	149.7	179.8	32.6	-34.4	0	0	0	111.2	Y94 N137 A186 K190 M248 A249	Y94-P188 VanDerWaalsContact OH-C 3.24Å; Y94-P188 PolarHBondContact OH-O 3.2Å; N137-P188 PolarHBondContact ND2-O 2.78Å; A186-P188 WeakPolarHBondContact O-CD 3.4Å; P188-K190 HydrophobicContact CB-CG 4.31Å; P188-M248 HydrophobicContact CB-CG 4.48Å; P188-M248 HydrophobicContact CB-SD 4.42Å; P188-A249 CarbonylContact C-O 3.52Å; P188-A249 WeakPolarHBondContact CA-O 3.41Å
189	L	96.2	Very high	94.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110.1	162.9	-176.4	65.7	0	0	0	106.8	I79 Y94 F135 I169 A171 M248 A249 F251	I79-L189 HydrophobicContact CD1-CD2 4.26Å; Y94-L189 WeakPolarHBondContact OH-CB 3.38Å; F135-L189 HydrophobicContact CD1-CD1 3.72Å; F135-L189 HydrophobicContact CD1-CG 4.18Å; F135-L189 HydrophobicContact CE1-CD1 4.1Å; F135-L189 HydrophobicContact CE1-CD2 4.32Å; F135-L189 HydrophobicContact CE1-CG 4.25Å; I169-L189 HydrophobicContact CG2-CD1 4.12Å; A171-L189 HydrophobicContact CB-CD1 4.08Å; L189-M248 WeakPolarHBondContact O-CA 3.3Å; L189-A249 HydrophobicContact CB-CB 4.45Å; L189-A249 PolarHBondContact N-O 3.41Å; L189-A249 PolarHBondContact O-N 2.93Å; L189-F251 HydrophobicContact CB-CE2 4.06Å; L189-F251 HydrophobicContact CD2-CE2 4.36Å
190	K	95.8	Very high	94.3	Very high	58 Å²	58	28.8 Å²	28.8	25%	0.252	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.8	-176.4	-61.5	-167.9	-178.7	-152.1	0	110.1	F135 L136 N137 P188 E235 V246 M247 M248	F135-K190 CarbonylContact C-O 3.6Å; F135-K190 VanDerWaalsContact CA-O 3.29Å; F135-K190 WeakPolarHBondContact CA-O 3.44Å; L136-K190 HydrophobicContact CB-CB 4.08Å; L136-K190 PolarHBondContact N-O 2.92Å; N137-K190 PolarHBondContact OD1-N 3.43Å; P188-K190 HydrophobicContact CB-CG 4.31Å; K190-E235 IonicContact NZ-OE2 3.48Å; K190-E235 PolarHBondContact NZ-OE2 3.04Å; K190-V246 HydrophobicContact CB-CG1 3.99Å; K190-V246 HydrophobicContact CG-CG1 4.48Å; K190-M247 WeakPolarHBondContact CA-O 3.34Å; K190-M248 HydrophobicContact CD-CE 4.03Å; K190-M248 HydrophobicContact CG-CE 4.31Å; K190-M248 HydrophobicContact CG-CG 4.07Å; K190-M248 HydrophobicContact CG-SD 4.44Å; K190-M248 VanDerWaalsContact NZ-CE 3.29Å
191	F	96.6	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.5	175.8	63.6	-85.3	0	0	0	112.3	T77 I79 F100 T133 F134 F135 W205 M247	T77-F191 HydrophobicContact CG2-CE2 4.1Å; I79-F191 HydrophobicContact CD1-CD1 4.32Å; I79-F191 HydrophobicContact CD1-CE1 3.51Å; I79-F191 HydrophobicContact CD1-CZ 3.94Å; F100-F191 AromaticContact CE2-CD2 3.94Å; F100-F191 HydrophobicContact CE2-CD2 3.94Å; F100-F191 HydrophobicContact CE2-CE1 4.33Å; F100-F191 AromaticContact CE2-CE2 3.69Å; F100-F191 HydrophobicContact CE2-CE2 3.69Å; F100-F191 HydrophobicContact CE2-CG 4.34Å; F100-F191 AromaticContact CE2-CZ 3.9Å; F100-F191 HydrophobicContact CE2-CZ 3.9Å; F100-F191 AromaticContact CZ-CD2 3.74Å; F100-F191 HydrophobicContact CZ-CD2 3.74Å; F100-F191 AromaticContact CZ-CE2 3.69Å; F100-F191 HydrophobicContact CZ-CE2 3.69Å; F100-F191 HydrophobicContact CZ-CG 4.44Å; F100-F191 HydrophobicContact CZ-CZ 4.36Å; T133-F191 HydrophobicContact CG2-CB 4.21Å; T133-F191 HydrophobicContact CG2-CD2 3.79Å; T133-F191 HydrophobicContact CG2-CG 4.44Å; F134-F191 WeakPolarHBondContact O-CA 3.46Å; F134-F191 WeakPolarHBondContact O-CB 3.45Å; F135-F191 HydrophobicContact CD1-CB 3.69Å; F135-F191 HydrophobicContact CD1-CG 4.47Å; F135-F191 HydrophobicContact CE1-CB 3.83Å; F135-F191 HydrophobicContact CE1-CD1 4.19Å; F135-F191 HydrophobicContact CE1-CG 4.19Å; F135-F191 HydrophobicContact CG-CB 4.39Å; F191-W205 AromaticContact CE1-CH2 3.8Å; F191-W205 HydrophobicContact CE1-CH2 3.8Å; F191-W205 HydrophobicContact CE1-CZ2 4.45Å; F191-W205 HydrophobicContact CE1-CZ3 4.49Å; F191-W205 AromaticContact CZ-CH2 3.69Å; F191-W205 HydrophobicContact CZ-CH2 3.69Å; F191-W205 HydrophobicContact CZ-CZ2 4.37Å; F191-W205 HydrophobicContact CZ-CZ3 4.01Å; F191-M247 HydrophobicContact CD1-CB 4.04Å; F191-M247 HydrophobicContact CD2-CB 3.86Å; F191-M247 HydrophobicContact CD2-CG 4.17Å; F191-M247 HydrophobicContact CE1-CB 3.56Å; F191-M247 HydrophobicContact CE2-CB 3.38Å; F191-M247 HydrophobicContact CE2-CG 3.58Å; F191-M247 HydrophobicContact CG-CB 4.18Å; F191-M247 HydrophobicContact CZ-CB 3.23Å; F191-M247 HydrophobicContact CZ-CG 3.84Å; F191-M247 PolarHBondContact N-O 2.94Å; F191-M247 PolarHBondContact O-N 3.49Å
192	G	96.1	Very high	94.5	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	-176.3	-178.5	0	0	0	0	0	111.9	T133 F134	T133-G192 WeakPolarHBondContact CA-O 3.32Å; F134-G192 VanDerWaalsContact CD1-O 3.31Å; F134-G192 WeakPolarHBondContact CD1-O 2.92Å; F134-G192 PolarHBondContact N-O 2.9Å; F134-G192 PolarHBondContact O-N 3.38Å; F134-G192 VanDerWaalsContact O-N 3.1Å
193	S	96.1	Very high	94.7	Very high	7 Å²	7	29.8 Å²	29.8	5%	0.049	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	142.6	171.4	173.4	0	0	0	0	110.3	D132 F134 A195 Y196	D132-S193 WeakPolarHBondContact OD1-CB 3.41Å; D132-S193 PolarHBondContact OD1-OG 3.3Å; D132-S193 PolarHBondContact OD2-OG 3.04Å; F134-S193 WeakPolarHBondContact CE1-O 3.23Å; S193-A195 PolarHBondContact OG-N 2.77Å; S193-Y196 WeakPolarHBondContact OG-CB 3.29Å; S193-Y196 WeakPolarHBondContact OG-CD2 3.39Å; S193-Y196 PolarHBondContact OG-N 3.5Å; S193-Y196 PolarHBondContact OG-O 3.11Å
194	Y	93.9	Very high	94.9	Very high	144 Å²	144	33.9 Å²	33.9	57%	0.565	18%	0.181	S	C	*	.	S	Bend	trans	-80.8	-48.3	176.9	-174.3	-97.5	0	0	0	112.8	D132 F134	D132-Y194 PolarHBondContact O-N 3.21Å; D132-Y194 PolarHBondContact OD2-N 3.21Å; F134-Y194 AromaticContact CD1-CD2 3.97Å; F134-Y194 HydrophobicContact CD1-CD2 3.97Å; F134-Y194 HydrophobicContact CD1-CG 4.31Å; F134-Y194 HydrophobicContact CD2-CD2 4.31Å; F134-Y194 VanDerWaalsContact CE1-CA 3.49Å; F134-Y194 AromaticContact CE1-CD2 3.92Å; F134-Y194 HydrophobicContact CE1-CD2 3.92Å; F134-Y194 HydrophobicContact CE1-CG 4.41Å; F134-Y194 HydrophobicContact CE2-CD2 4.24Å; F134-Y194 HydrophobicContact CG-CD2 4.17Å; F134-Y194 HydrophobicContact CZ-CD2 4.05Å
195	A	94.1	Very high	95	Very high	54 Å²	54	34.4 Å²	34.4	45%	0.446	18%	0.179	S	C	.	.	S	Bend	trans	-98.6	-36.3	-173.1	0	0	0	0	0	113.1	D132 S193 P197 Y244	D132-A195 VanDerWaalsContact OD2-CB 3.23Å; D132-A195 WeakPolarHBondContact OD2-CB 3.26Å; D132-A195 PolarHBondContact OD2-N 2.99Å; S193-A195 PolarHBondContact OG-N 2.77Å; A195-P197 WeakPolarHBondContact O-CD 3.47Å; A195-Y244 PolarHBondContact O-OH 2.97Å
196	Y	94.8	Very high	94.8	Very high	47 Å²	47	37 Å²	37	18%	0.184	20%	0.196	C	C	.	.			trans	-91.5	120.4	-168.3	-57.1	-74.8	0	0	0	112.2	R65 W129 D132 S193 E200 V201 Y244	R65-Y196 HydrophobicContact CB-CE1 4.45Å; W129-Y196 AromaticContact CZ2-CE2 3.99Å; W129-Y196 HydrophobicContact CZ2-CE2 3.99Å; W129-Y196 PolarHBondContact NE1-OH 3.01Å; D132-Y196 WeakPolarHBondContact OD1-CD2 3.22Å; S193-Y196 WeakPolarHBondContact OG-CB 3.29Å; S193-Y196 WeakPolarHBondContact OG-CD2 3.39Å; S193-Y196 PolarHBondContact OG-N 3.5Å; S193-Y196 PolarHBondContact OG-O 3.11Å; Y196-E200 HydrophobicContact CD1-CB 4.23Å; Y196-E200 WeakPolarHBondContact CD1-OE2 3.42Å; Y196-V201 VanDerWaalsContact CB-CG2 3.46Å; Y196-V201 HydrophobicContact CD1-CG2 4.28Å; Y196-V201 HydrophobicContact CD2-CG2 3.96Å; Y196-V201 HydrophobicContact CG-CB 4.42Å; Y196-V201 HydrophobicContact CG-CG2 3.65Å; Y196-Y244 VanDerWaalsContact C-CE1 3.49Å; Y196-Y244 VanDerWaalsContact O-CD1 3.23Å; Y196-Y244 WeakPolarHBondContact O-CD1 3.34Å; Y196-Y244 VanDerWaalsContact O-CE1 3.3Å; Y196-Y244 WeakPolarHBondContact O-CE1 3.31Å
197	P	95.1	Very high	94	Very high	22 Å²	22	41.7 Å²	41.7	14%	0.143	22%	0.216	C	C	.	.			trans	-74.5	175	174.5	32.3	-36.3	0	0	0	112.1	A195 S199 E200 V201 E243	A195-P197 WeakPolarHBondContact O-CD 3.47Å; P197-S199 WeakPolarHBondContact CG-OG 3.33Å; P197-S199 PolarHBondContact O-N 3.07Å; P197-S199 VanDerWaalsContact O-N 3.11Å; P197-E200 HydrophobicContact CG-CG 4.28Å; P197-E200 PolarHBondContact O-N 2.85Å; P197-V201 PolarHBondContact O-N 2.94Å; P197-E243 CarbonylContact C-O 3.47Å; P197-E243 WeakPolarHBondContact CA-O 3.34Å; P197-E243 VanDerWaalsContact CB-O 3.24Å; P197-E243 WeakPolarHBondContact CB-O 3.3Å
198	V	94.9	Very high	93.1	Very high	27 Å²	27	47.1 Å²	47.1	16%	0.164	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.2	178.6	178.2	0	0	0	0	112.8	E200 I202 E243	V198-E200 PolarHBondContact O-N 3.36Å; V198-I202 HydrophobicContact CG1-CD1 4.03Å; V198-I202 HydrophobicContact CG1-CG1 3.96Å; V198-I202 WeakPolarHBondContact O-CG1 3.23Å; V198-E243 HydrophobicContact CG2-CB 4.34Å; V198-E243 HydrophobicContact CG2-CG 4.01Å; V198-E243 WeakPolarHBondContact CG2-O 3.47Å; V198-E243 PolarHBondContact N-O 3.23Å
199	S	93	Very high	92.1	Very high	86 Å²	86	47.9 Å²	47.9	60%	0.601	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.8	175.9	59.6	0	0	0	0	114.1	P197	P197-S199 WeakPolarHBondContact CG-OG 3.33Å; P197-S199 PolarHBondContact O-N 3.07Å; P197-S199 VanDerWaalsContact O-N 3.11Å
200	E	94.4	Very high	91.1	Very high	60 Å²	60	51.5 Å²	51.5	28%	0.28	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-45.9	-176.3	-68.8	-163.5	-134	0	0	113	R65 V72 T73 Y196 P197 V198	R65-E200 IonicContact NE-OE2 3.58Å; R65-E200 PolarHBondContact NE-OE2 3.07Å; R65-E200 VanDerWaalsContact NE-OE2 3.1Å; R65-E200 PolarHBondContact NH1-O 2.97Å; R65-E200 VanDerWaalsContact NH1-O 3.14Å; V72-E200 WeakPolarHBondContact CG1-O 3.49Å; T73-E200 PolarHBondContact N-O 2.99Å; Y196-E200 HydrophobicContact CD1-CB 4.23Å; Y196-E200 WeakPolarHBondContact CD1-OE2 3.42Å; P197-E200 HydrophobicContact CG-CG 4.28Å; P197-E200 PolarHBondContact O-N 2.85Å; V198-E200 PolarHBondContact O-N 3.36Å
201	V	95.3	Very high	90.4	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	131.3	-177.4	174.5	0	0	0	0	110	T73 I75 Y196 P197 Y203	T73-V201 WeakPolarHBondContact O-CA 3.46Å; I75-V201 HydrophobicContact CD1-CG1 3.26Å; I75-V201 HydrophobicContact CG1-CG1 4.02Å; Y196-V201 VanDerWaalsContact CB-CG2 3.46Å; Y196-V201 HydrophobicContact CD1-CG2 4.28Å; Y196-V201 HydrophobicContact CD2-CG2 3.96Å; Y196-V201 HydrophobicContact CG-CB 4.42Å; Y196-V201 HydrophobicContact CG-CG2 3.65Å; P197-V201 PolarHBondContact O-N 2.94Å; V201-Y203 HydrophobicContact CG1-CD2 4.35Å; V201-Y203 HydrophobicContact CG1-CE2 3.91Å
202	I	95.6	Very high	90	Very high	47 Å²	47	54.6 Å²	54.6	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.6	175.3	-66.8	171.1	0	0	0	109.2	V72 T73 E74 I75 V198 K204	V72-I202 HydrophobicContact CG1-CB 4.3Å; V72-I202 HydrophobicContact CG1-CD1 3.75Å; V72-I202 HydrophobicContact CG1-CG1 3.69Å; T73-I202 PolarHBondContact O-N 3.1Å; E74-I202 WeakPolarHBondContact CA-O 3.1Å; I75-I202 PolarHBondContact N-O 3.29Å; V198-I202 HydrophobicContact CG1-CD1 4.03Å; V198-I202 HydrophobicContact CG1-CG1 3.96Å; V198-I202 WeakPolarHBondContact O-CG1 3.23Å; I202-K204 HydrophobicContact CG2-CG 4.17Å
203	Y	96	Very high	89.8	Confident	3 Å²	3	54.5 Å²	54.5	1%	0.012	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.3	171.7	-71.4	-95.1	0	0	0	110.7	I75 T77 T133 V201 M247	I75-Y203 HydrophobicContact CB-CD1 4.05Å; I75-Y203 HydrophobicContact CB-CE1 4.14Å; I75-Y203 HydrophobicContact CD1-CD1 4.47Å; I75-Y203 HydrophobicContact CD1-CE1 3.87Å; I75-Y203 HydrophobicContact CD1-CE2 4.23Å; I75-Y203 HydrophobicContact CG2-CD1 4.06Å; I75-Y203 HydrophobicContact CG2-CE1 3.93Å; I75-Y203 CarbonylContact O-C 3.52Å; I75-Y203 WeakPolarHBondContact O-CA 3.39Å; T77-Y203 HydrophobicContact CG2-CD1 3.65Å; T77-Y203 HydrophobicContact CG2-CE1 4.18Å; T133-Y203 HydrophobicContact CG2-CE1 4.16Å; T133-Y203 WeakPolarHBondContact OG1-CE1 3.41Å; T133-Y203 PolarHBondContact OG1-OH 3.39Å; V201-Y203 HydrophobicContact CG1-CD2 4.35Å; V201-Y203 HydrophobicContact CG1-CE2 3.91Å; Y203-M247 VanDerWaalsContact CB-CG 3.47Å; Y203-M247 VanDerWaalsContact CB-SD 3.52Å; Y203-M247 HydrophobicContact CG-CG 4.18Å
204	K	95	Very high	89.6	Confident	92 Å²	92	57.3 Å²	57.3	40%	0.4	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.7	171.8	-63.7	-170.9	-171.8	162.2	0	110.2	E74 I75 K76 T77 I202	E74-K204 HydrophobicContact CG-CD 4.07Å; E74-K204 HydrophobicContact CG-CG 4.33Å; E74-K204 IonicContact OE1-NZ 3.88Å; E74-K204 IonicContact OE2-NZ 3.84Å; E74-K204 PolarHBondContact OE2-NZ 2.87Å; I75-K204 PolarHBondContact O-N 3.44Å; K76-K204 CarbonylContact C-O 3.55Å; K76-K204 WeakPolarHBondContact CA-O 3.18Å; T77-K204 PolarHBondContact N-O 2.59Å; T77-K204 PolarHBondContact OG1-O 3.37Å; I202-K204 HydrophobicContact CG2-CG 4.17Å
205	W	94.6	Very high	89.4	Confident	27 Å²	27	51.7 Å²	51.7	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	140.9	168.7	-68	114.9	0	0	0	109.9	I79 F191 E207 A209 S212 V213 A232 G233 M247	I79-W205 HydrophobicContact CD1-CH2 4.13Å; I79-W205 HydrophobicContact CD1-CZ3 4.25Å; I79-W205 HydrophobicContact CG1-CZ3 4.18Å; F191-W205 AromaticContact CE1-CH2 3.8Å; F191-W205 HydrophobicContact CE1-CH2 3.8Å; F191-W205 HydrophobicContact CE1-CZ2 4.45Å; F191-W205 HydrophobicContact CE1-CZ3 4.49Å; F191-W205 AromaticContact CZ-CH2 3.69Å; F191-W205 HydrophobicContact CZ-CH2 3.69Å; F191-W205 HydrophobicContact CZ-CZ2 4.37Å; F191-W205 HydrophobicContact CZ-CZ3 4.01Å; W205-E207 CarbonylContact C-O 3.58Å; W205-E207 WeakPolarHBondContact CB-O 3.35Å; W205-A209 HydrophobicContact CG-CB 4.27Å; W205-S212 VanDerWaalsContact CE3-CB 3.46Å; W205-V213 HydrophobicContact CH2-CG2 3.63Å; W205-V213 HydrophobicContact CZ2-CG2 4.29Å; W205-V213 HydrophobicContact CZ3-CG2 3.77Å; W205-A232 HydrophobicContact CZ2-CB 3.9Å; W205-G233 PolarHBondContact NE1-O 2.86Å; W205-G233 VanDerWaalsContact NE1-O 3.16Å; W205-M247 HydrophobicContact CB-CE 4.4Å; W205-M247 HydrophobicContact CD2-CE 3.41Å; W205-M247 VanDerWaalsContact CD2-CE 3.41Å; W205-M247 HydrophobicContact CE3-CE 4.17Å; W205-M247 HydrophobicContact CG-CE 3.48Å; W205-M247 VanDerWaalsContact CG-CE 3.48Å; W205-M247 HydrophobicContact CZ2-CB 4.19Å; W205-M247 HydrophobicContact CZ2-CE 3.89Å
206	T	87.9	Confident	89.2	Confident	67 Å²	67	50.2 Å²	50.2	41%	0.411	28%	0.28	S	S	.	.	S	Bend	trans	-69.6	-37.7	-177.2	-50.6	0	0	0	0	112.6	K76 T77	K76-T206 HydrophobicContact CB-CG2 4.38Å; T77-T206 PolarHBondContact N-OG1 2.88Å; T77-T206 PolarHBondContact O-N 2.84Å; T77-T206 PolarHBondContact O-OG1 2.88Å; T77-T206 VanDerWaalsContact O-OG1 3.09Å
207	E	77	Confident	88.7	Confident	114 Å²	114	57.1 Å²	57.1	53%	0.533	31%	0.314	S	S	.	.	S	Bend	trans	-113.2	-177.2	170.1	-62.2	-172.8	-172.6	0	0	109.3	W205 A209 K211 S212	W205-E207 CarbonylContact C-O 3.58Å; W205-E207 WeakPolarHBondContact CB-O 3.35Å; E207-A209 PolarHBondContact O-N 2.76Å; E207-K211 HydrophobicContact CB-CB 4.15Å; E207-K211 VanDerWaalsContact OE2-CB 3.29Å; E207-K211 WeakPolarHBondContact OE2-CB 3.2Å; E207-S212 PolarHBondContact N-OG 3.37Å; E207-S212 PolarHBondContact O-OG 2.73Å
208	D	77.6	Confident	87.9	Confident	114 Å²	114	63.6 Å²	63.6	61%	0.61	34%	0.342	S	S	*	.			trans	-43.1	140.4	164.9	-63.5	-41.3	0	0	0	110	A210 K211 S212	D208-A210 PolarHBondContact O-N 2.77Å; D208-K211 PolarHBondContact O-N 2.89Å; D208-K211 IonicContact OD2-NZ 3.77Å; D208-S212 PolarHBondContact O-N 2.78Å; D208-S212 VanDerWaalsContact O-N 3.13Å; D208-S212 PolarHBondContact O-OG 2.69Å
209	A	73.6	Confident	86.8	Confident	32 Å²	32	62.9 Å²	62.9	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-50.8	-43.1	-172.3	0	0	0	0	0	112	W205 E207 K211 S212 A232	W205-A209 HydrophobicContact CG-CB 4.27Å; E207-A209 PolarHBondContact O-N 2.76Å; A209-K211 VanDerWaalsContact C-N 3.32Å; A209-K211 PolarHBondContact O-N 2.91Å; A209-S212 PolarHBondContact O-N 2.97Å; A209-A232 HydrophobicContact CB-CB 3.95Å; A209-A232 WeakPolarHBondContact CB-O 3.06Å; A209-A232 WeakPolarHBondContact O-CB 3.06Å
210	A	74.9	Confident	85.7	Confident	75 Å²	75	60.7 Å²	60.7	62%	0.62	32%	0.324	S	S	*	.	H	α-helix	trans	-62.2	-30.5	179.6	0	0	0	0	0	114.8	D208	D208-A210 PolarHBondContact O-N 2.77Å
211	K	82.8	Confident	84.5	Confident	123 Å²	123	67.9 Å²	67.9	54%	0.535	35%	0.349	S	S	.	.	H	α-helix	trans	-91.7	-16.9	179.6	-66	177.4	-177	161.5	0	112.9	E207 D208 A209 V213 V214	E207-K211 HydrophobicContact CB-CB 4.15Å; E207-K211 VanDerWaalsContact OE2-CB 3.29Å; E207-K211 WeakPolarHBondContact OE2-CB 3.2Å; D208-K211 PolarHBondContact O-N 2.89Å; D208-K211 IonicContact OD2-NZ 3.77Å; A209-K211 VanDerWaalsContact C-N 3.32Å; A209-K211 PolarHBondContact O-N 2.91Å; K211-V213 VanDerWaalsContact C-N 3.29Å; K211-V213 PolarHBondContact O-N 2.85Å; K211-V214 VanDerWaalsContact O-CG2 3.25Å; K211-V214 WeakPolarHBondContact O-CG2 3.3Å
212	S	87.3	Confident	84	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-76.5	-16	-178.3	-69.5	0	0	0	0	114.1	N78 I79 W205 E207 D208 A209	N78-S212 PolarHBondContact ND2-O 2.53Å; I79-S212 PolarHBondContact N-O 2.72Å; W205-S212 VanDerWaalsContact CE3-CB 3.46Å; E207-S212 PolarHBondContact N-OG 3.37Å; E207-S212 PolarHBondContact O-OG 2.73Å; D208-S212 PolarHBondContact O-N 2.78Å; D208-S212 VanDerWaalsContact O-N 3.13Å; D208-S212 PolarHBondContact O-OG 2.69Å; A209-S212 PolarHBondContact O-N 2.97Å
213	V	91.7	Very high	83.5	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	102.8	173.9	-174.5	0	0	0	0	109.2	I79 W205 K211 Q230 A232 A249 F251	I79-V213 HydrophobicContact CB-CG2 4.44Å; I79-V213 WeakPolarHBondContact O-CA 3.42Å; W205-V213 HydrophobicContact CH2-CG2 3.63Å; W205-V213 HydrophobicContact CZ2-CG2 4.29Å; W205-V213 HydrophobicContact CZ3-CG2 3.77Å; K211-V213 VanDerWaalsContact C-N 3.29Å; K211-V213 PolarHBondContact O-N 2.85Å; V213-Q230 HydrophobicContact CB-CG 4.41Å; V213-Q230 HydrophobicContact CG1-CG 4.14Å; V213-Q230 PolarHBondContact O-NE2 2.94Å; V213-A232 HydrophobicContact CG2-CB 3.87Å; V213-A249 HydrophobicContact CG1-CB 4.4Å; V213-A249 HydrophobicContact CG2-CB 4.04Å; V213-F251 HydrophobicContact CG1-CE1 4.15Å; V213-F251 HydrophobicContact CG1-CZ 4.15Å
214	V	91.4	Very high	83.1	Confident	65 Å²	65	78.2 Å²	78.2	39%	0.394	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	133.4	-178.1	-178.1	0	0	0	0	109.8	I79 F80 V81 K211	I79-V214 PolarHBondContact O-N 2.9Å; I79-V214 VanDerWaalsContact O-N 3.07Å; F80-V214 WeakPolarHBondContact CA-O 3.33Å; F80-V214 HydrophobicContact CD2-CB 4.1Å; F80-V214 HydrophobicContact CD2-CG1 4.18Å; F80-V214 HydrophobicContact CE2-CG1 4.12Å; V81-V214 PolarHBondContact N-O 3.32Å; K211-V214 VanDerWaalsContact O-CG2 3.25Å; K211-V214 WeakPolarHBondContact O-CG2 3.3Å
215	V	91.1	Very high	83	Confident	26 Å²	26	74 Å²	74	16%	0.158	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.6	175	-174.1	0	0	0	0	109.3	V81 L227 F251	V81-V215 HydrophobicContact CB-CB 4.37Å; V81-V215 HydrophobicContact CB-CG1 4.28Å; V81-V215 HydrophobicContact CB-CG2 4.08Å; V81-V215 HydrophobicContact CG1-CG1 4.28Å; V81-V215 HydrophobicContact CG2-CG2 4.13Å; V215-L227 HydrophobicContact CB-CD2 4.45Å; V215-L227 HydrophobicContact CG1-CD2 3.89Å; V215-L227 HydrophobicContact CG2-CD2 4.19Å; V215-F251 HydrophobicContact CG2-CE1 4.25Å
216	A	89.4	Confident	82.8	Confident	24 Å²	24	77.7 Å²	77.7	20%	0.198	40%	0.401	C	S	.	.			trans	-61	135.5	174.5	0	0	0	0	0	110.9	F80 V81 E218 G219	F80-A216 HydrophobicContact CE1-CB 4.36Å; F80-A216 HydrophobicContact CZ-CB 4.02Å; V81-A216 WeakPolarHBondContact O-CB 3.27Å; V81-A216 PolarHBondContact O-N 3.02Å; A216-E218 VanDerWaalsContact C-N 3.28Å; A216-E218 PolarHBondContact O-N 2.8Å; A216-G219 PolarHBondContact O-N 2.75Å
217	E	83.1	Confident	83	Confident	192 Å²	192	75.7 Å²	75.7	90%	0.897	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-56.8	-40.1	-176.5	-64.6	-177.6	174.2	0	0	112.6
218	E	78.9	Confident	83.6	Confident	158 Å²	158	75.4 Å²	75.4	74%	0.738	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-82.7	-16.3	177.7	-59.1	-165.6	154.5	0	0	113.4	A216 S220	A216-E218 VanDerWaalsContact C-N 3.28Å; A216-E218 PolarHBondContact O-N 2.8Å; E218-S220 PolarHBondContact O-N 3.01Å
219	G	72.8	Confident	84.2	Confident	12 Å²	12	70.8 Å²	70.8	12%	0.124	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-77.9	-1.4	-175.4	0	0	0	0	0	115.1	T82 F84 A216	T82-G219 WeakPolarHBondContact O-CA 3.29Å; F84-G219 PolarHBondContact N-O 3.24Å; A216-G219 PolarHBondContact O-N 2.75Å
220	S	69.8	Low	85.1	Confident	39 Å²	39	72.5 Å²	72.5	27%	0.273	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-95.1	6	-173.9	-177.9	0	0	0	0	114.7	E218 L222	E218-S220 PolarHBondContact O-N 3.01Å; S220-L222 VanDerWaalsContact C-N 3.35Å; S220-L222 PolarHBondContact O-N 2.97Å
221	R	68.6	Low	85.9	Confident	211 Å²	211	71.6 Å²	71.6	80%	0.796	36%	0.358	S	S	*	.			trans	-81.1	77.1	-173.4	-66.4	-174.5	-178.4	178.7	4.8	112.6
222	L	84.8	Confident	86.3	Confident	13 Å²	13	66.8 Å²	66.8	7%	0.068	34%	0.341	C	S	.	.			trans	-81.9	143.6	171.5	-65.3	169.1	0	0	0	111.6	F84 G85 S220 Y225 L253 K256	F84-L222 HydrophobicContact CB-CD1 4.45Å; F84-L222 HydrophobicContact CB-CD2 4.28Å; F84-L222 HydrophobicContact CB-CG 4.47Å; F84-L222 HydrophobicContact CD1-CD1 3.62Å; F84-L222 HydrophobicContact CD1-CD2 3.77Å; F84-L222 HydrophobicContact CD1-CG 4.19Å; F84-L222 HydrophobicContact CE1-CD1 4.14Å; F84-L222 HydrophobicContact CG-CD1 4.23Å; F84-L222 HydrophobicContact CG-CD2 4.48Å; F84-L222 WeakPolarHBondContact O-CD2 3.4Å; G85-L222 WeakPolarHBondContact O-CD2 3.02Å; S220-L222 VanDerWaalsContact C-N 3.35Å; S220-L222 PolarHBondContact O-N 2.97Å; L222-Y225 VanDerWaalsContact CB-O 3.3Å; L222-Y225 WeakPolarHBondContact CB-O 3.43Å; L222-L253 HydrophobicContact CD1-CD2 3.91Å; L222-K256 PolarHBondContact O-NZ 3.46Å
223	N	84.9	Confident	86.5	Confident	150 Å²	150	68.2 Å²	68.2	80%	0.802	36%	0.355	S	S	*	.	S	Bend	trans	-71.2	-54	-180	-69.4	-24.9	0	0	0	111.2	K256	N223-K256 WeakPolarHBondContact O-CD 3.42Å; N223-K256 PolarHBondContact O-NZ 3.01Å
224	Q	88.6	Confident	86.6	Confident	107 Å²	107	71.9 Å²	71.9	50%	0.5	38%	0.378	S	S	.	.	S	Bend	trans	-92.6	-22.2	-172.7	-67.7	173.2	-17.7	0	0	114.2	K256	Q224-K256 WeakPolarHBondContact O-CB 3.29Å; Q224-K256 PolarHBondContact O-N 3.01Å
225	Y	92.2	Very high	86.5	Confident	3 Å²	3	72.5 Å²	72.5	1%	0.012	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	162.1	-174	-74.2	-89.5	0	0	0	112.3	V87 D89 L222 L253 K254 R255 K256	V87-Y225 HydrophobicContact CB-CD2 3.98Å; V87-Y225 HydrophobicContact CB-CE2 3.88Å; V87-Y225 HydrophobicContact CG1-CD2 4.28Å; V87-Y225 HydrophobicContact CG1-CE2 3.76Å; V87-Y225 HydrophobicContact CG2-CD2 4.18Å; V87-Y225 HydrophobicContact CG2-CE2 4.48Å; D89-Y225 PolarHBondContact OD1-OH 3.28Å; L222-Y225 VanDerWaalsContact CB-O 3.3Å; L222-Y225 WeakPolarHBondContact CB-O 3.43Å; Y225-L253 HydrophobicContact CD1-CB 3.86Å; Y225-L253 HydrophobicContact CE1-CB 4.39Å; Y225-L253 HydrophobicContact CG-CB 4.44Å; Y225-K254 CarbonylContact C-O 3.48Å; Y225-K254 WeakPolarHBondContact CA-O 3.28Å; Y225-R255 HydrophobicContact CD1-CB 4.11Å; Y225-R255 HydrophobicContact CE1-CB 3.86Å; Y225-R255 HydrophobicContact CE1-CG 4.28Å; Y225-R255 VanDerWaalsContact CZ-NH1 3.32Å; Y225-R255 PolarHBondContact OH-NH1 2.9Å; Y225-R255 PolarHBondContact OH-NH2 3.28Å; Y225-K256 VanDerWaalsContact O-CE 3.29Å; Y225-K256 WeakPolarHBondContact O-CE 3.43Å
226	H	91.4	Very high	86.6	Confident	105 Å²	105	76.9 Å²	76.9	49%	0.486	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.8	161.6	-71.9	-79.4	0	0	0	108.6	I228 L253 K254 K256	H226-I228 PolarHBondContact O-N 3.3Å; H226-L253 WeakPolarHBondContact O-CA 3.26Å; H226-K254 PolarHBondContact N-O 2.74Å; H226-K254 PolarHBondContact O-N 2.68Å; H226-K256 WeakPolarHBondContact CD2-CG 3.22Å; H226-K256 VanDerWaalsContact CE1-CE 3.42Å; H226-K256 WeakPolarHBondContact CE1-CE 3.33Å; H226-K256 WeakPolarHBondContact NE2-CE 3.4Å; H226-K256 WeakPolarHBondContact NE2-CG 3.45Å
227	L	91.8	Very high	86.7	Confident	26 Å²	26	78 Å²	78	14%	0.136	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	113.5	165.7	-179.6	67.2	0	0	0	107.7	V215 F251 L253	V215-L227 HydrophobicContact CB-CD2 4.45Å; V215-L227 HydrophobicContact CG1-CD2 3.89Å; V215-L227 HydrophobicContact CG2-CD2 4.19Å; L227-F251 HydrophobicContact CD1-CB 4Å; L227-F251 HydrophobicContact CD1-CD1 4.25Å; L227-L253 HydrophobicContact CB-CD2 4.23Å; L227-L253 HydrophobicContact CD1-CD2 3.78Å
228	I	90	Very high	87.2	Confident	108 Å²	108	78 Å²	78	55%	0.554	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	-39.2	-179.9	-62.7	167.8	0	0	0	110.1	H226 Y252 K254	H226-I228 PolarHBondContact O-N 3.3Å; I228-Y252 PolarHBondContact N-O 3.44Å; I228-K254 HydrophobicContact CD1-CB 3.44Å; I228-K254 VanDerWaalsContact CD1-CB 3.44Å; I228-K254 HydrophobicContact CD1-CD 4.13Å; I228-K254 HydrophobicContact CD1-CG 4.42Å; I228-K254 HydrophobicContact CG1-CB 4.05Å
229	G	89.9	Confident	87.7	Confident	17 Å²	17	72.9 Å²	72.9	18%	0.175	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	-170.3	-179.1	0	0	0	0	0	111.7	Y252	G229-Y252 PolarHBondContact O-N 3.27Å
230	Q	91.2	Very high	88.6	Confident	67 Å²	67	77.8 Å²	77.8	31%	0.313	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	149	-177.5	73.3	-75.9	8.7	0	0	111.3	V213 H250 F251	V213-Q230 HydrophobicContact CB-CG 4.41Å; V213-Q230 HydrophobicContact CG1-CG 4.14Å; V213-Q230 PolarHBondContact O-NE2 2.94Å; Q230-H250 CarbonylContact C-O 3.46Å; Q230-H250 WeakPolarHBondContact CA-O 3.27Å; Q230-H250 WeakPolarHBondContact CB-O 3.1Å; Q230-F251 HydrophobicContact CB-CD1 3.9Å; Q230-F251 HydrophobicContact CB-CE1 4.11Å
231	T	91.8	Very high	89.5	Confident	57 Å²	57	84.8 Å²	84.8	35%	0.35	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.2	169.5	47.4	0	0	0	0	109.1	A249 H250 Y252	T231-A249 CarbonylContact O-C 3.58Å; T231-A249 WeakPolarHBondContact O-CA 3.1Å; T231-H250 PolarHBondContact N-O 2.88Å; T231-H250 PolarHBondContact O-N 2.79Å; T231-Y252 HydrophobicContact CG2-CE2 3.63Å; T231-Y252 WeakPolarHBondContact OG1-CE2 3.27Å; T231-Y252 PolarHBondContact OG1-OH 2.8Å
232	A	92.5	Very high	90.6	Very high	22 Å²	22	75.6 Å²	75.6	18%	0.182	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.1	177.3	0	0	0	0	0	109.4	W205 A209 V213 M248	W205-A232 HydrophobicContact CZ2-CB 3.9Å; A209-A232 HydrophobicContact CB-CB 3.95Å; A209-A232 WeakPolarHBondContact CB-O 3.06Å; A209-A232 WeakPolarHBondContact O-CB 3.06Å; V213-A232 HydrophobicContact CG2-CB 3.87Å; A232-M248 CarbonylContact C-O 3.44Å; A232-M248 WeakPolarHBondContact CA-O 3.16Å
233	G	91	Very high	91.1	Very high	29 Å²	29	79.2 Å²	79.2	30%	0.299	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	-178.8	-178.8	0	0	0	0	0	111.1	W205 M248	W205-G233 PolarHBondContact NE1-O 2.86Å; W205-G233 VanDerWaalsContact NE1-O 3.16Å; G233-M248 PolarHBondContact N-O 3.48Å; G233-M248 PolarHBondContact O-N 3Å; G233-M248 VanDerWaalsContact O-O 3.13Å
234	T	92.4	Very high	91.6	Very high	78 Å²	78	73.1 Å²	73.1	48%	0.479	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.9	176.7	-58.1	0	0	0	0	107.4	T245 V246 M247	T234-T245 HydrophobicContact CG2-CG2 3.63Å; T234-V246 WeakPolarHBondContact CA-O 3.43Å; T234-M247 HydrophobicContact CG2-SD 3.92Å
235	E	90.9	Very high	91.9	Very high	78 Å²	78	68.4 Å²	68.4	36%	0.364	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.2	179.4	-175.5	-178.5	-170.1	0	0	108	K190 I237 V246 M248	K190-E235 IonicContact NZ-OE2 3.48Å; K190-E235 PolarHBondContact NZ-OE2 3.04Å; E235-I237 HydrophobicContact CG-CG2 4.25Å; E235-V246 PolarHBondContact N-O 3.28Å; E235-V246 WeakPolarHBondContact O-CA 3.39Å; E235-V246 PolarHBondContact O-N 2.83Å; E235-V246 VanDerWaalsContact O-O 3.12Å; E235-M248 HydrophobicContact CB-CE 4.15Å; E235-M248 WeakPolarHBondContact OE2-CE 3.38Å
236	E	91.7	Very high	92	Very high	119 Å²	119	68.3 Å²	68.3	56%	0.556	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	123	171.3	-69	179.3	168.6	0	0	108.4
237	I	92.4	Very high	92.2	Very high	47 Å²	47	63.3 Å²	63.3	24%	0.241	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	135.8	180	69.3	169.7	0	0	0	110.2	L136 E235 E243 Y244 V246	L136-I237 HydrophobicContact CD2-CD1 3.81Å; E235-I237 HydrophobicContact CG-CG2 4.25Å; I237-E243 WeakPolarHBondContact O-CA 3.32Å; I237-Y244 PolarHBondContact N-O 2.9Å; I237-Y244 PolarHBondContact O-N 2.04Å; I237-V246 HydrophobicContact CB-CG2 4.3Å; I237-V246 HydrophobicContact CD1-CG2 3.57Å; I237-V246 HydrophobicContact CG1-CG2 3.62Å; I237-V246 HydrophobicContact CG2-CB 4.4Å; I237-V246 HydrophobicContact CG2-CG2 3.8Å
238	Y	93	Very high	92.3	Very high	192 Å²	192	63 Å²	63	75%	0.753	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.3	172.1	-174.9	-96.5	0	0	0	110.4
239	T	90.4	Very high	92.5	Very high	50 Å²	50	57.8 Å²	57.8	31%	0.307	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	162.4	173.8	-56	0	0	0	0	109.5	R241 G242	T239-R241 PolarHBondContact O-N 3.05Å; T239-G242 PolarHBondContact N-O 3.12Å; T239-G242 PolarHBondContact O-N 3.29Å; T239-G242 VanDerWaalsContact O-O 3.08Å
240	S	91.3	Very high	92.7	Very high	115 Å²	115	58.4 Å²	58.4	80%	0.804	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-21.6	175.6	56.5	0	0	0	0	115
241	R	89.1	Confident	92.9	Very high	187 Å²	187	55.2 Å²	55.2	71%	0.706	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-17.4	177.2	-63	-168.3	-175.4	102.7	1.6	114.1	T239 Y244	T239-R241 PolarHBondContact O-N 3.05Å; R241-Y244 HydrophobicContact CB-CE2 4.4Å
242	G	91.5	Very high	92.9	Very high	18 Å²	18	54.1 Å²	54.1	19%	0.186	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148	-178.4	-173.1	0	0	0	0	0	112.7	T239 Y244	T239-G242 PolarHBondContact N-O 3.12Å; T239-G242 PolarHBondContact O-N 3.29Å; T239-G242 VanDerWaalsContact O-O 3.08Å; G242-Y244 WeakPolarHBondContact O-CD2 3.4Å; G242-Y244 WeakPolarHBondContact O-CE2 3.27Å
243	E	95.3	Very high	93	Very high	88 Å²	88	53.1 Å²	53.1	41%	0.411	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	137.5	176.1	-170.4	167.1	-141.6	0	0	110.1	P197 V198 I237	P197-E243 CarbonylContact C-O 3.47Å; P197-E243 WeakPolarHBondContact CA-O 3.34Å; P197-E243 VanDerWaalsContact CB-O 3.24Å; P197-E243 WeakPolarHBondContact CB-O 3.3Å; V198-E243 HydrophobicContact CG2-CB 4.34Å; V198-E243 HydrophobicContact CG2-CG 4.01Å; V198-E243 WeakPolarHBondContact CG2-O 3.47Å; V198-E243 PolarHBondContact N-O 3.23Å; I237-E243 WeakPolarHBondContact O-CA 3.32Å
244	Y	95.2	Very high	93	Very high	22 Å²	22	57 Å²	57	9%	0.086	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.9	-176.7	-67.5	-95.3	0	0	0	111.1	A195 Y196 I237 R241 G242	A195-Y244 PolarHBondContact O-OH 2.97Å; Y196-Y244 VanDerWaalsContact C-CE1 3.49Å; Y196-Y244 VanDerWaalsContact O-CD1 3.23Å; Y196-Y244 WeakPolarHBondContact O-CD1 3.34Å; Y196-Y244 VanDerWaalsContact O-CE1 3.3Å; Y196-Y244 WeakPolarHBondContact O-CE1 3.31Å; I237-Y244 PolarHBondContact N-O 2.9Å; I237-Y244 PolarHBondContact O-N 2.04Å; R241-Y244 HydrophobicContact CB-CE2 4.4Å; G242-Y244 WeakPolarHBondContact O-CD2 3.4Å; G242-Y244 WeakPolarHBondContact O-CE2 3.27Å
245	T	94.3	Very high	93	Very high	8 Å²	8	53.9 Å²	53.9	5%	0.049	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.2	170.1	-50.3	0	0	0	0	110.2	T234 M247	T234-T245 HydrophobicContact CG2-CG2 3.63Å; T245-M247 HydrophobicContact CG2-SD 4.25Å
246	V	95.8	Very high	93.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.3	174.8	179.3	0	0	0	0	109.4	L136 K190 T234 E235 I237	L136-V246 HydrophobicContact CD1-CG1 4.42Å; L136-V246 HydrophobicContact CD2-CG1 4.13Å; L136-V246 HydrophobicContact CD2-CG2 3.76Å; K190-V246 HydrophobicContact CB-CG1 3.99Å; K190-V246 HydrophobicContact CG-CG1 4.48Å; T234-V246 WeakPolarHBondContact CA-O 3.43Å; E235-V246 PolarHBondContact N-O 3.28Å; E235-V246 WeakPolarHBondContact O-CA 3.39Å; E235-V246 PolarHBondContact O-N 2.83Å; E235-V246 VanDerWaalsContact O-O 3.12Å; I237-V246 HydrophobicContact CB-CG2 4.3Å; I237-V246 HydrophobicContact CD1-CG2 3.57Å; I237-V246 HydrophobicContact CG1-CG2 3.62Å; I237-V246 HydrophobicContact CG2-CB 4.4Å; I237-V246 HydrophobicContact CG2-CG2 3.8Å
247	M	95.1	Very high	93.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	136.4	171.8	-56.3	-56	-68.6	0	0	108.9	K190 F191 Y203 W205 T234 T245	K190-M247 WeakPolarHBondContact CA-O 3.34Å; F191-M247 HydrophobicContact CD1-CB 4.04Å; F191-M247 HydrophobicContact CD2-CB 3.86Å; F191-M247 HydrophobicContact CD2-CG 4.17Å; F191-M247 HydrophobicContact CE1-CB 3.56Å; F191-M247 HydrophobicContact CE2-CB 3.38Å; F191-M247 HydrophobicContact CE2-CG 3.58Å; F191-M247 HydrophobicContact CG-CB 4.18Å; F191-M247 HydrophobicContact CZ-CB 3.23Å; F191-M247 HydrophobicContact CZ-CG 3.84Å; F191-M247 PolarHBondContact N-O 2.94Å; F191-M247 PolarHBondContact O-N 3.49Å; Y203-M247 VanDerWaalsContact CB-CG 3.47Å; Y203-M247 VanDerWaalsContact CB-SD 3.52Å; Y203-M247 HydrophobicContact CG-CG 4.18Å; W205-M247 HydrophobicContact CB-CE 4.4Å; W205-M247 HydrophobicContact CD2-CE 3.41Å; W205-M247 VanDerWaalsContact CD2-CE 3.41Å; W205-M247 HydrophobicContact CE3-CE 4.17Å; W205-M247 HydrophobicContact CG-CE 3.48Å; W205-M247 VanDerWaalsContact CG-CE 3.48Å; W205-M247 HydrophobicContact CZ2-CB 4.19Å; W205-M247 HydrophobicContact CZ2-CE 3.89Å; T234-M247 HydrophobicContact CG2-SD 3.92Å; T245-M247 HydrophobicContact CG2-SD 4.25Å
248	M	93.9	Very high	93.1	Very high	18 Å²	18	49.9 Å²	49.9	9%	0.089	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.5	-177	-167.3	175.7	-38.8	0	0	111.6	P188 L189 K190 A232 G233 E235 H250	P188-M248 HydrophobicContact CB-CG 4.48Å; P188-M248 HydrophobicContact CB-SD 4.42Å; L189-M248 WeakPolarHBondContact O-CA 3.3Å; K190-M248 HydrophobicContact CD-CE 4.03Å; K190-M248 HydrophobicContact CG-CE 4.31Å; K190-M248 HydrophobicContact CG-CG 4.07Å; K190-M248 HydrophobicContact CG-SD 4.44Å; K190-M248 VanDerWaalsContact NZ-CE 3.29Å; A232-M248 CarbonylContact C-O 3.44Å; A232-M248 WeakPolarHBondContact CA-O 3.16Å; G233-M248 PolarHBondContact N-O 3.48Å; G233-M248 PolarHBondContact O-N 3Å; G233-M248 VanDerWaalsContact O-O 3.13Å; E235-M248 HydrophobicContact CB-CE 4.15Å; E235-M248 WeakPolarHBondContact OE2-CE 3.38Å; M248-H250 PolarHBondContact SD-CE1 3.49Å; M248-H250 PolarHBondContact SD-NE2 2.82Å; M248-H250 VanDerWaalsContact SD-NE2 3.36Å
249	A	94.7	Very high	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.9	167.5	0	0	0	0	0	109.7	P188 L189 V213 T231 F251	P188-A249 CarbonylContact C-O 3.52Å; P188-A249 WeakPolarHBondContact CA-O 3.41Å; L189-A249 HydrophobicContact CB-CB 4.45Å; L189-A249 PolarHBondContact N-O 3.41Å; L189-A249 PolarHBondContact O-N 2.93Å; V213-A249 HydrophobicContact CG1-CB 4.4Å; V213-A249 HydrophobicContact CG2-CB 4.04Å; T231-A249 CarbonylContact O-C 3.58Å; T231-A249 WeakPolarHBondContact O-CA 3.1Å; A249-F251 HydrophobicContact CB-CE2 4.36Å; A249-F251 HydrophobicContact CB-CZ 4.44Å
250	H	93.9	Very high	93.1	Very high	29 Å²	29	46 Å²	46	13%	0.134	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.7	173.2	-68.7	106.3	0	0	0	110.3	A186 Q230 T231 M248 G457	A186-H250 HydrophobicContact CB-CB 4.48Å; Q230-H250 CarbonylContact C-O 3.46Å; Q230-H250 WeakPolarHBondContact CA-O 3.27Å; Q230-H250 WeakPolarHBondContact CB-O 3.1Å; T231-H250 PolarHBondContact N-O 2.88Å; T231-H250 PolarHBondContact O-N 2.79Å; M248-H250 PolarHBondContact SD-CE1 3.49Å; M248-H250 PolarHBondContact SD-NE2 2.82Å; M248-H250 VanDerWaalsContact SD-NE2 3.36Å; H250-G457 PolarHBondContact CE1-O 3.48Å
251	F	93.9	Very high	93.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.1	171.4	-61.4	-77.8	0	0	0	109.4	V81 F84 Y94 I96 C187 L189 V213 V215 L227 Q230 A249	V81-F251 HydrophobicContact CG2-CE1 4.11Å; V81-F251 HydrophobicContact CG2-CZ 4.04Å; F84-F251 HydrophobicContact CE2-CB 3.89Å; F84-F251 HydrophobicContact CE2-CD1 4.08Å; F84-F251 HydrophobicContact CE2-CD2 4.05Å; F84-F251 AromaticContact CE2-CG 3.73Å; F84-F251 HydrophobicContact CE2-CG 3.73Å; F84-F251 HydrophobicContact CZ-CB 4.31Å; Y94-F251 HydrophobicContact CE2-CD2 4.37Å; I96-F251 HydrophobicContact CD1-CD2 4.45Å; I96-F251 HydrophobicContact CD1-CE1 4.2Å; I96-F251 HydrophobicContact CD1-CE2 3.69Å; I96-F251 HydrophobicContact CD1-CZ 3.54Å; C187-F251 PolarHBondContact N-O 3.16Å; C187-F251 PolarHBondContact O-N 2.98Å; L189-F251 HydrophobicContact CB-CE2 4.06Å; L189-F251 HydrophobicContact CD2-CE2 4.36Å; V213-F251 HydrophobicContact CG1-CE1 4.15Å; V213-F251 HydrophobicContact CG1-CZ 4.15Å; V215-F251 HydrophobicContact CG2-CE1 4.25Å; L227-F251 HydrophobicContact CD1-CB 4Å; L227-F251 HydrophobicContact CD1-CD1 4.25Å; Q230-F251 HydrophobicContact CB-CD1 3.9Å; Q230-F251 HydrophobicContact CB-CE1 4.11Å; A249-F251 HydrophobicContact CB-CE2 4.36Å; A249-F251 HydrophobicContact CB-CZ 4.44Å
252	Y	93.3	Very high	93.5	Very high	35 Å²	35	40.1 Å²	40.1	14%	0.137	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	113.4	-179.3	-59.8	-70.4	0	0	0	110.3	H185 A186 I228 G229 T231 I455	H185-Y252 WeakPolarHBondContact O-CA 3.47Å; A186-Y252 HydrophobicContact CB-CD1 3.84Å; A186-Y252 HydrophobicContact CB-CE1 3.82Å; I228-Y252 PolarHBondContact N-O 3.44Å; G229-Y252 PolarHBondContact O-N 3.27Å; T231-Y252 HydrophobicContact CG2-CE2 3.63Å; T231-Y252 WeakPolarHBondContact OG1-CE2 3.27Å; T231-Y252 PolarHBondContact OG1-OH 2.8Å; Y252-I455 HydrophobicContact CD1-CD1 3.68Å; Y252-I455 HydrophobicContact CD1-CG2 3.94Å; Y252-I455 HydrophobicContact CE1-CD1 4.07Å; Y252-I455 HydrophobicContact CE1-CG2 3.71Å
253	L	93.1	Very high	93.4	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.6	-177.8	-60.3	177.3	0	0	0	110	F84 V87 A184 H185 C187 L222 Y225 H226 L227	F84-L253 HydrophobicContact CE1-CD1 4.08Å; F84-L253 HydrophobicContact CE1-CD2 4.22Å; F84-L253 HydrophobicContact CZ-CD1 4.06Å; F84-L253 HydrophobicContact CZ-CD2 4.2Å; V87-L253 HydrophobicContact CG2-CD1 3.89Å; A184-L253 CarbonylContact C-O 3.57Å; A184-L253 VanDerWaalsContact CA-O 3.23Å; A184-L253 WeakPolarHBondContact CA-O 3.27Å; A184-L253 WeakPolarHBondContact CB-O 3.44Å; H185-L253 PolarHBondContact N-O 2.73Å; H185-L253 PolarHBondContact O-N 3.42Å; C187-L253 HydrophobicContact CB-CD1 4.46Å; L222-L253 HydrophobicContact CD1-CD2 3.91Å; Y225-L253 HydrophobicContact CD1-CB 3.86Å; Y225-L253 HydrophobicContact CE1-CB 4.39Å; Y225-L253 HydrophobicContact CG-CB 4.44Å; H226-L253 WeakPolarHBondContact O-CA 3.26Å; L227-L253 HydrophobicContact CB-CD2 4.23Å; L227-L253 HydrophobicContact CD1-CD2 3.78Å
254	K	92.2	Very high	93.3	Very high	110 Å²	110	39 Å²	39	48%	0.478	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.1	172	176.9	170.8	-174.4	170.1	0	111	A184 Y225 H226 I228	A184-K254 HydrophobicContact CB-CB 4.22Å; Y225-K254 CarbonylContact C-O 3.48Å; Y225-K254 WeakPolarHBondContact CA-O 3.28Å; H226-K254 PolarHBondContact N-O 2.74Å; H226-K254 PolarHBondContact O-N 2.68Å; I228-K254 HydrophobicContact CD1-CB 3.44Å; I228-K254 VanDerWaalsContact CD1-CB 3.44Å; I228-K254 HydrophobicContact CD1-CD 4.13Å; I228-K254 HydrophobicContact CD1-CG 4.42Å; I228-K254 HydrophobicContact CG1-CB 4.05Å
255	R	93	Very high	93.3	Very high	12 Å²	12	38 Å²	38	5%	0.045	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	144.7	-175.4	-166	-179.3	-60.5	-85.9	12.8	111.7	D89 D183 Y225 F260	D89-R255 VanDerWaalsContact CG-NH1 3.31Å; D89-R255 IonicContact OD1-CZ 3.45Å; D89-R255 IonicContact OD1-NH1 3.3Å; D89-R255 PolarHBondContact OD1-NH1 2.82Å; D89-R255 VanDerWaalsContact OD1-NH1 3.15Å; D89-R255 IonicContact OD1-NH2 3.82Å; D89-R255 PolarHBondContact OD1-NH2 3.29Å; D89-R255 IonicContact OD2-CZ 3.32Å; D89-R255 IonicContact OD2-NH1 3.73Å; D89-R255 PolarHBondContact OD2-NH1 3.43Å; D89-R255 IonicContact OD2-NH2 3.21Å; D89-R255 PolarHBondContact OD2-NH2 3.45Å; D183-R255 PolarHBondContact O-N 2.78Å; D183-R255 WeakPolarHBondContact OD1-CB 3.43Å; D183-R255 WeakPolarHBondContact OD1-CD 3.38Å; D183-R255 IonicContact OD1-CZ 2.73Å; D183-R255 IonicContact OD1-NE 3.12Å; D183-R255 PolarHBondContact OD1-NE 3.4Å; D183-R255 IonicContact OD2-CZ 3.15Å; D183-R255 IonicContact OD2-NE 3.73Å; D183-R255 IonicContact OD2-NH2 2.82Å; D183-R255 PolarHBondContact OD2-NH2 3.16Å; Y225-R255 HydrophobicContact CD1-CB 4.11Å; Y225-R255 HydrophobicContact CE1-CB 3.86Å; Y225-R255 HydrophobicContact CE1-CG 4.28Å; Y225-R255 VanDerWaalsContact CZ-NH1 3.32Å; Y225-R255 PolarHBondContact OH-NH1 2.9Å; Y225-R255 PolarHBondContact OH-NH2 3.28Å; R255-F260 HydrophobicContact CG-CE2 4.32Å
256	K	92.4	Very high	93.3	Very high	70 Å²	70	42.4 Å²	42.4	30%	0.304	21%	0.208	S	C	.	.			trans	-82.5	115.5	171.4	-66.9	-176.2	-160.8	165.2	0	110.2	L222 N223 Q224 Y225 H226 G258	L222-K256 PolarHBondContact O-NZ 3.46Å; N223-K256 WeakPolarHBondContact O-CD 3.42Å; N223-K256 PolarHBondContact O-NZ 3.01Å; Q224-K256 WeakPolarHBondContact O-CB 3.29Å; Q224-K256 PolarHBondContact O-N 3.01Å; Y225-K256 VanDerWaalsContact O-CE 3.29Å; Y225-K256 WeakPolarHBondContact O-CE 3.43Å; H226-K256 WeakPolarHBondContact CD2-CG 3.22Å; H226-K256 VanDerWaalsContact CE1-CE 3.42Å; H226-K256 WeakPolarHBondContact CE1-CE 3.33Å; H226-K256 WeakPolarHBondContact NE2-CE 3.4Å; H226-K256 WeakPolarHBondContact NE2-CG 3.45Å; K256-G258 PolarHBondContact O-N 3.3Å
257	I	92.2	Very high	93.3	Very high	51 Å²	51	44.3 Å²	44.3	26%	0.262	22%	0.221	S	C	.	.			trans	-73	-26	-177.5	-171.3	53.7	0	0	0	114	P181 M182 Y259 F260 V261 Y265	P181-I257 HydrophobicContact CB-CD1 4.2Å; P181-I257 HydrophobicContact CG-CD1 3.51Å; M182-I257 HydrophobicContact CG-CD1 3.9Å; M182-I257 HydrophobicContact CG-CG1 4.32Å; I257-Y259 VanDerWaalsContact C-N 3.34Å; I257-Y259 PolarHBondContact O-N 3.32Å; I257-Y259 VanDerWaalsContact O-N 3.16Å; I257-F260 HydrophobicContact CD1-CB 4.44Å; I257-F260 PolarHBondContact O-N 3.34Å; I257-F260 VanDerWaalsContact O-N 3.09Å; I257-V261 HydrophobicContact CD1-CG2 4.47Å; I257-V261 HydrophobicContact CG1-CG2 3.84Å; I257-V261 WeakPolarHBondContact O-CG2 3.28Å; I257-V261 PolarHBondContact O-N 2.82Å; I257-V261 VanDerWaalsContact O-N 3.14Å; I257-Y265 HydrophobicContact CD1-CE2 4.39Å
258	G	91.3	Very high	93.3	Very high	40 Å²	40	44.3 Å²	44.3	41%	0.412	22%	0.221	S	C	.	.	H	α-helix	trans	-57.2	-36.9	-166.1	0	0	0	0	0	115.8	K256 V261 I262	K256-G258 PolarHBondContact O-N 3.3Å; G258-V261 PolarHBondContact O-N 3.11Å; G258-I262 PolarHBondContact O-N 2.77Å
259	Y	91.6	Very high	93.4	Very high	137 Å²	137	45.8 Å²	45.8	54%	0.537	23%	0.227	S	C	.	.	H	α-helix	trans	-62.7	-48.5	176.9	175.2	-106.1	0	0	0	111.9	I257 V261 I262 Q263	I257-Y259 VanDerWaalsContact C-N 3.34Å; I257-Y259 PolarHBondContact O-N 3.32Å; I257-Y259 VanDerWaalsContact O-N 3.16Å; Y259-V261 VanDerWaalsContact C-N 3.3Å; Y259-V261 PolarHBondContact O-N 3.19Å; Y259-I262 PolarHBondContact O-N 3.43Å; Y259-Q263 VanDerWaalsContact CZ-CD 3.47Å; Y259-Q263 WeakPolarHBondContact O-CB 3.47Å; Y259-Q263 PolarHBondContact O-N 2.97Å; Y259-Q263 VanDerWaalsContact OH-CD 3.26Å; Y259-Q263 PolarHBondContact OH-NE2 3.09Å; Y259-Q263 PolarHBondContact OH-OE1 2.88Å
260	F	92.8	Very high	93.4	Very high	22 Å²	22	50.4 Å²	50.4	10%	0.096	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-33.4	179.9	-59.9	-75.1	0	0	0	112.1	F180 P181 R255 I257 I262 T264 Y265 M320	F180-F260 HydrophobicContact CE1-CD1 4.41Å; F180-F260 HydrophobicContact CE1-CE1 4.01Å; F180-F260 HydrophobicContact CE1-CZ 4.34Å; F180-F260 HydrophobicContact CE2-CE1 4.47Å; F180-F260 HydrophobicContact CE2-CZ 4.05Å; F180-F260 HydrophobicContact CZ-CD1 4.29Å; F180-F260 AromaticContact CZ-CE1 3.49Å; F180-F260 HydrophobicContact CZ-CE1 3.49Å; F180-F260 VanDerWaalsContact CZ-CE1 3.49Å; F180-F260 HydrophobicContact CZ-CE2 4.3Å; F180-F260 AromaticContact CZ-CZ 3.48Å; F180-F260 HydrophobicContact CZ-CZ 3.48Å; F180-F260 VanDerWaalsContact CZ-CZ 3.48Å; P181-F260 HydrophobicContact CB-CB 4.44Å; P181-F260 HydrophobicContact CB-CD1 4.44Å; P181-F260 HydrophobicContact CB-CD2 3.46Å; P181-F260 VanDerWaalsContact CB-CD2 3.46Å; P181-F260 HydrophobicContact CB-CE2 3.72Å; P181-F260 HydrophobicContact CB-CG 3.86Å; P181-F260 HydrophobicContact CB-CZ 4.29Å; P181-F260 HydrophobicContact CG-CB 3.81Å; P181-F260 HydrophobicContact CG-CD1 4.39Å; P181-F260 HydrophobicContact CG-CD2 3.8Å; P181-F260 HydrophobicContact CG-CE2 4.5Å; P181-F260 HydrophobicContact CG-CG 3.73Å; R255-F260 HydrophobicContact CG-CE2 4.32Å; I257-F260 HydrophobicContact CD1-CB 4.44Å; I257-F260 PolarHBondContact O-N 3.34Å; I257-F260 VanDerWaalsContact O-N 3.09Å; F260-I262 PolarHBondContact O-N 3.4Å; F260-T264 WeakPolarHBondContact O-CA 3.31Å; F260-T264 WeakPolarHBondContact O-CB 3.45Å; F260-T264 PolarHBondContact O-N 2.74Å; F260-Y265 HydrophobicContact CB-CD2 4.37Å; F260-Y265 HydrophobicContact CB-CE2 4.18Å; F260-Y265 WeakPolarHBondContact O-CD2 3.22Å; F260-Y265 PolarHBondContact O-N 3.03Å; F260-M320 HydrophobicContact CB-CE 4.14Å; F260-M320 HydrophobicContact CD1-CE 3.61Å; F260-M320 HydrophobicContact CE1-CE 4.31Å; F260-M320 HydrophobicContact CG-CE 4.07Å
261	V	94	Very high	93.5	Very high	50 Å²	50	49.5 Å²	49.5	30%	0.303	25%	0.246	S	C	.	.	I	π-helix	trans	-58.2	-49.5	174.4	179.4	0	0	0	0	111	I257 G258 Y259 Y265 M266	I257-V261 HydrophobicContact CD1-CG2 4.47Å; I257-V261 HydrophobicContact CG1-CG2 3.84Å; I257-V261 WeakPolarHBondContact O-CG2 3.28Å; I257-V261 PolarHBondContact O-N 2.82Å; I257-V261 VanDerWaalsContact O-N 3.14Å; G258-V261 PolarHBondContact O-N 3.11Å; Y259-V261 VanDerWaalsContact C-N 3.3Å; Y259-V261 PolarHBondContact O-N 3.19Å; V261-Y265 PolarHBondContact O-N 2.7Å; V261-M266 WeakPolarHBondContact O-CB 3.32Å; V261-M266 PolarHBondContact O-N 2.8Å
262	I	93.3	Very high	93.6	Very high	130 Å²	130	49.5 Å²	49.5	67%	0.667	25%	0.246	S	C	*	.	I	π-helix	trans	-75.1	-41	-175.6	-63.2	171.1	0	0	0	111.2	G258 Y259 F260 P267	G258-I262 PolarHBondContact O-N 2.77Å; Y259-I262 PolarHBondContact O-N 3.43Å; F260-I262 PolarHBondContact O-N 3.4Å; I262-P267 VanDerWaalsContact O-CD 3.27Å; I262-P267 WeakPolarHBondContact O-CD 3.42Å
263	Q	90.9	Very high	93.7	Very high	75 Å²	75	51.4 Å²	51.4	35%	0.35	26%	0.258	S	S	.	.	I	π-helix	trans	-85.1	-33.2	-172.2	-163.3	-169.6	26.3	0	0	113.7	Y259 P267	Y259-Q263 VanDerWaalsContact CZ-CD 3.47Å; Y259-Q263 WeakPolarHBondContact O-CB 3.47Å; Y259-Q263 PolarHBondContact O-N 2.97Å; Y259-Q263 VanDerWaalsContact OH-CD 3.26Å; Y259-Q263 PolarHBondContact OH-NE2 3.09Å; Y259-Q263 PolarHBondContact OH-OE1 2.88Å; Q263-P267 WeakPolarHBondContact O-CG 3.4Å
264	T	92.8	Very high	93.7	Very high	7 Å²	7	55.8 Å²	55.8	4%	0.043	28%	0.281	C	S	.	.	I	π-helix	trans	-115.1	-57.6	-172.8	-50.1	0	0	0	0	111.7	F260 P267 C268 A307 M320 I324	F260-T264 WeakPolarHBondContact O-CA 3.31Å; F260-T264 WeakPolarHBondContact O-CB 3.45Å; F260-T264 PolarHBondContact O-N 2.74Å; T264-P267 WeakPolarHBondContact O-CD 3.26Å; T264-C268 WeakPolarHBondContact O-CB 3.41Å; T264-C268 PolarHBondContact O-N 3.48Å; T264-C268 VanDerWaalsContact O-N 3.14Å; T264-C268 PolarHBondContact O-SG 2.87Å; T264-A307 HydrophobicContact CG2-CB 3.96Å; T264-M320 HydrophobicContact CG2-CE 4.5Å; T264-M320 HydrophobicContact CG2-CG 4.47Å; T264-M320 HydrophobicContact CG2-SD 4.08Å; T264-I324 HydrophobicContact CG2-CD1 4.13Å
265	Y	94.8	Very high	93.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.008	26%	0.259	C	S	.	.	I	π-helix	trans	-66.8	-50	-172.9	-68.3	-85.2	0	0	0	112	P181 I257 F260 V261 C268 F269 M320 F323 Y444 W445	P181-Y265 WeakPolarHBondContact CD-OH 3.32Å; P181-Y265 HydrophobicContact CG-CE2 4.19Å; I257-Y265 HydrophobicContact CD1-CE2 4.39Å; F260-Y265 HydrophobicContact CB-CD2 4.37Å; F260-Y265 HydrophobicContact CB-CE2 4.18Å; F260-Y265 WeakPolarHBondContact O-CD2 3.22Å; F260-Y265 PolarHBondContact O-N 3.03Å; V261-Y265 PolarHBondContact O-N 2.7Å; Y265-C268 PolarHBondContact O-N 3.15Å; Y265-F269 WeakPolarHBondContact O-CB 3.49Å; Y265-F269 WeakPolarHBondContact O-CD2 3.37Å; Y265-F269 PolarHBondContact O-N 2.82Å; Y265-M320 HydrophobicContact CE2-CE 4.37Å; Y265-F323 AromaticContact CD1-CD1 3.57Å; Y265-F323 HydrophobicContact CD1-CD1 3.57Å; Y265-F323 HydrophobicContact CD1-CD2 4.13Å; Y265-F323 AromaticContact CD1-CE1 3.5Å; Y265-F323 HydrophobicContact CD1-CE1 3.5Å; Y265-F323 HydrophobicContact CD1-CE2 4.06Å; Y265-F323 AromaticContact CD1-CG 3.9Å; Y265-F323 HydrophobicContact CD1-CG 3.9Å; Y265-F323 AromaticContact CD1-CZ 3.77Å; Y265-F323 HydrophobicContact CD1-CZ 3.77Å; Y265-F323 HydrophobicContact CE1-CB 4.1Å; Y265-F323 AromaticContact CE1-CD1 3.69Å; Y265-F323 HydrophobicContact CE1-CD1 3.69Å; Y265-F323 AromaticContact CE1-CD2 3.96Å; Y265-F323 HydrophobicContact CE1-CD2 3.96Å; Y265-F323 HydrophobicContact CE1-CE1 4.11Å; Y265-F323 HydrophobicContact CE1-CE2 4.34Å; Y265-F323 AromaticContact CE1-CG 3.63Å; Y265-F323 HydrophobicContact CE1-CG 3.63Å; Y265-F323 HydrophobicContact CE1-CZ 4.43Å; Y265-F323 HydrophobicContact CG-CE1 4.46Å; Y265-Y444 AromaticContact CE1-CE1 3.7Å; Y265-Y444 HydrophobicContact CE1-CE1 3.7Å; Y265-Y444 AromaticContact CE1-CZ 3.91Å; Y265-Y444 WeakPolarHBondContact CE1-OH 3.28Å; Y265-Y444 PolarHBondContact OH-OH 3.02Å; Y265-W445 AromaticContact CD1-CH2 3.93Å; Y265-W445 HydrophobicContact CD1-CH2 3.93Å; Y265-W445 AromaticContact CD1-CZ2 3.74Å; Y265-W445 HydrophobicContact CD1-CZ2 3.74Å; Y265-W445 HydrophobicContact CD2-CH2 4.14Å; Y265-W445 HydrophobicContact CE1-CH2 4.06Å; Y265-W445 HydrophobicContact CE1-CZ2 4.14Å; Y265-W445 HydrophobicContact CE2-CH2 4.27Å; Y265-W445 AromaticContact CG-CH2 3.98Å; Y265-W445 HydrophobicContact CG-CH2 3.98Å; Y265-W445 HydrophobicContact CG-CZ2 4.01Å
266	M	95.1	Very high	93.8	Very high	100 Å²	100	51 Å²	51	49%	0.493	26%	0.261	S	S	.	.	H	α-helix	trans	-55.9	-51	179.6	-102.7	-69.8	-163.7	0	0	112.6	V261 C268 F269 M270	V261-M266 WeakPolarHBondContact O-CB 3.32Å; V261-M266 PolarHBondContact O-N 2.8Å; M266-C268 VanDerWaalsContact C-N 3.35Å; M266-C268 PolarHBondContact O-N 3.01Å; M266-F269 WeakPolarHBondContact O-CB 3.39Å; M266-F269 PolarHBondContact O-N 3.43Å; M266-M270 HydrophobicContact CE-CE 4.34Å; M266-M270 VanDerWaalsContact O-CG 3.29Å; M266-M270 WeakPolarHBondContact O-CG 3.41Å; M266-M270 PolarHBondContact O-N 2.79Å; M266-M270 HydrophobicContact SD-CE 3.63Å
267	P	95.8	Very high	93.8	Very high	41 Å²	41	51.5 Å²	51.5	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-61.4	-38.3	176	-29.1	39	0	0	0	113.9	I262 Q263 T264 M270 T271 L303	I262-P267 VanDerWaalsContact O-CD 3.27Å; I262-P267 WeakPolarHBondContact O-CD 3.42Å; Q263-P267 WeakPolarHBondContact O-CG 3.4Å; T264-P267 WeakPolarHBondContact O-CD 3.26Å; P267-M270 PolarHBondContact O-N 3.09Å; P267-T271 WeakPolarHBondContact O-CB 3.49Å; P267-T271 PolarHBondContact O-N 3.16Å; P267-T271 PolarHBondContact O-OG1 3.21Å; P267-L303 HydrophobicContact CB-CD1 3.76Å; P267-L303 HydrophobicContact CB-CD2 3.83Å; P267-L303 HydrophobicContact CB-CG 4.48Å
268	C	95.6	Very high	93.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-46.8	175.3	-69.6	0	0	0	0	111.4	T264 Y265 M266 M270 T271 V272 M300 F323	T264-C268 WeakPolarHBondContact O-CB 3.41Å; T264-C268 PolarHBondContact O-N 3.48Å; T264-C268 VanDerWaalsContact O-N 3.14Å; T264-C268 PolarHBondContact O-SG 2.87Å; Y265-C268 PolarHBondContact O-N 3.15Å; M266-C268 VanDerWaalsContact C-N 3.35Å; M266-C268 PolarHBondContact O-N 3.01Å; C268-M270 PolarHBondContact O-N 3.45Å; C268-T271 PolarHBondContact O-N 3.4Å; C268-V272 WeakPolarHBondContact O-CG2 3.46Å; C268-V272 PolarHBondContact O-N 3.33Å; C268-M300 HydrophobicContact CB-CE 4.4Å; C268-M300 HydrophobicContact CB-SD 4.48Å; C268-F323 HydrophobicContact CB-CE1 3.91Å
269	F	95	Very high	93.6	Very high	50 Å²	50	47.7 Å²	47.7	22%	0.219	24%	0.241	C	C	.	.	H	α-helix	trans	-55.5	-50.4	174.3	-98.3	-84.4	0	0	0	111.9	Y265 M266 T271 V272 I273 F323 F437 N441 W445	Y265-F269 WeakPolarHBondContact O-CB 3.49Å; Y265-F269 WeakPolarHBondContact O-CD2 3.37Å; Y265-F269 PolarHBondContact O-N 2.82Å; M266-F269 WeakPolarHBondContact O-CB 3.39Å; M266-F269 PolarHBondContact O-N 3.43Å; F269-T271 VanDerWaalsContact C-N 3.31Å; F269-T271 PolarHBondContact O-N 3.14Å; F269-V272 PolarHBondContact O-N 2.95Å; F269-I273 WeakPolarHBondContact O-CG1 3.19Å; F269-I273 PolarHBondContact O-N 3.47Å; F269-F323 AromaticContact CD2-CZ 3.76Å; F269-F323 HydrophobicContact CD2-CZ 3.76Å; F269-F323 HydrophobicContact CE2-CE2 4.08Å; F269-F323 AromaticContact CE2-CZ 3.57Å; F269-F323 HydrophobicContact CE2-CZ 3.57Å; F269-F323 HydrophobicContact CZ-CZ 4.37Å; F269-F437 AromaticContact CD1-CE1 3.53Å; F269-F437 HydrophobicContact CD1-CE1 3.53Å; F269-F437 AromaticContact CD1-CZ 3.77Å; F269-F437 HydrophobicContact CD1-CZ 3.77Å; F269-F437 AromaticContact CE1-CE1 3.79Å; F269-F437 HydrophobicContact CE1-CE1 3.79Å; F269-F437 AromaticContact CE1-CZ 3.99Å; F269-F437 HydrophobicContact CE1-CZ 3.99Å; F269-F437 HydrophobicContact CG-CE1 4.42Å; F269-F437 HydrophobicContact CG-CZ 4.3Å; F269-N441 HydrophobicContact CE1-CB 4.27Å; F269-N441 VanDerWaalsContact CE1-ND2 3.3Å; F269-N441 WeakPolarHBondContact CE1-ND2 3.18Å; F269-N441 WeakPolarHBondContact CE1-OD1 3.28Å; F269-N441 WeakPolarHBondContact CE2-OD1 3.47Å; F269-N441 HydrophobicContact CZ-CB 4.01Å; F269-N441 WeakPolarHBondContact CZ-OD1 3.41Å; F269-W445 HydrophobicContact CE2-CZ2 4.44Å; F269-W445 AromaticContact CE2-NE1 3.94Å; F269-W445 AromaticContact CZ-NE1 3.89Å
270	M	94.9	Very high	93.5	Very high	96 Å²	96	49.4 Å²	49.4	47%	0.473	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-38.5	179.8	-67.3	-61.5	162	0	0	111.6	M266 P267 C268 I273 L274	M266-M270 HydrophobicContact CE-CE 4.34Å; M266-M270 VanDerWaalsContact O-CG 3.29Å; M266-M270 WeakPolarHBondContact O-CG 3.41Å; M266-M270 PolarHBondContact O-N 2.79Å; M266-M270 HydrophobicContact SD-CE 3.63Å; P267-M270 PolarHBondContact O-N 3.09Å; C268-M270 PolarHBondContact O-N 3.45Å; M270-I273 PolarHBondContact O-N 2.9Å; M270-L274 WeakPolarHBondContact O-CB 3.39Å; M270-L274 VanDerWaalsContact O-CG 3.24Å; M270-L274 WeakPolarHBondContact O-CG 3.41Å; M270-L274 PolarHBondContact O-N 2.99Å
271	T	95.4	Very high	93.3	Very high	10 Å²	10	51.2 Å²	51.2	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-41.6	177	-56.8	0	0	0	0	111.7	P267 C268 F269 L274 S275 T296 T299 M300 V331	P267-T271 WeakPolarHBondContact O-CB 3.49Å; P267-T271 PolarHBondContact O-N 3.16Å; P267-T271 PolarHBondContact O-OG1 3.21Å; C268-T271 PolarHBondContact O-N 3.4Å; F269-T271 VanDerWaalsContact C-N 3.31Å; F269-T271 PolarHBondContact O-N 3.14Å; T271-L274 PolarHBondContact O-N 3.27Å; T271-S275 PolarHBondContact O-N 3.38Å; T271-T296 HydrophobicContact CG2-CG2 4.41Å; T271-T299 HydrophobicContact CG2-CG2 4.28Å; T271-M300 HydrophobicContact CG2-CB 4.46Å; T271-V331 HydrophobicContact CG2-CG2 4.46Å
272	V	96.3	Very high	92.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-44.9	175.3	174.6	0	0	0	0	110.6	C268 F269 L274 S275 Q276 C327 F330 V331 F437	C268-V272 WeakPolarHBondContact O-CG2 3.46Å; C268-V272 PolarHBondContact O-N 3.33Å; F269-V272 PolarHBondContact O-N 2.95Å; V272-L274 VanDerWaalsContact C-N 3.34Å; V272-L274 PolarHBondContact O-N 2.77Å; V272-S275 WeakPolarHBondContact O-CB 3.32Å; V272-S275 PolarHBondContact O-N 3.38Å; V272-S275 VanDerWaalsContact O-N 3.16Å; V272-S275 PolarHBondContact O-OG 2.91Å; V272-Q276 WeakPolarHBondContact O-CG 2.79Å; V272-Q276 PolarHBondContact O-N 2.98Å; V272-C327 HydrophobicContact CG2-CB 3.72Å; V272-F330 HydrophobicContact CG1-CB 4.13Å; V272-V331 HydrophobicContact CG2-CG2 4.07Å; V272-F437 HydrophobicContact CB-CE1 4.1Å; V272-F437 HydrophobicContact CB-CE2 4.28Å; V272-F437 HydrophobicContact CB-CZ 3.91Å; V272-F437 HydrophobicContact CG1-CD1 3.87Å; V272-F437 HydrophobicContact CG1-CD2 3.93Å; V272-F437 HydrophobicContact CG1-CE1 3.83Å; V272-F437 HydrophobicContact CG1-CE2 3.91Å; V272-F437 HydrophobicContact CG1-CG 3.92Å; V272-F437 HydrophobicContact CG1-CZ 3.85Å; V272-F437 HydrophobicContact CG2-CE2 4.14Å; V272-F437 HydrophobicContact CG2-CZ 4.08Å
273	I	94.8	Very high	92.2	Very high	76 Å²	76	49.6 Å²	49.6	39%	0.39	25%	0.245	S	C	.	.	H	α-helix	trans	-59.9	-45.6	176.2	-67.2	167.6	0	0	0	110.7	F269 M270 S275 Q276 V277	F269-I273 WeakPolarHBondContact O-CG1 3.19Å; F269-I273 PolarHBondContact O-N 3.47Å; M270-I273 PolarHBondContact O-N 2.9Å; I273-S275 VanDerWaalsContact C-N 3.28Å; I273-S275 PolarHBondContact O-N 3.49Å; I273-Q276 WeakPolarHBondContact O-CB 3.33Å; I273-Q276 PolarHBondContact O-N 2.93Å; I273-V277 WeakPolarHBondContact O-CG2 3.5Å; I273-V277 PolarHBondContact O-N 3.42Å
274	L	93.2	Very high	91.7	Very high	93 Å²	93	47.6 Å²	47.6	49%	0.487	24%	0.236	S	C	.	.	H	α-helix	trans	-59.1	-37.7	176.3	-75.4	171.8	0	0	0	112.5	M270 T271 V272 Q276 V277 T296	M270-L274 WeakPolarHBondContact O-CB 3.39Å; M270-L274 VanDerWaalsContact O-CG 3.24Å; M270-L274 WeakPolarHBondContact O-CG 3.41Å; M270-L274 PolarHBondContact O-N 2.99Å; T271-L274 PolarHBondContact O-N 3.27Å; V272-L274 VanDerWaalsContact C-N 3.34Å; V272-L274 PolarHBondContact O-N 2.77Å; L274-Q276 VanDerWaalsContact C-N 3.29Å; L274-Q276 PolarHBondContact O-N 3.24Å; L274-V277 PolarHBondContact O-N 3.27Å; L274-T296 HydrophobicContact CB-CG2 4.33Å
275	S	94.7	Very high	91.3	Very high	2 Å²	2	49 Å²	49	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-36.1	175	79.2	0	0	0	0	112	T271 V272 I273 S278	T271-S275 PolarHBondContact O-N 3.38Å; V272-S275 WeakPolarHBondContact O-CB 3.32Å; V272-S275 PolarHBondContact O-N 3.38Å; V272-S275 VanDerWaalsContact O-N 3.16Å; V272-S275 PolarHBondContact O-OG 2.91Å; I273-S275 VanDerWaalsContact C-N 3.28Å; I273-S275 PolarHBondContact O-N 3.49Å; S275-S278 WeakPolarHBondContact O-CB 3.36Å; S275-S278 PolarHBondContact O-N 2.92Å; S275-S278 PolarHBondContact O-OG 2.77Å
276	Q	93	Very high	90.9	Very high	20 Å²	20	50.8 Å²	50.8	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-77	-26.7	179	-62.4	173.6	7.3	0	0	113.1	V272 I273 L274 S278 F279 F433	V272-Q276 WeakPolarHBondContact O-CG 2.79Å; V272-Q276 PolarHBondContact O-N 2.98Å; I273-Q276 WeakPolarHBondContact O-CB 3.33Å; I273-Q276 PolarHBondContact O-N 2.93Å; L274-Q276 VanDerWaalsContact C-N 3.29Å; L274-Q276 PolarHBondContact O-N 3.24Å; Q276-S278 PolarHBondContact O-N 3.42Å; Q276-F279 HydrophobicContact CB-CD2 4.2Å; Q276-F279 HydrophobicContact CB-CE2 4.07Å; Q276-F279 HydrophobicContact CG-CE2 4.09Å; Q276-F279 WeakPolarHBondContact O-CB 3.37Å; Q276-F279 WeakPolarHBondContact O-CD2 3.27Å; Q276-F279 WeakPolarHBondContact O-CG 3.24Å; Q276-F279 PolarHBondContact O-N 3.15Å; Q276-F279 VanDerWaalsContact O-N 3.15Å; Q276-F433 HydrophobicContact CG-CB 4.22Å
277	V	92.1	Very high	90.6	Very high	80 Å²	80	50.6 Å²	50.6	49%	0.485	26%	0.263	S	S	.	.	H	α-helix	trans	-59	-28	172.9	172.2	0	0	0	0	111	I273 L274 F279 W280	I273-V277 WeakPolarHBondContact O-CG2 3.5Å; I273-V277 PolarHBondContact O-N 3.42Å; L274-V277 PolarHBondContact O-N 3.27Å; V277-F279 PolarHBondContact O-N 3.1Å; V277-F279 VanDerWaalsContact O-N 3.15Å; V277-W280 WeakPolarHBondContact O-CB 3.45Å; V277-W280 PolarHBondContact O-N 3.04Å
278	S	89.8	Confident	90.3	Very high	10 Å²	10	50.4 Å²	50.4	7%	0.07	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-59.7	-25.3	177.5	77.1	0	0	0	0	114.1	S275 Q276 W280 L281	S275-S278 WeakPolarHBondContact O-CB 3.36Å; S275-S278 PolarHBondContact O-N 2.92Å; S275-S278 PolarHBondContact O-OG 2.77Å; Q276-S278 PolarHBondContact O-N 3.42Å; S278-W280 PolarHBondContact O-N 3.07Å; S278-L281 WeakPolarHBondContact O-CB 3.47Å; S278-L281 PolarHBondContact O-N 2.72Å; S278-L281 VanDerWaalsContact O-N 3.15Å
279	F	90.5	Very high	90	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-69.8	-18.7	176.8	-53.7	-38	0	0	0	113.5	Q276 V277 A334 E337 R430 F433	Q276-F279 HydrophobicContact CB-CD2 4.2Å; Q276-F279 HydrophobicContact CB-CE2 4.07Å; Q276-F279 HydrophobicContact CG-CE2 4.09Å; Q276-F279 WeakPolarHBondContact O-CB 3.37Å; Q276-F279 WeakPolarHBondContact O-CD2 3.27Å; Q276-F279 WeakPolarHBondContact O-CG 3.24Å; Q276-F279 PolarHBondContact O-N 3.15Å; Q276-F279 VanDerWaalsContact O-N 3.15Å; V277-F279 PolarHBondContact O-N 3.1Å; V277-F279 VanDerWaalsContact O-N 3.15Å; F279-A334 HydrophobicContact CE1-CB 4.04Å; F279-A334 HydrophobicContact CZ-CB 3.79Å; F279-E337 HydrophobicContact CD1-CG 4.4Å; F279-E337 WeakPolarHBondContact CD1-OE2 3.19Å; F279-E337 HydrophobicContact CE1-CB 4.04Å; F279-E337 HydrophobicContact CE1-CG 3.84Å; F279-E337 WeakPolarHBondContact CE1-OE2 3.29Å; F279-E337 HydrophobicContact CZ-CG 4.49Å; F279-R430 HydrophobicContact CB-CG 3.89Å; F279-R430 PolarHBondContact O-NE 3.07Å; F279-R430 PolarHBondContact O-NH2 2.82Å; F279-F433 HydrophobicContact CE2-CB 3.85Å; F279-F433 HydrophobicContact CE2-CD1 4.03Å; F279-F433 HydrophobicContact CE2-CD2 4.02Å; F279-F433 AromaticContact CE2-CG 3.72Å; F279-F433 HydrophobicContact CE2-CG 3.72Å; F279-F433 AromaticContact CZ-CD1 3.93Å; F279-F433 HydrophobicContact CZ-CD1 3.93Å; F279-F433 HydrophobicContact CZ-CD2 4.11Å; F279-F433 HydrophobicContact CZ-CE1 4.04Å; F279-F433 HydrophobicContact CZ-CE2 4.22Å; F279-F433 AromaticContact CZ-CG 3.97Å; F279-F433 HydrophobicContact CZ-CG 3.97Å; F279-F433 HydrophobicContact CZ-CZ 4.18Å
280	W	89.7	Confident	89.8	Confident	173 Å²	173	50.8 Å²	50.8	66%	0.655	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-85.8	-13.9	175.5	-70.2	89.4	0	0	0	112.6	V277 S278 R430	V277-W280 WeakPolarHBondContact O-CB 3.45Å; V277-W280 PolarHBondContact O-N 3.04Å; S278-W280 PolarHBondContact O-N 3.07Å; W280-R430 HydrophobicContact CZ2-CG 4.39Å
281	L	88.3	Confident	89.8	Confident	60 Å²	60	50.6 Å²	50.6	31%	0.314	28%	0.276	S	S	.	.	S	Bend	trans	-74.4	146.3	178.1	-147.2	72.2	0	0	0	110.9	S278 R283 S285 A288 R289	S278-L281 WeakPolarHBondContact O-CB 3.47Å; S278-L281 PolarHBondContact O-N 2.72Å; S278-L281 VanDerWaalsContact O-N 3.15Å; L281-R283 PolarHBondContact O-N 3.03Å; L281-S285 WeakPolarHBondContact CD2-OG 3.3Å; L281-S285 WeakPolarHBondContact CG-OG 3.39Å; L281-A288 HydrophobicContact CD2-CB 3.56Å; L281-R289 HydrophobicContact CB-CG 4.11Å; L281-R289 HydrophobicContact CD2-CG 3.85Å
282	N	84.4	Confident	89.5	Confident	115 Å²	115	55 Å²	55	62%	0.615	29%	0.294	S	S	*	.			trans	-59	135.4	177.4	-69.6	-28.3	0	0	0	110	E284 S285	N282-E284 PolarHBondContact O-N 2.78Å; N282-E284 VanDerWaalsContact O-N 3.07Å; N282-S285 PolarHBondContact O-N 3.22Å; N282-S285 VanDerWaalsContact O-N 3.12Å; N282-S285 PolarHBondContact O-OG 2.76Å
283	R	80.1	Confident	89.3	Confident	30 Å²	30	55.3 Å²	55.3	11%	0.113	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.8	179.3	84	-173.6	88.8	66.6	-0.6	113.3	L281 V341 T345 N420 S421	L281-R283 PolarHBondContact O-N 3.03Å; R283-V341 HydrophobicContact CB-CG1 4.12Å; R283-T345 HydrophobicContact CG-CG2 4.3Å; R283-N420 VanDerWaalsContact CZ-O 3.28Å; R283-N420 PolarHBondContact NH1-O 2.93Å; R283-N420 VanDerWaalsContact NH1-O 3.11Å; R283-N420 PolarHBondContact NH2-O 3.11Å; R283-S421 VanDerWaalsContact CZ-O 3.3Å; R283-S421 PolarHBondContact NE-O 3.27Å; R283-S421 PolarHBondContact NH2-O 2.86Å
284	E	78.9	Confident	89.3	Confident	33 Å²	33	55.5 Å²	55.5	15%	0.154	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.3	-179.6	-70.3	142.5	-163.3	0	0	112.3	N282 V286 A350 W351	N282-E284 PolarHBondContact O-N 2.78Å; N282-E284 VanDerWaalsContact O-N 3.07Å; E284-V286 PolarHBondContact O-N 3.39Å; E284-A350 HydrophobicContact CB-CB 4.32Å; E284-A350 VanDerWaalsContact CD-CA 3.49Å; E284-A350 WeakPolarHBondContact OE2-CA 3.49Å; E284-W351 PolarHBondContact OE2-N 3.35Å
285	S	84.8	Confident	89.3	Confident	37 Å²	37	54.4 Å²	54.4	26%	0.259	30%	0.299	S	S	.	.			trans	-85.4	60.1	175.3	53.5	0	0	0	0	111.5	L281 N282 A288 R289	L281-S285 WeakPolarHBondContact CD2-OG 3.3Å; L281-S285 WeakPolarHBondContact CG-OG 3.39Å; N282-S285 PolarHBondContact O-N 3.22Å; N282-S285 VanDerWaalsContact O-N 3.12Å; N282-S285 PolarHBondContact O-OG 2.76Å; S285-A288 PolarHBondContact O-N 3.46Å; S285-R289 PolarHBondContact O-N 2.84Å; S285-R289 VanDerWaalsContact O-N 3.13Å
286	V	86.3	Confident	89.3	Confident	39 Å²	39	54.8 Å²	54.8	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-52.5	-47.7	179.4	-178.2	0	0	0	0	111.9	E284 A288 R289 T290 F338	E284-V286 PolarHBondContact O-N 3.39Å; V286-A288 VanDerWaalsContact C-N 3.31Å; V286-A288 PolarHBondContact O-N 2.84Å; V286-R289 PolarHBondContact O-N 3.07Å; V286-T290 PolarHBondContact O-N 3.13Å; V286-T290 PolarHBondContact O-OG1 2.9Å; V286-F338 HydrophobicContact CG1-CE2 4.32Å; V286-F338 HydrophobicContact CG1-CZ 3.78Å
287	P	89.6	Confident	89.5	Confident	96 Å²	96	55 Å²	55	62%	0.623	30%	0.304	S	S	*	.	H	α-helix	trans	-60.8	-39.5	-179.1	-23.3	35	0	0	0	113	V291	P287-V291 VanDerWaalsContact O-CG2 3.27Å; P287-V291 WeakPolarHBondContact O-CG2 3.42Å; P287-V291 PolarHBondContact O-N 3.24Å; P287-V291 VanDerWaalsContact O-N 3.1Å
288	A	89	Confident	89.6	Confident	37 Å²	37	56.3 Å²	56.3	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-47.3	178.9	0	0	0	0	0	111.3	L281 S285 V286 T290 V291 F292	L281-A288 HydrophobicContact CD2-CB 3.56Å; S285-A288 PolarHBondContact O-N 3.46Å; V286-A288 VanDerWaalsContact C-N 3.31Å; V286-A288 PolarHBondContact O-N 2.84Å; A288-T290 PolarHBondContact O-N 3.14Å; A288-V291 PolarHBondContact O-N 2.85Å; A288-F292 WeakPolarHBondContact O-CD2 2.99Å; A288-F292 PolarHBondContact O-N 3.19Å
289	R	90.4	Very high	89.9	Confident	3 Å²	3	58.5 Å²	58.5	1%	0.011	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-41.4	178.6	-69.8	-174.9	71.8	164	-5.9	112.2	L281 S285 V286 F292 G293 E337 F338 D426	L281-R289 HydrophobicContact CB-CG 4.11Å; L281-R289 HydrophobicContact CD2-CG 3.85Å; S285-R289 PolarHBondContact O-N 2.84Å; S285-R289 VanDerWaalsContact O-N 3.13Å; V286-R289 PolarHBondContact O-N 3.07Å; R289-F292 PolarHBondContact O-N 3.48Å; R289-G293 PolarHBondContact O-N 3.01Å; R289-E337 IonicContact NH2-OE2 2.89Å; R289-E337 PolarHBondContact NH2-OE2 2.96Å; R289-F338 HydrophobicContact CB-CD2 3.55Å; R289-F338 HydrophobicContact CB-CE2 3.4Å; R289-F338 VanDerWaalsContact CB-CE2 3.4Å; R289-F338 HydrophobicContact CB-CG 4.19Å; R289-F338 HydrophobicContact CB-CZ 3.94Å; R289-F338 HydrophobicContact CG-CD2 4.28Å; R289-F338 HydrophobicContact CG-CE2 4.27Å; R289-D426 IonicContact CZ-OD1 3.37Å; R289-D426 IonicContact NH1-OD1 2.92Å; R289-D426 PolarHBondContact NH1-OD1 3.35Å; R289-D426 IonicContact NH1-OD2 3.64Å; R289-D426 IonicContact NH2-OD1 2.86Å; R289-D426 PolarHBondContact NH2-OD1 2.76Å
290	T	90.8	Very high	90	Very high	56 Å²	56	58.5 Å²	58.5	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-47	176	-53.4	0	0	0	0	111.6	V286 A288 G293 V294 F338	V286-T290 PolarHBondContact O-N 3.13Å; V286-T290 PolarHBondContact O-OG1 2.9Å; A288-T290 PolarHBondContact O-N 3.14Å; T290-G293 PolarHBondContact O-N 3.42Å; T290-V294 HydrophobicContact CG2-CG2 4.32Å; T290-V294 WeakPolarHBondContact O-CG2 3.33Å; T290-V294 PolarHBondContact O-N 3.02Å; T290-F338 WeakPolarHBondContact OG1-CE1 3.32Å; T290-F338 VanDerWaalsContact OG1-CZ 3.22Å; T290-F338 WeakPolarHBondContact OG1-CZ 3.42Å
291	V	93	Very high	90.3	Very high	91 Å²	91	52.6 Å²	52.6	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-63.8	-43.7	-179.9	172.5	0	0	0	0	110.9	P287 A288 G293 T295	P287-V291 VanDerWaalsContact O-CG2 3.27Å; P287-V291 WeakPolarHBondContact O-CG2 3.42Å; P287-V291 PolarHBondContact O-N 3.24Å; P287-V291 VanDerWaalsContact O-N 3.1Å; A288-V291 PolarHBondContact O-N 2.85Å; V291-G293 PolarHBondContact O-N 3.16Å; V291-T295 WeakPolarHBondContact O-CB 3.34Å; V291-T295 PolarHBondContact O-N 3.49Å; V291-T295 PolarHBondContact O-OG1 2.92Å
292	F	90.5	Very high	90.6	Very high	103 Å²	103	53.8 Å²	53.8	45%	0.452	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-45.3	175.3	-85.5	-70.5	0	0	0	112.2	A288 R289 T296	A288-F292 WeakPolarHBondContact O-CD2 2.99Å; A288-F292 PolarHBondContact O-N 3.19Å; R289-F292 PolarHBondContact O-N 3.48Å; F292-T296 WeakPolarHBondContact O-CB 3.47Å; F292-T296 VanDerWaalsContact O-CG2 3.28Å; F292-T296 WeakPolarHBondContact O-CG2 3.46Å; F292-T296 PolarHBondContact O-N 2.94Å; F292-T296 PolarHBondContact O-OG1 3.49Å
293	G	91.6	Very high	91	Very high	7 Å²	7	50 Å²	50	7%	0.072	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-48.1	179.7	0	0	0	0	0	113.1	R289 T290 V291 T296 V297	R289-G293 PolarHBondContact O-N 3.01Å; T290-G293 PolarHBondContact O-N 3.42Å; V291-G293 PolarHBondContact O-N 3.16Å; G293-T296 PolarHBondContact O-OG1 2.84Å; G293-V297 WeakPolarHBondContact O-CG2 3.34Å; G293-V297 PolarHBondContact O-N 3.37Å
294	V	94.1	Very high	91.5	Very high	80 Å²	80	50 Å²	50	49%	0.485	30%	0.298	S	S	.	.	H	α-helix	trans	-68.2	-41.5	179.9	175.9	0	0	0	0	111.5	T290 T296 V297 L298	T290-V294 HydrophobicContact CG2-CG2 4.32Å; T290-V294 WeakPolarHBondContact O-CG2 3.33Å; T290-V294 PolarHBondContact O-N 3.02Å; V294-T296 PolarHBondContact O-N 3.41Å; V294-V297 PolarHBondContact O-N 3.43Å; V294-L298 PolarHBondContact O-N 3.06Å
295	T	94.8	Very high	92.1	Very high	70 Å²	70	53 Å²	53	43%	0.429	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-41.5	-180	-53.9	0	0	0	0	111.2	V291 V297 L298 T299	V291-T295 WeakPolarHBondContact O-CB 3.34Å; V291-T295 PolarHBondContact O-N 3.49Å; V291-T295 PolarHBondContact O-OG1 2.92Å; T295-V297 PolarHBondContact O-N 3.36Å; T295-L298 PolarHBondContact O-N 3.16Å; T295-T299 WeakPolarHBondContact O-CB 3.48Å; T295-T299 PolarHBondContact O-N 3.49Å; T295-T299 PolarHBondContact O-OG1 3.23Å
296	T	94.9	Very high	92.4	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.055	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-38.5	178	48.4	0	0	0	0	112.6	T271 L274 F292 G293 V294 T299 M300 V331	T271-T296 HydrophobicContact CG2-CG2 4.41Å; L274-T296 HydrophobicContact CB-CG2 4.33Å; F292-T296 WeakPolarHBondContact O-CB 3.47Å; F292-T296 VanDerWaalsContact O-CG2 3.28Å; F292-T296 WeakPolarHBondContact O-CG2 3.46Å; F292-T296 PolarHBondContact O-N 2.94Å; F292-T296 PolarHBondContact O-OG1 3.49Å; G293-T296 PolarHBondContact O-OG1 2.84Å; V294-T296 PolarHBondContact O-N 3.41Å; T296-T299 PolarHBondContact O-N 3.05Å; T296-M300 WeakPolarHBondContact O-CB 3.46Å; T296-M300 PolarHBondContact O-N 2.99Å; T296-V331 WeakPolarHBondContact OG1-CG1 3.33Å
297	V	95.4	Very high	92.5	Very high	24 Å²	24	52.7 Å²	52.7	15%	0.145	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-43.4	172.9	174.7	0	0	0	0	111.1	G293 V294 T295 M300 T301 Y328 V331	G293-V297 WeakPolarHBondContact O-CG2 3.34Å; G293-V297 PolarHBondContact O-N 3.37Å; V294-V297 PolarHBondContact O-N 3.43Å; T295-V297 PolarHBondContact O-N 3.36Å; V297-M300 PolarHBondContact O-N 3.36Å; V297-T301 PolarHBondContact O-N 3.25Å; V297-T301 PolarHBondContact O-OG1 3.28Å; V297-Y328 HydrophobicContact CG1-CE2 4.21Å; V297-V331 HydrophobicContact CB-CG1 4.42Å; V297-V331 HydrophobicContact CG2-CG1 3.7Å
298	L	95.4	Very high	92.3	Very high	108 Å²	108	55.4 Å²	55.4	57%	0.565	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-48.4	176.9	178.5	62.6	0	0	0	111.2	V294 T295 M300 T301 T302	V294-L298 PolarHBondContact O-N 3.06Å; T295-L298 PolarHBondContact O-N 3.16Å; L298-M300 VanDerWaalsContact C-N 3.3Å; L298-M300 PolarHBondContact O-N 2.85Å; L298-T301 WeakPolarHBondContact O-CB 3.39Å; L298-T301 PolarHBondContact O-N 3.29Å; L298-T301 VanDerWaalsContact O-N 3.15Å; L298-T302 PolarHBondContact O-N 3.1Å; L298-T302 PolarHBondContact O-OG1 2.94Å; L298-T302 VanDerWaalsContact O-OG1 3.12Å
299	T	95.3	Very high	92.2	Very high	57 Å²	57	59.8 Å²	59.8	35%	0.35	33%	0.33	S	S	.	.	H	α-helix	trans	-57.5	-44.3	176.4	-58.7	0	0	0	0	111.2	T271 T295 T296 T301 T302 L303	T271-T299 HydrophobicContact CG2-CG2 4.28Å; T295-T299 WeakPolarHBondContact O-CB 3.48Å; T295-T299 PolarHBondContact O-N 3.49Å; T295-T299 PolarHBondContact O-OG1 3.23Å; T296-T299 PolarHBondContact O-N 3.05Å; T299-T301 VanDerWaalsContact C-N 3.33Å; T299-T301 PolarHBondContact O-N 3.18Å; T299-T302 PolarHBondContact O-N 3.02Å; T299-L303 HydrophobicContact CG2-CD1 4.24Å; T299-L303 WeakPolarHBondContact O-CG 3.42Å; T299-L303 PolarHBondContact O-N 3Å
300	M	93.9	Very high	91.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64	-38.5	177.9	-167.3	65.8	-165.8	0	0	112.2	C268 T271 T296 V297 L298 L303 S304 I324 C327 Y328	C268-M300 HydrophobicContact CB-CE 4.4Å; C268-M300 HydrophobicContact CB-SD 4.48Å; T271-M300 HydrophobicContact CG2-CB 4.46Å; T296-M300 WeakPolarHBondContact O-CB 3.46Å; T296-M300 PolarHBondContact O-N 2.99Å; V297-M300 PolarHBondContact O-N 3.36Å; L298-M300 VanDerWaalsContact C-N 3.3Å; L298-M300 PolarHBondContact O-N 2.85Å; M300-L303 PolarHBondContact O-N 3.03Å; M300-S304 WeakPolarHBondContact O-CB 3.41Å; M300-S304 PolarHBondContact O-N 2.97Å; M300-I324 HydrophobicContact CE-CB 4.24Å; M300-I324 HydrophobicContact CE-CG2 3.76Å; M300-I324 WeakPolarHBondContact CE-O 3.36Å; M300-C327 HydrophobicContact CE-CB 3.33Å; M300-C327 HydrophobicContact SD-CB 4.19Å; M300-Y328 HydrophobicContact CB-CD2 4.2Å; M300-Y328 HydrophobicContact CG-CD2 3.75Å; M300-Y328 HydrophobicContact CG-CG 4.44Å
301	T	94.6	Very high	91.3	Very high	50 Å²	50	60.8 Å²	60.8	31%	0.307	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-44.6	175.1	-53.4	0	0	0	0	110.9	V297 L298 T299 S304 I305	V297-T301 PolarHBondContact O-N 3.25Å; V297-T301 PolarHBondContact O-OG1 3.28Å; L298-T301 WeakPolarHBondContact O-CB 3.39Å; L298-T301 PolarHBondContact O-N 3.29Å; L298-T301 VanDerWaalsContact O-N 3.15Å; T299-T301 VanDerWaalsContact C-N 3.33Å; T299-T301 PolarHBondContact O-N 3.18Å; T301-S304 PolarHBondContact O-N 2.97Å; T301-I305 HydrophobicContact CG2-CD1 4.15Å; T301-I305 WeakPolarHBondContact O-CG1 3.29Å; T301-I305 PolarHBondContact O-N 3.16Å
302	T	94.3	Very high	91.1	Very high	84 Å²	84	57.3 Å²	57.3	52%	0.515	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-44.2	176.6	-56.4	0	0	0	0	112	L298 T299 S304 I305 S306	L298-T302 PolarHBondContact O-N 3.1Å; L298-T302 PolarHBondContact O-OG1 2.94Å; L298-T302 VanDerWaalsContact O-OG1 3.12Å; T299-T302 PolarHBondContact O-N 3.02Å; T302-S304 PolarHBondContact O-N 3.36Å; T302-I305 PolarHBondContact O-N 3.44Å; T302-S306 WeakPolarHBondContact O-CB 3.27Å; T302-S306 PolarHBondContact O-N 3.18Å
303	L	92.7	Very high	91	Very high	36 Å²	36	62.8 Å²	62.8	19%	0.188	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-41.1	176.5	-72.5	173.6	0	0	0	111.9	P267 T299 M300 S306 A307	P267-L303 HydrophobicContact CB-CD1 3.76Å; P267-L303 HydrophobicContact CB-CD2 3.83Å; P267-L303 HydrophobicContact CB-CG 4.48Å; T299-L303 HydrophobicContact CG2-CD1 4.24Å; T299-L303 WeakPolarHBondContact O-CG 3.42Å; T299-L303 PolarHBondContact O-N 3Å; M300-L303 PolarHBondContact O-N 3.03Å; L303-S306 PolarHBondContact O-N 3.33Å; L303-A307 WeakPolarHBondContact O-CB 3.42Å; L303-A307 PolarHBondContact O-N 3.29Å
304	S	91.3	Very high	90.9	Very high	31 Å²	31	64.2 Å²	64.2	22%	0.217	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-46.7	176.7	178.3	0	0	0	0	112.2	M300 T301 T302 A307 R308	M300-S304 WeakPolarHBondContact O-CB 3.41Å; M300-S304 PolarHBondContact O-N 2.97Å; T301-S304 PolarHBondContact O-N 2.97Å; T302-S304 PolarHBondContact O-N 3.36Å; S304-A307 PolarHBondContact O-N 2.63Å; S304-R308 WeakPolarHBondContact O-CG 3.26Å; S304-R308 PolarHBondContact O-N 3.42Å; S304-R308 VanDerWaalsContact O-N 3.1Å
305	I	91.9	Very high	90.7	Very high	96 Å²	96	65.8 Å²	65.8	49%	0.492	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-45.3	177.6	-65.9	165.9	0	0	0	110.4	T301 T302 A307 R308 N309	T301-I305 HydrophobicContact CG2-CD1 4.15Å; T301-I305 WeakPolarHBondContact O-CG1 3.29Å; T301-I305 PolarHBondContact O-N 3.16Å; T302-I305 PolarHBondContact O-N 3.44Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 2.97Å; I305-R308 PolarHBondContact O-N 3.3Å; I305-N309 VanDerWaalsContact O-CG 3.32Å; I305-N309 PolarHBondContact O-N 3.46Å; I305-N309 VanDerWaalsContact O-N 3.14Å; I305-N309 PolarHBondContact O-ND2 2.91Å
306	S	90.6	Very high	90.5	Very high	60 Å²	60	65.9 Å²	65.9	42%	0.42	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-41.4	179.1	-173	0	0	0	0	112.2	T302 L303	T302-S306 WeakPolarHBondContact O-CB 3.27Å; T302-S306 PolarHBondContact O-N 3.18Å; L303-S306 PolarHBondContact O-N 3.33Å
307	A	88.4	Confident	90.4	Very high	8 Å²	8	68 Å²	68	7%	0.066	38%	0.381	C	S	.	.	H	α-helix	trans	-63.7	-45.8	177.5	0	0	0	0	0	110.9	T264 L303 S304 I305 N309 S310 L311 M320 I324	T264-A307 HydrophobicContact CG2-CB 3.96Å; L303-A307 WeakPolarHBondContact O-CB 3.42Å; L303-A307 PolarHBondContact O-N 3.29Å; S304-A307 PolarHBondContact O-N 2.63Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 2.97Å; A307-N309 VanDerWaalsContact C-N 3.31Å; A307-N309 PolarHBondContact O-N 3.41Å; A307-S310 PolarHBondContact O-N 3.42Å; A307-L311 WeakPolarHBondContact O-CD1 3.36Å; A307-M320 HydrophobicContact CB-SD 4.13Å; A307-I324 HydrophobicContact CB-CD1 3.85Å
308	R	86.1	Confident	90.3	Very high	153 Å²	153	66.8 Å²	66.8	58%	0.577	37%	0.374	S	S	*	.	H	α-helix	trans	-67.5	-25.6	-177.5	-68.4	-179.4	109.3	-146.8	-2.3	114.3	S304 I305 S310 L311 D321	S304-R308 WeakPolarHBondContact O-CG 3.26Å; S304-R308 PolarHBondContact O-N 3.42Å; S304-R308 VanDerWaalsContact O-N 3.1Å; I305-R308 PolarHBondContact O-N 3.3Å; R308-S310 PolarHBondContact O-N 3.25Å; R308-L311 PolarHBondContact O-N 3.4Å; R308-D321 IonicContact NE-OD1 3.54Å
309	N	85.9	Confident	90.2	Very high	130 Å²	130	61.7 Å²	61.7	70%	0.695	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-22.1	176.7	-72.9	-21	0	0	0	113.3	I305 A307	I305-N309 VanDerWaalsContact O-CG 3.32Å; I305-N309 PolarHBondContact O-N 3.46Å; I305-N309 VanDerWaalsContact O-N 3.14Å; I305-N309 PolarHBondContact O-ND2 2.91Å; A307-N309 VanDerWaalsContact C-N 3.31Å; A307-N309 PolarHBondContact O-N 3.41Å
310	S	79	Confident	90.1	Very high	59 Å²	59	59.1 Å²	59.1	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-3.5	179	-59.1	0	0	0	0	113.5	A307 R308	A307-S310 PolarHBondContact O-N 3.42Å; R308-S310 PolarHBondContact O-N 3.25Å
311	L	83.7	Confident	90.1	Very high	21 Å²	21	60.7 Å²	60.7	11%	0.11	34%	0.339	C	S	.	.	S	Bend	trans	-108.8	147.8	178.6	-73	86	0	0	0	111.4	F180 A307 R308 T318 M320	F180-L311 HydrophobicContact CD1-CD1 4.44Å; F180-L311 HydrophobicContact CD1-CD2 3.36Å; F180-L311 HydrophobicContact CD1-CG 4.07Å; F180-L311 HydrophobicContact CD2-CD2 4.41Å; F180-L311 HydrophobicContact CE1-CD1 3.61Å; F180-L311 HydrophobicContact CE1-CD2 3.35Å; F180-L311 HydrophobicContact CE1-CG 3.52Å; F180-L311 HydrophobicContact CE2-CD2 4.38Å; F180-L311 HydrophobicContact CE2-CG 4.28Å; F180-L311 HydrophobicContact CG-CD2 3.91Å; F180-L311 HydrophobicContact CZ-CD1 3.93Å; F180-L311 HydrophobicContact CZ-CD2 3.88Å; F180-L311 HydrophobicContact CZ-CG 3.63Å; A307-L311 WeakPolarHBondContact O-CD1 3.36Å; R308-L311 PolarHBondContact O-N 3.4Å; L311-T318 HydrophobicContact CD2-CG2 4.2Å; L311-M320 HydrophobicContact CD1-SD 4.28Å
312	P	89	Confident	90.1	Very high	17 Å²	17	65.5 Å²	65.5	11%	0.11	35%	0.352	C	S	.	.			trans	-58.8	153.6	164.2	25.6	-34.1	0	0	0	111.4	D89 L177 V314	D89-P312 WeakPolarHBondContact O-CB 3.26Å; D89-P312 WeakPolarHBondContact O-CG 3.34Å; L177-P312 HydrophobicContact CD1-CG 3.29Å; P312-V314 PolarHBondContact O-N 3.22Å
313	K	87.2	Confident	90.2	Very high	219 Å²	219	61.5 Å²	61.5	95%	0.952	33%	0.328	S	S	*	.			trans	-75.1	97.6	174.6	-63.9	178.7	-176.3	175.2	0	109.7
314	V	89.8	Confident	90.3	Very high	36 Å²	36	60.1 Å²	60.1	22%	0.218	32%	0.32	C	S	.	.			trans	-98	150.9	171.3	-66.7	0	0	0	0	111.1	L177 P312 Y316 T318	L177-V314 HydrophobicContact CD1-CG1 4.03Å; P312-V314 PolarHBondContact O-N 3.22Å; V314-Y316 HydrophobicContact CB-CD2 4.46Å; V314-Y316 HydrophobicContact CB-CE1 4.23Å; V314-Y316 HydrophobicContact CB-CE2 4.15Å; V314-Y316 HydrophobicContact CG1-CE1 4.5Å; V314-Y316 HydrophobicContact CG1-CE2 4.45Å; V314-Y316 HydrophobicContact CG2-CD2 4.28Å; V314-Y316 HydrophobicContact CG2-CE2 4.12Å; V314-T318 HydrophobicContact CG2-CG2 4Å
315	A	89.9	Confident	90.5	Very high	114 Å²	114	61.2 Å²	61.2	94%	0.942	33%	0.331	S	S	*	.	S	Bend	trans	-82.3	-13.9	-178.3	0	0	0	0	0	113.8
316	Y	92.1	Very high	90.7	Very high	72 Å²	72	58.5 Å²	58.5	28%	0.282	32%	0.319	S	S	.	.	S	Bend	trans	-106	160.4	179.5	51.2	-100.2	0	0	0	111.6	Q176 L177 E178 V314	Q176-Y316 PolarHBondContact OE1-OH 2.91Å; L177-Y316 HydrophobicContact CB-CE2 4.3Å; L177-Y316 PolarHBondContact N-OH 3.48Å; E178-Y316 HydrophobicContact CG-CD2 4.06Å; E178-Y316 HydrophobicContact CG-CE2 3.95Å; V314-Y316 HydrophobicContact CB-CD2 4.46Å; V314-Y316 HydrophobicContact CB-CE1 4.23Å; V314-Y316 HydrophobicContact CB-CE2 4.15Å; V314-Y316 HydrophobicContact CG1-CE1 4.5Å; V314-Y316 HydrophobicContact CG1-CE2 4.45Å; V314-Y316 HydrophobicContact CG2-CD2 4.28Å; V314-Y316 HydrophobicContact CG2-CE2 4.12Å
317	A	91.4	Very high	91	Very high	52 Å²	52	55.7 Å²	55.7	43%	0.43	30%	0.299	S	S	.	.			trans	-79.9	129.1	176.7	0	0	0	0	0	110.8	D321	A317-D321 HydrophobicContact CB-CB 4.48Å
318	T	93.7	Very high	91.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.314	C	S	.	.			trans	-82.3	163.4	175.8	65.8	0	0	0	0	111.8	L177 E178 F180 L311 V314 M320 D321 W322	L177-T318 WeakPolarHBondContact O-CG2 3.24Å; E178-T318 CarbonylContact O-C 3.38Å; F180-T318 HydrophobicContact CB-CG2 4.32Å; L311-T318 HydrophobicContact CD2-CG2 4.2Å; V314-T318 HydrophobicContact CG2-CG2 4Å; T318-M320 PolarHBondContact O-N 2.71Å; T318-D321 PolarHBondContact N-OD2 3.32Å; T318-D321 WeakPolarHBondContact O-CB 3.45Å; T318-D321 PolarHBondContact O-N 3.14Å; T318-D321 PolarHBondContact OG1-N 2.91Å; T318-D321 VanDerWaalsContact OG1-N 3.1Å; T318-D321 PolarHBondContact OG1-OD2 3.47Å; T318-W322 PolarHBondContact O-N 2.86Å; T318-W322 VanDerWaalsContact O-N 3.07Å
319	A	93.4	Very high	91.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-33.5	172.8	0	0	0	0	0	112.5	E178 F323 Y444 Y448	E178-A319 PolarHBondContact O-N 2.89Å; A319-F323 PolarHBondContact O-N 3.28Å; A319-Y444 WeakPolarHBondContact O-CE2 3.27Å; A319-Y444 PolarHBondContact O-OH 3.36Å; A319-Y448 HydrophobicContact CB-CD1 3.69Å; A319-Y448 HydrophobicContact CB-CD2 4.29Å; A319-Y448 HydrophobicContact CB-CE1 3.34Å; A319-Y448 HydrophobicContact CB-CE2 4Å; A319-Y448 HydrophobicContact CB-CG 4.15Å
320	M	92.9	Very high	92.3	Very high	3 Å²	3	50 Å²	50	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-43.4	171.5	-175.2	-179.7	-70	0	0	112.3	F180 P181 F260 T264 Y265 A307 L311 T318 W322 F323 I324	F180-M320 HydrophobicContact CD1-CB 4.15Å; F180-M320 HydrophobicContact CD1-CE 3.95Å; F180-M320 HydrophobicContact CD1-SD 4.39Å; F180-M320 HydrophobicContact CE1-CE 3.41Å; F180-M320 VanDerWaalsContact CE1-CE 3.41Å; F180-M320 HydrophobicContact CE1-SD 3.93Å; F180-M320 HydrophobicContact CZ-CE 4.42Å; F180-M320 PolarHBondContact O-N 3.29Å; F180-M320 VanDerWaalsContact O-N 3.11Å; P181-M320 HydrophobicContact CB-CE 4.48Å; P181-M320 HydrophobicContact CG-CE 3.68Å; F260-M320 HydrophobicContact CB-CE 4.14Å; F260-M320 HydrophobicContact CD1-CE 3.61Å; F260-M320 HydrophobicContact CE1-CE 4.31Å; F260-M320 HydrophobicContact CG-CE 4.07Å; T264-M320 HydrophobicContact CG2-CE 4.5Å; T264-M320 HydrophobicContact CG2-CG 4.47Å; T264-M320 HydrophobicContact CG2-SD 4.08Å; Y265-M320 HydrophobicContact CE2-CE 4.37Å; A307-M320 HydrophobicContact CB-SD 4.13Å; L311-M320 HydrophobicContact CD1-SD 4.28Å; T318-M320 PolarHBondContact O-N 2.71Å; M320-W322 VanDerWaalsContact C-N 3.33Å; M320-W322 PolarHBondContact O-N 3.42Å; M320-F323 WeakPolarHBondContact O-CB 3.5Å; M320-F323 PolarHBondContact O-N 2.85Å; M320-F323 VanDerWaalsContact O-N 3.15Å; M320-I324 HydrophobicContact CG-CD1 3.84Å; M320-I324 HydrophobicContact CG-CG1 4.38Å; M320-I324 WeakPolarHBondContact O-CG1 3.4Å; M320-I324 PolarHBondContact O-N 3.34Å; M320-I324 HydrophobicContact SD-CD1 4.37Å
321	D	93.9	Very high	93.1	Very high	33 Å²	33	47.3 Å²	47.3	18%	0.176	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-42.9	178.1	-69.1	-54.9	0	0	0	111.3	R308 A317 T318 F323 I324 A325	R308-D321 IonicContact NE-OD1 3.54Å; A317-D321 HydrophobicContact CB-CB 4.48Å; T318-D321 PolarHBondContact N-OD2 3.32Å; T318-D321 WeakPolarHBondContact O-CB 3.45Å; T318-D321 PolarHBondContact O-N 3.14Å; T318-D321 PolarHBondContact OG1-N 2.91Å; T318-D321 VanDerWaalsContact OG1-N 3.1Å; T318-D321 PolarHBondContact OG1-OD2 3.47Å; D321-F323 VanDerWaalsContact C-N 3.32Å; D321-F323 PolarHBondContact O-N 2.94Å; D321-I324 PolarHBondContact O-N 2.68Å; D321-A325 VanDerWaalsContact O-CB 3.24Å; D321-A325 WeakPolarHBondContact O-CB 3.45Å; D321-A325 PolarHBondContact O-N 3.48Å
322	W	94.9	Very high	93.7	Very high	152 Å²	152	51 Å²	51	58%	0.576	27%	0.274	S	S	*	.	H	α-helix	trans	-59.6	-41.5	174.6	-78.7	110.8	0	0	0	112.4	T318 M320 A325 V326	T318-W322 PolarHBondContact O-N 2.86Å; T318-W322 VanDerWaalsContact O-N 3.07Å; M320-W322 VanDerWaalsContact C-N 3.33Å; M320-W322 PolarHBondContact O-N 3.42Å; W322-A325 PolarHBondContact O-N 2.99Å; W322-V326 WeakPolarHBondContact O-CG2 3.33Å; W322-V326 PolarHBondContact O-N 3.13Å
323	F	95.8	Very high	94	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-48.9	177	-174.8	-93.4	0	0	0	112.3	Y265 C268 F269 A319 M320 D321 V326 C327 F440 N441 Y444	Y265-F323 AromaticContact CD1-CD1 3.57Å; Y265-F323 HydrophobicContact CD1-CD1 3.57Å; Y265-F323 HydrophobicContact CD1-CD2 4.13Å; Y265-F323 AromaticContact CD1-CE1 3.5Å; Y265-F323 HydrophobicContact CD1-CE1 3.5Å; Y265-F323 HydrophobicContact CD1-CE2 4.06Å; Y265-F323 AromaticContact CD1-CG 3.9Å; Y265-F323 HydrophobicContact CD1-CG 3.9Å; Y265-F323 AromaticContact CD1-CZ 3.77Å; Y265-F323 HydrophobicContact CD1-CZ 3.77Å; Y265-F323 HydrophobicContact CE1-CB 4.1Å; Y265-F323 AromaticContact CE1-CD1 3.69Å; Y265-F323 HydrophobicContact CE1-CD1 3.69Å; Y265-F323 AromaticContact CE1-CD2 3.96Å; Y265-F323 HydrophobicContact CE1-CD2 3.96Å; Y265-F323 HydrophobicContact CE1-CE1 4.11Å; Y265-F323 HydrophobicContact CE1-CE2 4.34Å; Y265-F323 AromaticContact CE1-CG 3.63Å; Y265-F323 HydrophobicContact CE1-CG 3.63Å; Y265-F323 HydrophobicContact CE1-CZ 4.43Å; Y265-F323 HydrophobicContact CG-CE1 4.46Å; C268-F323 HydrophobicContact CB-CE1 3.91Å; F269-F323 AromaticContact CD2-CZ 3.76Å; F269-F323 HydrophobicContact CD2-CZ 3.76Å; F269-F323 HydrophobicContact CE2-CE2 4.08Å; F269-F323 AromaticContact CE2-CZ 3.57Å; F269-F323 HydrophobicContact CE2-CZ 3.57Å; F269-F323 HydrophobicContact CZ-CZ 4.37Å; A319-F323 PolarHBondContact O-N 3.28Å; M320-F323 WeakPolarHBondContact O-CB 3.5Å; M320-F323 PolarHBondContact O-N 2.85Å; M320-F323 VanDerWaalsContact O-N 3.15Å; D321-F323 VanDerWaalsContact C-N 3.32Å; D321-F323 PolarHBondContact O-N 2.94Å; F323-V326 PolarHBondContact O-N 3.09Å; F323-C327 WeakPolarHBondContact CE1-SG 3.48Å; F323-C327 WeakPolarHBondContact O-CB 3.34Å; F323-C327 PolarHBondContact O-N 3.33Å; F323-C327 PolarHBondContact O-SG 3.29Å; F323-F440 AromaticContact CD2-CE1 3.75Å; F323-F440 HydrophobicContact CD2-CE1 3.75Å; F323-F440 AromaticContact CD2-CZ 3.93Å; F323-F440 HydrophobicContact CD2-CZ 3.93Å; F323-F440 AromaticContact CE2-CE1 3.83Å; F323-F440 HydrophobicContact CE2-CE1 3.83Å; F323-F440 HydrophobicContact CE2-CZ 4.46Å; F323-N441 WeakPolarHBondContact CE2-OD1 3.34Å; F323-Y444 HydrophobicContact CB-CD2 4.42Å; F323-Y444 HydrophobicContact CB-CE1 4.47Å; F323-Y444 HydrophobicContact CB-CE2 3.72Å; F323-Y444 AromaticContact CD2-CD1 3.82Å; F323-Y444 HydrophobicContact CD2-CD1 3.82Å; F323-Y444 HydrophobicContact CD2-CD2 4.05Å; F323-Y444 AromaticContact CD2-CE1 3.77Å; F323-Y444 HydrophobicContact CD2-CE1 3.77Å; F323-Y444 HydrophobicContact CD2-CE2 4.01Å; F323-Y444 AromaticContact CD2-CG 3.97Å; F323-Y444 HydrophobicContact CD2-CG 3.97Å; F323-Y444 AromaticContact CD2-CZ 3.87Å; F323-Y444 HydrophobicContact CE2-CD1 4.29Å; F323-Y444 HydrophobicContact CE2-CE1 4.46Å; F323-Y444 HydrophobicContact CG-CE1 4.37Å; F323-Y444 HydrophobicContact CG-CE2 4.33Å
324	I	94.8	Very high	94.3	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.036	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-42.8	179	-68.3	174.8	0	0	0	110.2	T264 M300 A307 M320 D321 V326 C327 Y328	T264-I324 HydrophobicContact CG2-CD1 4.13Å; M300-I324 HydrophobicContact CE-CB 4.24Å; M300-I324 HydrophobicContact CE-CG2 3.76Å; M300-I324 WeakPolarHBondContact CE-O 3.36Å; A307-I324 HydrophobicContact CB-CD1 3.85Å; M320-I324 HydrophobicContact CG-CD1 3.84Å; M320-I324 HydrophobicContact CG-CG1 4.38Å; M320-I324 WeakPolarHBondContact O-CG1 3.4Å; M320-I324 PolarHBondContact O-N 3.34Å; M320-I324 HydrophobicContact SD-CD1 4.37Å; D321-I324 PolarHBondContact O-N 2.68Å; I324-V326 PolarHBondContact O-N 3.48Å; I324-C327 PolarHBondContact O-N 3.1Å; I324-Y328 WeakPolarHBondContact O-CB 3.37Å; I324-Y328 PolarHBondContact O-N 3.26Å
325	A	95.4	Very high	94.4	Very high	53 Å²	53	42.7 Å²	42.7	44%	0.438	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-43.3	178.8	0	0	0	0	0	112.4	D321 W322 Y328 A329	D321-A325 VanDerWaalsContact O-CB 3.24Å; D321-A325 WeakPolarHBondContact O-CB 3.45Å; D321-A325 PolarHBondContact O-N 3.48Å; W322-A325 PolarHBondContact O-N 2.99Å; A325-Y328 WeakPolarHBondContact O-CB 3.39Å; A325-Y328 PolarHBondContact O-N 3.17Å; A325-A329 PolarHBondContact O-N 2.9Å
326	V	96.4	Very high	94.6	Very high	40 Å²	40	41.2 Å²	41.2	24%	0.242	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-43.6	176.8	172.9	0	0	0	0	111.1	W322 F323 I324 Y328 A329 F330 F440	W322-V326 WeakPolarHBondContact O-CG2 3.33Å; W322-V326 PolarHBondContact O-N 3.13Å; F323-V326 PolarHBondContact O-N 3.09Å; I324-V326 PolarHBondContact O-N 3.48Å; V326-Y328 VanDerWaalsContact C-N 3.27Å; V326-Y328 PolarHBondContact O-N 3.2Å; V326-A329 WeakPolarHBondContact O-CB 3.18Å; V326-A329 PolarHBondContact O-N 2.97Å; V326-A329 VanDerWaalsContact O-N 3.16Å; V326-F330 HydrophobicContact CG1-CD2 3.81Å; V326-F330 HydrophobicContact CG1-CE2 3.58Å; V326-F330 VanDerWaalsContact O-CD2 3.26Å; V326-F330 WeakPolarHBondContact O-CD2 3.44Å; V326-F330 PolarHBondContact O-N 2.86Å; V326-F440 HydrophobicContact CB-CD2 4.44Å; V326-F440 HydrophobicContact CB-CE1 4.07Å; V326-F440 HydrophobicContact CB-CE2 3.84Å; V326-F440 HydrophobicContact CB-CZ 3.63Å; V326-F440 HydrophobicContact CG1-CD1 3.84Å; V326-F440 HydrophobicContact CG1-CD2 3.77Å; V326-F440 HydrophobicContact CG1-CE1 3.73Å; V326-F440 HydrophobicContact CG1-CE2 3.66Å; V326-F440 HydrophobicContact CG1-CG 3.85Å; V326-F440 HydrophobicContact CG1-CZ 3.64Å; V326-F440 HydrophobicContact CG2-CD2 4.44Å; V326-F440 HydrophobicContact CG2-CE2 3.76Å; V326-F440 HydrophobicContact CG2-CZ 3.99Å
327	C	96.4	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-41.5	174	-70.6	0	0	0	0	111.6	V272 M300 F323 I324 F330 V331	V272-C327 HydrophobicContact CG2-CB 3.72Å; M300-C327 HydrophobicContact CE-CB 3.33Å; M300-C327 HydrophobicContact SD-CB 4.19Å; F323-C327 WeakPolarHBondContact CE1-SG 3.48Å; F323-C327 WeakPolarHBondContact O-CB 3.34Å; F323-C327 PolarHBondContact O-N 3.33Å; F323-C327 PolarHBondContact O-SG 3.29Å; I324-C327 PolarHBondContact O-N 3.1Å; C327-F330 PolarHBondContact O-N 2.89Å; C327-V331 WeakPolarHBondContact O-CG2 3.42Å; C327-V331 PolarHBondContact O-N 3.15Å; C327-V331 VanDerWaalsContact O-N 3.1Å
328	Y	95.6	Very high	94.6	Very high	96 Å²	96	36.6 Å²	36.6	38%	0.376	19%	0.19	S	C	.	.	H	α-helix	trans	-61.9	-43.4	175.4	-170.4	-88.2	0	0	0	111.7	V297 M300 I324 A325 V326 F330 V331 F332	V297-Y328 HydrophobicContact CG1-CE2 4.21Å; M300-Y328 HydrophobicContact CB-CD2 4.2Å; M300-Y328 HydrophobicContact CG-CD2 3.75Å; M300-Y328 HydrophobicContact CG-CG 4.44Å; I324-Y328 WeakPolarHBondContact O-CB 3.37Å; I324-Y328 PolarHBondContact O-N 3.26Å; A325-Y328 WeakPolarHBondContact O-CB 3.39Å; A325-Y328 PolarHBondContact O-N 3.17Å; V326-Y328 VanDerWaalsContact C-N 3.27Å; V326-Y328 PolarHBondContact O-N 3.2Å; Y328-F330 VanDerWaalsContact C-N 3.34Å; Y328-F330 PolarHBondContact O-N 2.97Å; Y328-V331 PolarHBondContact O-N 3.2Å; Y328-F332 WeakPolarHBondContact O-CB 3.48Å; Y328-F332 PolarHBondContact O-N 2.99Å
329	A	96.5	Very high	94.5	Very high	48 Å²	48	39.2 Å²	39.2	40%	0.397	21%	0.211	S	C	.	.	H	α-helix	trans	-61.2	-39	176	0	0	0	0	0	112.5	A325 V326 S333	A325-A329 PolarHBondContact O-N 2.9Å; V326-A329 WeakPolarHBondContact O-CB 3.18Å; V326-A329 PolarHBondContact O-N 2.97Å; V326-A329 VanDerWaalsContact O-N 3.16Å; A329-S333 WeakPolarHBondContact O-CB 3.39Å; A329-S333 PolarHBondContact O-N 3.4Å; A329-S333 PolarHBondContact O-OG 2.66Å
330	F	96.4	Very high	94.3	Very high	29 Å²	29	41.7 Å²	41.7	13%	0.127	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-46.3	175.2	-84.6	-72.9	0	0	0	112.6	V272 V326 C327 Y328 F332 S333 A334 F433 L436 F437	V272-F330 HydrophobicContact CG1-CB 4.13Å; V326-F330 HydrophobicContact CG1-CD2 3.81Å; V326-F330 HydrophobicContact CG1-CE2 3.58Å; V326-F330 VanDerWaalsContact O-CD2 3.26Å; V326-F330 WeakPolarHBondContact O-CD2 3.44Å; V326-F330 PolarHBondContact O-N 2.86Å; C327-F330 PolarHBondContact O-N 2.89Å; Y328-F330 VanDerWaalsContact C-N 3.34Å; Y328-F330 PolarHBondContact O-N 2.97Å; F330-F332 VanDerWaalsContact C-N 3.35Å; F330-S333 PolarHBondContact O-N 3.32Å; F330-A334 PolarHBondContact O-N 3.03Å; F330-F433 HydrophobicContact CD1-CD1 4.06Å; F330-L436 HydrophobicContact CE1-CB 3.94Å; F330-L436 HydrophobicContact CZ-CB 3.96Å; F330-F437 AromaticContact CD2-CD2 3.77Å; F330-F437 HydrophobicContact CD2-CD2 3.77Å; F330-F437 HydrophobicContact CD2-CE2 4.46Å; F330-F437 HydrophobicContact CE1-CB 4.23Å; F330-F437 HydrophobicContact CE2-CB 4.34Å; F330-F437 AromaticContact CE2-CD2 3.8Å; F330-F437 HydrophobicContact CE2-CD2 3.8Å; F330-F437 HydrophobicContact CG-CD2 4.37Å; F330-F437 HydrophobicContact CZ-CB 4.1Å; F330-F437 HydrophobicContact CZ-CD2 4.41Å
331	V	96.3	Very high	94.1	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-43.7	178.1	175.9	0	0	0	0	110.6	T271 V272 T296 V297 C327 Y328 A334 L335	T271-V331 HydrophobicContact CG2-CG2 4.46Å; V272-V331 HydrophobicContact CG2-CG2 4.07Å; T296-V331 WeakPolarHBondContact OG1-CG1 3.33Å; V297-V331 HydrophobicContact CB-CG1 4.42Å; V297-V331 HydrophobicContact CG2-CG1 3.7Å; C327-V331 WeakPolarHBondContact O-CG2 3.42Å; C327-V331 PolarHBondContact O-N 3.15Å; C327-V331 VanDerWaalsContact O-N 3.1Å; Y328-V331 PolarHBondContact O-N 3.2Å; V331-A334 WeakPolarHBondContact O-CB 3.24Å; V331-A334 PolarHBondContact O-N 3.41Å; V331-L335 PolarHBondContact O-N 3.44Å
332	F	95.6	Very high	93.8	Very high	99 Å²	99	43.3 Å²	43.3	43%	0.434	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-40.2	176.1	-173.7	-109.2	0	0	0	112.2	Y328 F330 A334 L335 I336	Y328-F332 WeakPolarHBondContact O-CB 3.48Å; Y328-F332 PolarHBondContact O-N 2.99Å; F330-F332 VanDerWaalsContact C-N 3.35Å; F332-A334 VanDerWaalsContact C-N 3.29Å; F332-A334 PolarHBondContact O-N 2.98Å; F332-L335 WeakPolarHBondContact O-CB 3.48Å; F332-L335 PolarHBondContact O-N 2.93Å; F332-L335 VanDerWaalsContact O-N 3.11Å; F332-I336 HydrophobicContact CD1-CD1 3.77Å; F332-I336 HydrophobicContact CD1-CG1 4.45Å; F332-I336 HydrophobicContact CE1-CD1 3.47Å; F332-I336 VanDerWaalsContact CE1-CD1 3.47Å; F332-I336 HydrophobicContact CE1-CG1 4.21Å; F332-I336 HydrophobicContact CZ-CD1 4.17Å; F332-I336 PolarHBondContact O-N 3.35Å; F332-I336 VanDerWaalsContact O-N 3.08Å
333	S	94.9	Very high	93.4	Very high	49 Å²	49	45.3 Å²	45.3	34%	0.343	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-33.4	175.9	-61.8	0	0	0	0	112.3	A329 F330 L335 I336 E337	A329-S333 WeakPolarHBondContact O-CB 3.39Å; A329-S333 PolarHBondContact O-N 3.4Å; A329-S333 PolarHBondContact O-OG 2.66Å; F330-S333 PolarHBondContact O-N 3.32Å; S333-L335 VanDerWaalsContact C-N 3.32Å; S333-I336 PolarHBondContact O-N 3.42Å; S333-E337 WeakPolarHBondContact O-CB 3.38Å; S333-E337 PolarHBondContact O-N 2.93Å
334	A	93.4	Very high	92.8	Very high	5 Å²	5	51.5 Å²	51.5	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-65.7	-34.6	173.3	0	0	0	0	0	112.3	F279 F330 V331 F332 E337 F338	F279-A334 HydrophobicContact CE1-CB 4.04Å; F279-A334 HydrophobicContact CZ-CB 3.79Å; F330-A334 PolarHBondContact O-N 3.03Å; V331-A334 WeakPolarHBondContact O-CB 3.24Å; V331-A334 PolarHBondContact O-N 3.41Å; F332-A334 VanDerWaalsContact C-N 3.29Å; F332-A334 PolarHBondContact O-N 2.98Å; A334-E337 WeakPolarHBondContact O-CB 3.21Å; A334-E337 PolarHBondContact O-N 3.27Å; A334-F338 PolarHBondContact O-N 3.4Å; A334-F338 VanDerWaalsContact O-N 3.09Å
335	L	92.8	Very high	92.1	Very high	43 Å²	43	52.6 Å²	52.6	23%	0.225	28%	0.278	C	S	.	.	H	α-helix	trans	-68.8	-40.5	174	-174	66.6	0	0	0	111.9	V331 F332 S333 E337 F338 A339	V331-L335 PolarHBondContact O-N 3.44Å; F332-L335 WeakPolarHBondContact O-CB 3.48Å; F332-L335 PolarHBondContact O-N 2.93Å; F332-L335 VanDerWaalsContact O-N 3.11Å; S333-L335 VanDerWaalsContact C-N 3.32Å; L335-E337 VanDerWaalsContact C-N 3.35Å; L335-F338 HydrophobicContact CD1-CD1 4.38Å; L335-F338 PolarHBondContact O-N 3.42Å; L335-A339 PolarHBondContact O-N 3.5Å
336	I	93.7	Very high	90.6	Very high	84 Å²	84	59.8 Å²	59.8	43%	0.431	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174.4	-66.8	174.2	0	0	0	111.1	F332 S333 F338 A339 T340	F332-I336 HydrophobicContact CD1-CD1 3.77Å; F332-I336 HydrophobicContact CD1-CG1 4.45Å; F332-I336 HydrophobicContact CE1-CD1 3.47Å; F332-I336 VanDerWaalsContact CE1-CD1 3.47Å; F332-I336 HydrophobicContact CE1-CG1 4.21Å; F332-I336 HydrophobicContact CZ-CD1 4.17Å; F332-I336 PolarHBondContact O-N 3.35Å; F332-I336 VanDerWaalsContact O-N 3.08Å; S333-I336 PolarHBondContact O-N 3.42Å; I336-F338 VanDerWaalsContact C-N 3.32Å; I336-F338 PolarHBondContact O-N 2.96Å; I336-A339 PolarHBondContact O-N 3.38Å; I336-T340 WeakPolarHBondContact O-CB 3.43Å; I336-T340 PolarHBondContact O-N 3.37Å; I336-T340 PolarHBondContact O-OG1 3.26Å
337	E	93.8	Very high	89	Confident	10 Å²	10	64.4 Å²	64.4	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-49	175.2	-170.5	-78.5	164.7	0	0	110.5	F279 R289 S333 A334 L335 A339 T340 V341 I425 S429	F279-E337 HydrophobicContact CD1-CG 4.4Å; F279-E337 WeakPolarHBondContact CD1-OE2 3.19Å; F279-E337 HydrophobicContact CE1-CB 4.04Å; F279-E337 HydrophobicContact CE1-CG 3.84Å; F279-E337 WeakPolarHBondContact CE1-OE2 3.29Å; F279-E337 HydrophobicContact CZ-CG 4.49Å; R289-E337 IonicContact NH2-OE2 2.89Å; R289-E337 PolarHBondContact NH2-OE2 2.96Å; S333-E337 WeakPolarHBondContact O-CB 3.38Å; S333-E337 PolarHBondContact O-N 2.93Å; A334-E337 WeakPolarHBondContact O-CB 3.21Å; A334-E337 PolarHBondContact O-N 3.27Å; L335-E337 VanDerWaalsContact C-N 3.35Å; E337-A339 PolarHBondContact O-N 3.45Å; E337-T340 WeakPolarHBondContact O-CB 3.2Å; E337-T340 PolarHBondContact O-N 3.34Å; E337-T340 VanDerWaalsContact O-N 3.14Å; E337-V341 WeakPolarHBondContact O-CG2 3.45Å; E337-V341 PolarHBondContact O-N 3.22Å; E337-V341 VanDerWaalsContact OE1-CG2 3.24Å; E337-V341 WeakPolarHBondContact OE1-CG2 3.46Å; E337-I425 HydrophobicContact CG-CG2 4.25Å; E337-S429 VanDerWaalsContact CG-OG 3.29Å; E337-S429 WeakPolarHBondContact CG-OG 3.24Å; E337-S429 PolarHBondContact OE1-OG 3.47Å
338	F	90.9	Very high	87.3	Confident	17 Å²	17	69.2 Å²	69.2	8%	0.075	35%	0.346	C	S	.	.	H	α-helix	trans	-60	-44.8	176.6	164.3	-113	0	0	0	112.3	V286 R289 T290 A334 L335 I336 T340 V341 N342	V286-F338 HydrophobicContact CG1-CE2 4.32Å; V286-F338 HydrophobicContact CG1-CZ 3.78Å; R289-F338 HydrophobicContact CB-CD2 3.55Å; R289-F338 HydrophobicContact CB-CE2 3.4Å; R289-F338 VanDerWaalsContact CB-CE2 3.4Å; R289-F338 HydrophobicContact CB-CG 4.19Å; R289-F338 HydrophobicContact CB-CZ 3.94Å; R289-F338 HydrophobicContact CG-CD2 4.28Å; R289-F338 HydrophobicContact CG-CE2 4.27Å; T290-F338 WeakPolarHBondContact OG1-CE1 3.32Å; T290-F338 VanDerWaalsContact OG1-CZ 3.22Å; T290-F338 WeakPolarHBondContact OG1-CZ 3.42Å; A334-F338 PolarHBondContact O-N 3.4Å; A334-F338 VanDerWaalsContact O-N 3.09Å; L335-F338 HydrophobicContact CD1-CD1 4.38Å; L335-F338 PolarHBondContact O-N 3.42Å; I336-F338 VanDerWaalsContact C-N 3.32Å; I336-F338 PolarHBondContact O-N 2.96Å; F338-T340 VanDerWaalsContact C-N 3.25Å; F338-T340 PolarHBondContact O-N 3.45Å; F338-V341 PolarHBondContact O-N 3.32Å; F338-N342 HydrophobicContact CE2-CB 4.39Å; F338-N342 WeakPolarHBondContact O-CB 3.45Å; F338-N342 PolarHBondContact O-N 3.06Å
339	A	90.8	Very high	85.5	Confident	55 Å²	55	73.6 Å²	73.6	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-58.7	-40.5	176.8	0	0	0	0	0	111.5	L335 I336 E337 N342 Y343	L335-A339 PolarHBondContact O-N 3.5Å; I336-A339 PolarHBondContact O-N 3.38Å; E337-A339 PolarHBondContact O-N 3.45Å; A339-N342 PolarHBondContact O-N 3.09Å; A339-Y343 WeakPolarHBondContact O-CB 3.35Å; A339-Y343 PolarHBondContact O-N 3.39Å
340	T	89.9	Confident	83.9	Confident	52 Å²	52	74.6 Å²	74.6	32%	0.319	37%	0.371	S	S	.	.	H	α-helix	trans	-66.5	-46.4	177.3	-53.3	0	0	0	0	111.3	I336 E337 F338 N342 Y343 F344 I425	I336-T340 WeakPolarHBondContact O-CB 3.43Å; I336-T340 PolarHBondContact O-N 3.37Å; I336-T340 PolarHBondContact O-OG1 3.26Å; E337-T340 WeakPolarHBondContact O-CB 3.2Å; E337-T340 PolarHBondContact O-N 3.34Å; E337-T340 VanDerWaalsContact O-N 3.14Å; F338-T340 VanDerWaalsContact C-N 3.25Å; F338-T340 PolarHBondContact O-N 3.45Å; T340-N342 VanDerWaalsContact C-N 3.31Å; T340-N342 PolarHBondContact O-N 3.13Å; T340-Y343 PolarHBondContact O-N 3.35Å; T340-F344 HydrophobicContact CG2-CD2 3.83Å; T340-F344 HydrophobicContact CG2-CE2 3.65Å; T340-F344 WeakPolarHBondContact O-CD2 3.34Å; T340-F344 PolarHBondContact O-N 3.24Å; T340-F344 VanDerWaalsContact O-N 3.11Å; T340-I425 HydrophobicContact CG2-CD1 4Å
341	V	88.8	Confident	82.2	Confident	2 Å²	2	80.3 Å²	80.3	1%	0.012	39%	0.391	C	S	.	.	H	α-helix	trans	-61	-41.7	176.2	171.5	0	0	0	0	111.1	R283 E337 F338 F344 T345 I425	R283-V341 HydrophobicContact CB-CG1 4.12Å; E337-V341 WeakPolarHBondContact O-CG2 3.45Å; E337-V341 PolarHBondContact O-N 3.22Å; E337-V341 VanDerWaalsContact OE1-CG2 3.24Å; E337-V341 WeakPolarHBondContact OE1-CG2 3.46Å; F338-V341 PolarHBondContact O-N 3.32Å; V341-F344 PolarHBondContact O-N 2.89Å; V341-T345 WeakPolarHBondContact O-CB 3.43Å; V341-T345 PolarHBondContact O-N 3.49Å; V341-T345 VanDerWaalsContact O-N 3.11Å; V341-T345 PolarHBondContact O-OG1 2.91Å; V341-I425 HydrophobicContact CG2-CB 4.13Å; V341-I425 HydrophobicContact CG2-CG2 4.02Å
342	N	87	Confident	80.8	Confident	67 Å²	67	83.5 Å²	83.5	36%	0.358	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-44.3	177.8	-167.5	8.7	0	0	0	111.4	F338 A339 T340 F344 T345	F338-N342 HydrophobicContact CE2-CB 4.39Å; F338-N342 WeakPolarHBondContact O-CB 3.45Å; F338-N342 PolarHBondContact O-N 3.06Å; A339-N342 PolarHBondContact O-N 3.09Å; T340-N342 VanDerWaalsContact C-N 3.31Å; T340-N342 PolarHBondContact O-N 3.13Å; N342-F344 VanDerWaalsContact C-N 3.32Å; N342-F344 PolarHBondContact O-N 3.27Å; N342-T345 WeakPolarHBondContact O-CB 3.34Å; N342-T345 PolarHBondContact O-N 3.35Å
343	Y	86.1	Confident	79.1	Confident	194 Å²	194	79.9 Å²	79.9	76%	0.761	40%	0.399	S	S	*	.	H	α-helix	trans	-58.7	-40.6	176.7	-176.9	-100.3	0	0	0	113	A339 T340 T345	A339-Y343 WeakPolarHBondContact O-CB 3.35Å; A339-Y343 PolarHBondContact O-N 3.39Å; T340-Y343 PolarHBondContact O-N 3.35Å; Y343-T345 VanDerWaalsContact C-N 3.3Å; Y343-T345 PolarHBondContact O-N 3.11Å
344	F	84.3	Confident	77.4	Confident	130 Å²	130	85.5 Å²	85.5	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-82	-3.9	177.1	-70	-64.3	0	0	0	114.2	T340 V341 N342 K346 I425	T340-F344 HydrophobicContact CG2-CD2 3.83Å; T340-F344 HydrophobicContact CG2-CE2 3.65Å; T340-F344 WeakPolarHBondContact O-CD2 3.34Å; T340-F344 PolarHBondContact O-N 3.24Å; T340-F344 VanDerWaalsContact O-N 3.11Å; V341-F344 PolarHBondContact O-N 2.89Å; N342-F344 VanDerWaalsContact C-N 3.32Å; N342-F344 PolarHBondContact O-N 3.27Å; F344-K346 PolarHBondContact O-N 3.08Å; F344-K346 VanDerWaalsContact O-N 3.14Å; F344-I425 HydrophobicContact CD2-CD1 3.91Å; F344-I425 HydrophobicContact CE2-CD1 4.37Å
345	T	78.3	Confident	75.7	Confident	30 Å²	30	90 Å²	90	18%	0.184	44%	0.436	C	S	.	.			trans	-82.9	91.6	178.3	-63.7	0	0	0	0	110.3	R283 V341 N342 Y343 R347	R283-T345 HydrophobicContact CG-CG2 4.3Å; V341-T345 WeakPolarHBondContact O-CB 3.43Å; V341-T345 PolarHBondContact O-N 3.49Å; V341-T345 VanDerWaalsContact O-N 3.11Å; V341-T345 PolarHBondContact O-OG1 2.91Å; N342-T345 WeakPolarHBondContact O-CB 3.34Å; N342-T345 PolarHBondContact O-N 3.35Å; Y343-T345 VanDerWaalsContact C-N 3.3Å; Y343-T345 PolarHBondContact O-N 3.11Å; T345-R347 VanDerWaalsContact C-N 3.28Å; T345-R347 PolarHBondContact O-N 3.29Å
346	K	64.8	Low	74	Confident	204 Å²	204	88.8 Å²	88.8	89%	0.887	43%	0.432	S	S	*	.			trans	-71.6	-7.5	-177.2	-70.3	-175.4	176.9	-177.7	0	115.8	F344	F344-K346 PolarHBondContact O-N 3.08Å; F344-K346 VanDerWaalsContact O-N 3.14Å
347	R	63.7	Low	72.1	Confident	138 Å²	138	91.2 Å²	91.2	52%	0.521	44%	0.443	S	S	.	.			trans	-148.9	129.2	-173	-163.3	168.2	-81.5	154.5	-5.9	111.1	T345 N420	T345-R347 VanDerWaalsContact C-N 3.28Å; T345-R347 PolarHBondContact O-N 3.29Å; R347-N420 PolarHBondContact O-ND2 3.43Å
348	S	59.1	Low	70.3	Confident	100 Å²	100	97.5 Å²	97.5	70%	0.699	47%	0.472	S	S	*	.			trans	-92.2	5.4	-168	-159.1	0	0	0	0	115.6
349	W	59.6	Low	68.6	Low	189 Å²	189	100.8 Å²	100.8	72%	0.716	50%	0.503	S	S	*	.			trans	-86.9	125.5	-168.6	-65.5	70.8	0	0	0	111.7
350	A	61.3	Low	66.8	Low	69 Å²	69	105.7 Å²	105.7	57%	0.57	52%	0.516	S	S	*	.			trans	-65.4	145.5	178.2	0	0	0	0	0	112.8	E284 D352	E284-A350 HydrophobicContact CB-CB 4.32Å; E284-A350 VanDerWaalsContact CD-CA 3.49Å; E284-A350 WeakPolarHBondContact OE2-CA 3.49Å; A350-D352 PolarHBondContact O-N 2.86Å
351	W	61	Low	64.5	Low	148 Å²	148	110.8 Å²	110.8	56%	0.561	54%	0.536	S	S	*	.			trans	-63.8	102.5	171.9	-173	86.6	0	0	0	111.2	E284 G353 A356 Y419	E284-W351 PolarHBondContact OE2-N 3.35Å; W351-G353 VanDerWaalsContact CE3-CA 3.46Å; W351-G353 PolarHBondContact O-N 2.94Å; W351-A356 HydrophobicContact CZ2-CB 3.52Å; W351-Y419 HydrophobicContact CB-CD1 4.03Å; W351-Y419 HydrophobicContact CB-CE1 4.26Å; W351-Y419 AromaticContact CD1-CD1 3.32Å; W351-Y419 AromaticContact CD1-CD2 3.82Å; W351-Y419 AromaticContact CD1-CE1 3.55Å; W351-Y419 AromaticContact CD1-CG 3.43Å; W351-Y419 VanDerWaalsContact CD1-CG 3.43Å; W351-Y419 AromaticContact CD1-CZ 3.9Å; W351-Y419 AromaticContact CG-CD1 3.97Å; W351-Y419 HydrophobicContact CG-CD1 3.97Å; W351-Y419 HydrophobicContact CG-CE1 4.04Å; W351-Y419 HydrophobicContact CG-CG 4.45Å
352	D	67.5	Low	62.2	Low	68 Å²	68	116.6 Å²	116.6	36%	0.364	57%	0.574	S	S	.	*			trans	-80.5	99.1	171.2	-175.4	-1.6	0	0	0	109.4	A350 K354 K355 A356 Y419	A350-D352 PolarHBondContact O-N 2.86Å; D352-K354 PolarHBondContact O-N 2.92Å; D352-K354 PolarHBondContact OD1-N 2.81Å; D352-K355 PolarHBondContact O-N 3.15Å; D352-K355 VanDerWaalsContact O-N 3.17Å; D352-K355 VanDerWaalsContact OD2-CD 3.26Å; D352-K355 WeakPolarHBondContact OD2-CD 3.39Å; D352-K355 VanDerWaalsContact OD2-CE 3.25Å; D352-K355 WeakPolarHBondContact OD2-CE 3.4Å; D352-K355 WeakPolarHBondContact OD2-CG 3.41Å; D352-K355 IonicContact OD2-NZ 3.91Å; D352-A356 PolarHBondContact O-N 3.25Å; D352-Y419 PolarHBondContact O-OH 3.15Å
353	G	59.7	Low	60.2	Low	23 Å²	23	123.2 Å²	123.2	24%	0.237	60%	0.6	C	S	.	*	H	α-helix	trans	-63	-21	-174.9	0	0	0	0	0	115.1	W351	W351-G353 VanDerWaalsContact CE3-CA 3.46Å; W351-G353 PolarHBondContact O-N 2.94Å
354	K	58.9	Low	57.8	Low	167 Å²	167	122.9 Å²	122.9	73%	0.726	60%	0.602	S	S	*	*	H	α-helix	trans	-71.2	-37	176.6	-129.8	177	-179	-177.4	0	111.8	D352	D352-K354 PolarHBondContact O-N 2.92Å; D352-K354 PolarHBondContact OD1-N 2.81Å
355	K	57.5	Low	55.6	Low	101 Å²	101	126.3 Å²	126.3	44%	0.439	62%	0.617	S	S	.	*	H	α-helix	trans	-84.6	-23.2	-176.1	-65.7	-174.1	-176.5	179.8	0	114	D352 A359	D352-K355 PolarHBondContact O-N 3.15Å; D352-K355 VanDerWaalsContact O-N 3.17Å; D352-K355 VanDerWaalsContact OD2-CD 3.26Å; D352-K355 WeakPolarHBondContact OD2-CD 3.39Å; D352-K355 VanDerWaalsContact OD2-CE 3.25Å; D352-K355 WeakPolarHBondContact OD2-CE 3.4Å; D352-K355 WeakPolarHBondContact OD2-CG 3.41Å; D352-K355 IonicContact OD2-NZ 3.91Å; K355-A359 PolarHBondContact O-N 3.32Å
356	A	57.1	Low	53.4	Low	17 Å²	17	131.2 Å²	131.2	14%	0.14	64%	0.642	C	S	.	*	H	α-helix	trans	-71.9	-34.3	175.4	0	0	0	0	0	112.4	W351 D352 Y419	W351-A356 HydrophobicContact CZ2-CB 3.52Å; D352-A356 PolarHBondContact O-N 3.25Å; A356-Y419 HydrophobicContact CB-CE2 4.12Å
357	M	53.7	Low	52.1	Low	135 Å²	135	127 Å²	127	67%	0.665	64%	0.636	S	S	*	*	H	α-helix	trans	-74.8	-36.6	177.1	-61.9	-165.4	85.5	0	0	112.4	A359 Q360	M357-A359 VanDerWaalsContact C-N 3.25Å; M357-A359 PolarHBondContact O-N 3.48Å; M357-Q360 PolarHBondContact O-N 2.96Å
358	E	56.2	Low	50.8	Low	141 Å²	141	128.7 Å²	128.7	66%	0.659	65%	0.654	S	S	*	*	H	α-helix	trans	-63.7	-29.9	173.5	-73.8	176.1	162.3	0	0	112.6	Q360	E358-Q360 VanDerWaalsContact C-N 3.33Å
359	A	56.4	Low	49.4	Very low	86 Å²	86	128.7 Å²	128.7	71%	0.711	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-12.8	177	0	0	0	0	0	114.3	K355 M357	K355-A359 PolarHBondContact O-N 3.32Å; M357-A359 VanDerWaalsContact C-N 3.25Å; M357-A359 PolarHBondContact O-N 3.48Å
360	Q	51.1	Low	48.1	Very low	159 Å²	159	127.8 Å²	127.8	74%	0.743	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-8.8	178.8	-87.4	176	-21.6	0	0	113.9	M357 E358 P362	M357-Q360 PolarHBondContact O-N 2.96Å; E358-Q360 VanDerWaalsContact C-N 3.33Å; Q360-P362 VanDerWaalsContact O-CD 3.28Å; Q360-P362 WeakPolarHBondContact O-CD 3.45Å
361	Q	42.5	Very low	46.4	Very low	158 Å²	158	130.3 Å²	130.3	74%	0.738	68%	0.682	S	S	*	*	S	Bend	trans	-79	116.4	170.4	-82.4	-172.9	-11.4	0	0	110.6	K363	Q361-K363 PolarHBondContact O-N 2.99Å
362	P	40.7	Very low	44.8	Very low	124 Å²	124	131.6 Å²	131.6	81%	0.805	70%	0.696	S	S	*	*			trans	-69.8	121.3	173.4	27.7	-30.7	0	0	0	109.4	Q360 K364	Q360-P362 VanDerWaalsContact O-CD 3.28Å; Q360-P362 WeakPolarHBondContact O-CD 3.45Å; P362-K364 PolarHBondContact O-N 3.25Å
363	K	45.3	Very low	43.1	Very low	207 Å²	207	136.7 Å²	136.7	90%	0.9	72%	0.715	S	S	*	*			trans	-61.4	105.1	166.2	-78.5	-174	176.1	-179.8	0	108.8	Q361 K365	Q361-K363 PolarHBondContact O-N 2.99Å; K363-K365 PolarHBondContact O-N 3.35Å
364	K	35	Very low	41.8	Very low	187 Å²	187	141.4 Å²	141.4	81%	0.813	74%	0.742	S	S	*	*			trans	-61.4	118.5	168	-132.5	-176.9	-179.4	-169.6	0	108.1	P362	P362-K364 PolarHBondContact O-N 3.25Å
365	K	38.5	Very low	40.2	Very low	202 Å²	202	138.9 Å²	138.9	88%	0.878	74%	0.736	S	S	*	*			trans	-89	113	166.6	-82.8	-178.3	174.4	179.6	0	107.2	K363	K363-K365 PolarHBondContact O-N 3.35Å
366	D	32.3	Very low	38.9	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	75%	0.75	S	S	*	*			trans	-98.2	138.4	164.5	-70.5	-31.8	0	0	0	109.4
367	P	36.9	Very low	37.4	Very low	117 Å²	117	146.6 Å²	146.6	76%	0.76	79%	0.785	S	S	*	*			trans	-85	144.1	176.7	22.5	-12.4	0	0	0	112.9
368	L	37.5	Very low	36.3	Very low	173 Å²	173	145.8 Å²	145.8	91%	0.906	79%	0.791	S	S	*	*			trans	9.6	117.7	155.6	-76.7	138.6	0	0	0	118.9
369	A	29.7	Very low	34.9	Very low	100 Å²	100	144.4 Å²	144.4	83%	0.826	80%	0.797	S	S	*	*			trans	-151.2	129.4	144.4	0	0	0	0	0	111
370	L	30.5	Very low	33.4	Very low	170 Å²	170	146.4 Å²	146.4	89%	0.89	80%	0.801	S	S	*	*			trans	-62.4	147.1	168.7	-78.8	92.4	0	0	0	111.1
371	S	25.8	Very low	32.3	Very low	121 Å²	121	142.7 Å²	142.7	85%	0.846	81%	0.806	S	S	*	*				178.1	168.1	120.9	-163.7	0	0	0	0	111.4
372	M	28	Very low	31.7	Very low	176 Å²	176	139.7 Å²	139.7	87%	0.867	80%	0.798	S	S	*	*			trans	-74.9	160.2	-149.9	-60.5	-178.3	87.7	0	0	118.1
373	K	31.3	Very low	31	Very low	174 Å²	174	141.1 Å²	141.1	76%	0.757	80%	0.799	S	S	*	*			trans	-52.3	156.3	157.3	-112.5	179.9	-179.7	-173.6	0	112.6
374	P	32.1	Very low	30.1	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	79%	0.792	S	S	*	*				-141.9	139.6	82	32	-12.8	0	0	0	113.5
375	N	27.2	Very low	29.8	Very low	114 Å²	114	138.2 Å²	138.2	61%	0.61	79%	0.794	S	S	*	*				81.5	127.2	73	-124.6	40.4	0	0	0	115.9
376	N	29.7	Very low	29.3	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	79%	0.786	S	S	*	*			trans	74.2	133.9	165.7	-59.3	0.1	0	0	0	115.9
377	T	26	Very low	29	Very low	144 Å²	144	133.5 Å²	133.5	88%	0.883	79%	0.79	S	S	*	*			cis	-155.3	159.1	43	19.8	0	0	0	0	112.5
378	C	30.7	Very low	28.7	Very low	118 Å²	118	135.1 Å²	135.1	80%	0.797	79%	0.792	S	S	*	*			trans	-91.5	147.9	176.1	-178.5	0	0	0	0	111.2
379	S	26.1	Very low	28.2	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	79%	0.785	S	S	*	*			trans	-155	103.4	150.5	52.4	0	0	0	0	111.7
380	T	25	Very low	28.1	Very low	128 Å²	128	138 Å²	138	79%	0.785	79%	0.789	S	S	*	*			trans	-14.3	137.9	147.5	35.6	0	0	0	0	118.5
381	G	28.4	Very low	27.8	Very low	82 Å²	82	137.4 Å²	137.4	85%	0.845	79%	0.787	S	S	*	*			trans	-160.3	97.2	159.8	0	0	0	0	0	110.2
382	V	29.4	Very low	28	Very low	95 Å²	95	136.7 Å²	136.7	58%	0.576	79%	0.788	S	S	*	*			trans	-84.7	146.6	-179.2	177.9	0	0	0	0	109.6	Y384	V382-Y384 HydrophobicContact CG1-CD2 3.92Å; V382-Y384 HydrophobicContact CG1-CE2 3.42Å; V382-Y384 VanDerWaalsContact CG1-CE2 3.42Å
383	N	26.2	Very low	28	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	78%	0.78	S	S	*	*				-178	143.9	126.8	-87.9	-18.1	0	0	0	115.4
384	Y	26.4	Very low	27.8	Very low	193 Å²	193	132.3 Å²	132.3	76%	0.757	78%	0.783	S	S	*	*			trans	-76.9	156.2	-166	-61.1	-98	0	0	0	114.5	V382	V382-Y384 HydrophobicContact CG1-CD2 3.92Å; V382-Y384 HydrophobicContact CG1-CE2 3.42Å; V382-Y384 VanDerWaalsContact CG1-CE2 3.42Å
385	T	27.4	Very low	27.5	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	78%	0.781	S	S	*	*				165.6	156.6	87.8	39	0	0	0	0	106.1
386	A	28.2	Very low	27.5	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	79%	0.788	S	S	*	*			cis	-159.4	139.4	29.6	0	0	0	0	0	112.9
387	N	27	Very low	27.5	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	79%	0.79	S	S	*	*			trans	38	119.4	131.4	-62.6	-12.9	0	0	0	121.8
388	L	29.7	Very low	27.6	Very low	152 Å²	152	131.3 Å²	131.3	80%	0.796	79%	0.785	S	S	*	*				90.9	111.1	80.8	-144.7	85.5	0	0	0	111
389	T	26.9	Very low	27.4	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	79%	0.786	S	S	*	*				178.8	139.1	81.4	35	0	0	0	0	108.8
390	K	29	Very low	27.5	Very low	208 Å²	208	132.9 Å²	132.9	90%	0.904	79%	0.786	S	S	*	*				171	125.4	114.3	-147.1	168	-172	173.3	0	110.7
391	D	24.5	Very low	27.5	Very low	159 Å²	159	132.6 Å²	132.6	85%	0.85	79%	0.785	S	S	*	*			trans	-67.1	148.2	-175.5	-55.9	-71.2	0	0	0	114.8
392	A	28.5	Very low	27.3	Very low	106 Å²	106	134.7 Å²	134.7	88%	0.876	78%	0.781	S	S	*	*			trans	-161	132.9	133.6	0	0	0	0	0	110.7
393	S	27.9	Very low	27.2	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	79%	0.787	S	S	*	*			trans	-95.4	142	-157.7	47.8	0	0	0	0	115.7
394	I	27.1	Very low	27.2	Very low	158 Å²	158	137.4 Å²	137.4	81%	0.81	79%	0.785	S	S	*	*				58	121.8	127.4	-52.2	167.1	0	0	0	119.7
395	S	26	Very low	27.4	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	79%	0.789	S	S	*	*				152.1	142.9	125.3	51.8	0	0	0	0	109.2
396	T	27.9	Very low	27.3	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	78%	0.781	S	S	*	*			cis	-163.7	142.4	-9.1	-78	0	0	0	0	104.5
397	I	29.5	Very low	27.1	Very low	148 Å²	148	138 Å²	138	76%	0.759	78%	0.782	S	S	*	*			trans	-67.9	129	171.9	-67.3	165.5	0	0	0	109.2
398	S	28	Very low	27	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	78%	0.783	S	S	*	*			trans	-151.6	121.5	142.3	54	0	0	0	0	110.8
399	N	27	Very low	26.9	Very low	150 Å²	150	136.6 Å²	136.6	80%	0.802	78%	0.78	S	S	*	*			trans	-72.2	134.2	178.4	-68.4	-33.2	0	0	0	110.3
400	S	26.9	Very low	27	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	78%	0.778	S	S	*	*			trans	-141.1	115.4	144.2	52.1	0	0	0	0	109.6	T402	S400-T402 PolarHBondContact O-N 3.49Å
401	T	24.9	Very low	27.2	Very low	122 Å²	122	135.5 Å²	135.5	75%	0.748	78%	0.777	S	S	*	*			trans	-62.3	123	176.9	-44	0	0	0	0	109.4	I403	T401-I403 HydrophobicContact CG2-CG1 4.1Å
402	T	25.7	Very low	27.7	Very low	125 Å²	125	131.8 Å²	131.8	77%	0.767	77%	0.769	S	S	*	*			trans	-123.8	109.8	152.1	-41.9	0	0	0	0	107.2	S400 Q404	S400-T402 PolarHBondContact O-N 3.49Å; T402-Q404 PolarHBondContact O-N 3.47Å
403	I	26.6	Very low	28.2	Very low	139 Å²	139	132.3 Å²	132.3	71%	0.713	76%	0.763	S	S	*	*			trans	-65	115	172.5	-64.6	171.1	0	0	0	106.8	T401	T401-I403 HydrophobicContact CG2-CG1 4.1Å
404	Q	25.8	Very low	29	Very low	167 Å²	167	134.6 Å²	134.6	78%	0.78	77%	0.768	S	S	*	*			trans	-121.1	115.9	160.9	-86.1	-72.7	18.7	0	0	108.1	T402 K406	T402-Q404 PolarHBondContact O-N 3.47Å; Q404-K406 PolarHBondContact O-N 2.94Å
405	L	31.4	Very low	29.8	Very low	159 Å²	159	132.6 Å²	132.6	83%	0.832	77%	0.765	S	S	*	*			trans	-58.6	114.8	165.6	-104.5	80.6	0	0	0	108.1
406	K	24.4	Very low	30.6	Very low	159 Å²	159	136.6 Å²	136.6	69%	0.691	77%	0.768	S	S	*	*			trans	-112.5	127.3	162.6	-164.7	177.4	177.2	-164.5	0	108.4	Q404 E409	Q404-K406 PolarHBondContact O-N 2.94Å; K406-E409 IonicContact NZ-OE1 3.22Å; K406-E409 PolarHBondContact NZ-OE1 2.94Å
407	P	24.3	Very low	31.7	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	76%	0.757	S	S	*	*			trans	-61.2	151.6	178.9	-16.8	29.1	0	0	0	111.2	E409	P407-E409 PolarHBondContact O-N 3.15Å; P407-E409 VanDerWaalsContact O-N 3.08Å
408	S	25.4	Very low	32.9	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	75%	0.75	S	S	*	*			trans	-51.6	117.5	175.3	69.6	0	0	0	0	109.8	S410	S408-S410 VanDerWaalsContact C-N 3.29Å; S408-S410 PolarHBondContact O-N 2.78Å
409	E	27.5	Very low	34.3	Very low	157 Å²	157	132 Å²	132	73%	0.734	73%	0.725	S	S	*	*			trans	-70.7	93.2	172.4	-140.6	163.6	-127.9	0	0	106.8	K406 P407 K411	K406-E409 IonicContact NZ-OE1 3.22Å; K406-E409 PolarHBondContact NZ-OE1 2.94Å; P407-E409 PolarHBondContact O-N 3.15Å; P407-E409 VanDerWaalsContact O-N 3.08Å; E409-K411 PolarHBondContact O-N 3.38Å
410	S	29.1	Very low	36	Very low	102 Å²	102	127.1 Å²	127.1	71%	0.713	70%	0.699	S	S	*	*			trans	-53.6	113.3	163.7	53.6	0	0	0	0	106.8	S408 A412	S408-S410 VanDerWaalsContact C-N 3.29Å; S408-S410 PolarHBondContact O-N 2.78Å; S410-A412 PolarHBondContact O-N 3.12Å
411	K	33.3	Very low	37.8	Very low	206 Å²	206	126.7 Å²	126.7	90%	0.896	70%	0.696	S	S	*	*			trans	-48.9	108.1	168.6	-81.8	-177.4	175.2	179.5	0	107.8	E409	E409-K411 PolarHBondContact O-N 3.38Å
412	A	34.8	Very low	39.7	Very low	81 Å²	81	123.8 Å²	123.8	67%	0.669	68%	0.678	S	S	*	*			trans	-54.7	133.4	168.8	0	0	0	0	0	107.3	S410 D414	S410-A412 PolarHBondContact O-N 3.12Å; A412-D414 PolarHBondContact O-N 3.05Å
413	P	39.3	Very low	42.2	Very low	117 Å²	117	118.9 Å²	118.9	76%	0.76	65%	0.649	S	S	*	*			trans	-62	131.3	174.9	26.5	-30.5	0	0	0	107.7
414	D	43.7	Very low	44.9	Very low	149 Å²	149	121.2 Å²	121.2	80%	0.797	65%	0.654	S	S	*	*			trans	-43.5	131.6	170.7	-74.3	-54.9	0	0	0	109.2	A412 K416	A412-D414 PolarHBondContact O-N 3.05Å; D414-K416 PolarHBondContact O-N 2.95Å
415	P	44.7	Very low	47.8	Very low	115 Å²	115	115.9 Å²	115.9	75%	0.747	63%	0.63	S	S	*	*			trans	-59.5	113.5	178.1	23.7	-30.9	0	0	0	107.2	K417	P415-K417 PolarHBondContact O-N 2.83Å
416	K	42.5	Very low	50.5	Low	194 Å²	194	108.5 Å²	108.5	84%	0.843	59%	0.591	S	S	*	*			trans	-44.8	109.7	176	-75.8	180	177.4	179.4	0	107.9	D414 T418	D414-K416 PolarHBondContact O-N 2.95Å; K416-T418 VanDerWaalsContact C-N 3.33Å; K416-T418 PolarHBondContact O-N 3.25Å; K416-T418 PolarHBondContact O-OG1 3.46Å
417	K	50.7	Low	53.5	Low	122 Å²	122	106.7 Å²	106.7	53%	0.53	58%	0.584	S	S	.	*			trans	-59.5	100	178.4	-71.2	-174.2	-180	-172.2	0	107.5	P415 Y419	P415-K417 PolarHBondContact O-N 2.83Å; K417-Y419 WeakPolarHBondContact O-CD2 3.28Å; K417-Y419 PolarHBondContact O-N 2.83Å
418	T	54.4	Low	56.7	Low	100 Å²	100	107.1 Å²	107.1	61%	0.613	58%	0.577	S	S	*	*			trans	-84.6	107.7	177.8	-55	0	0	0	0	106.4	K416	K416-T418 VanDerWaalsContact C-N 3.33Å; K416-T418 PolarHBondContact O-N 3.25Å; K416-T418 PolarHBondContact O-OG1 3.46Å
419	Y	58.2	Low	59.9	Low	67 Å²	67	102.1 Å²	102.1	26%	0.263	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-71.2	147.4	177.8	-61.2	-83.2	0	0	0	110.5	W351 D352 A356 K417 S421	W351-Y419 HydrophobicContact CB-CD1 4.03Å; W351-Y419 HydrophobicContact CB-CE1 4.26Å; W351-Y419 AromaticContact CD1-CD1 3.32Å; W351-Y419 AromaticContact CD1-CD2 3.82Å; W351-Y419 AromaticContact CD1-CE1 3.55Å; W351-Y419 AromaticContact CD1-CG 3.43Å; W351-Y419 VanDerWaalsContact CD1-CG 3.43Å; W351-Y419 AromaticContact CD1-CZ 3.9Å; W351-Y419 AromaticContact CG-CD1 3.97Å; W351-Y419 HydrophobicContact CG-CD1 3.97Å; W351-Y419 HydrophobicContact CG-CE1 4.04Å; W351-Y419 HydrophobicContact CG-CG 4.45Å; D352-Y419 PolarHBondContact O-OH 3.15Å; A356-Y419 HydrophobicContact CB-CE2 4.12Å; K417-Y419 WeakPolarHBondContact O-CD2 3.28Å; K417-Y419 PolarHBondContact O-N 2.83Å; Y419-S421 PolarHBondContact O-N 2.66Å
420	N	63.3	Low	63.1	Low	46 Å²	46	97.6 Å²	97.6	25%	0.246	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-69.8	128.6	175.8	-76.1	-13.9	0	0	0	109.4	R283 R347	R283-N420 VanDerWaalsContact CZ-O 3.28Å; R283-N420 PolarHBondContact NH1-O 2.93Å; R283-N420 VanDerWaalsContact NH1-O 3.11Å; R283-N420 PolarHBondContact NH2-O 3.11Å; R347-N420 PolarHBondContact O-ND2 3.43Å
421	S	64.4	Low	66.2	Low	105 Å²	105	98.2 Å²	98.2	73%	0.734	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-72.2	147.6	173.2	59.8	0	0	0	0	111	R283 Y419 S423	R283-S421 VanDerWaalsContact CZ-O 3.3Å; R283-S421 PolarHBondContact NE-O 3.27Å; R283-S421 PolarHBondContact NH2-O 2.86Å; Y419-S421 PolarHBondContact O-N 2.66Å; S421-S423 PolarHBondContact O-N 3.31Å
422	V	65.4	Low	69.1	Low	62 Å²	62	91 Å²	91	38%	0.376	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-47.5	129.3	177.3	-178.6	0	0	0	0	109.2	K424 K427	V422-K424 PolarHBondContact O-N 3.43Å; V422-K427 HydrophobicContact CG1-CD 4.41Å; V422-K427 HydrophobicContact CG1-CG 3.72Å
423	S	76.6	Confident	72	Confident	22 Å²	22	88.6 Å²	88.6	15%	0.154	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-59	134.8	-177.2	-174.7	0	0	0	0	108.8	S421 I425 D426 K427	S421-S423 PolarHBondContact O-N 3.31Å; S423-I425 PolarHBondContact O-N 3.35Å; S423-I425 WeakPolarHBondContact OG-CB 3.5Å; S423-I425 PolarHBondContact OG-N 3.14Å; S423-D426 VanDerWaalsContact CB-OD2 3.28Å; S423-D426 WeakPolarHBondContact CB-OD2 3.47Å; S423-D426 PolarHBondContact O-N 2.85Å; S423-K427 PolarHBondContact O-N 3.45Å; S423-K427 VanDerWaalsContact O-N 3.13Å
424	K	83.9	Confident	74.6	Confident	188 Å²	188	85.5 Å²	85.5	82%	0.817	44%	0.44	S	S	*	.	H	α-helix	trans	-58.2	-30	172.9	-68.1	-177	-179.7	179.9	0	110.6	V422 M428	V422-K424 PolarHBondContact O-N 3.43Å; K424-M428 PolarHBondContact O-N 3.11Å; K424-M428 VanDerWaalsContact O-N 3.13Å
425	I	86.7	Confident	77.1	Confident	55 Å²	55	82.6 Å²	82.6	28%	0.282	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-56.8	176.3	-54	171.8	0	0	0	109.6	E337 T340 V341 F344 S423 K427 M428 S429	E337-I425 HydrophobicContact CG-CG2 4.25Å; T340-I425 HydrophobicContact CG2-CD1 4Å; V341-I425 HydrophobicContact CG2-CB 4.13Å; V341-I425 HydrophobicContact CG2-CG2 4.02Å; F344-I425 HydrophobicContact CD2-CD1 3.91Å; F344-I425 HydrophobicContact CE2-CD1 4.37Å; S423-I425 PolarHBondContact O-N 3.35Å; S423-I425 WeakPolarHBondContact OG-CB 3.5Å; S423-I425 PolarHBondContact OG-N 3.14Å; I425-K427 PolarHBondContact O-N 3.43Å; I425-K427 VanDerWaalsContact O-N 3.17Å; I425-M428 PolarHBondContact O-N 2.75Å; I425-S429 PolarHBondContact O-N 2.94Å; I425-S429 PolarHBondContact O-OG 2.92Å
426	D	87.2	Confident	79.6	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.016	42%	0.415	C	S	.	.	H	α-helix	trans	-54.7	-40	177.8	-69.5	-58.7	0	0	0	111.7	R289 S423 M428 S429 R430	R289-D426 IonicContact CZ-OD1 3.37Å; R289-D426 IonicContact NH1-OD1 2.92Å; R289-D426 PolarHBondContact NH1-OD1 3.35Å; R289-D426 IonicContact NH1-OD2 3.64Å; R289-D426 IonicContact NH2-OD1 2.86Å; R289-D426 PolarHBondContact NH2-OD1 2.76Å; S423-D426 VanDerWaalsContact CB-OD2 3.28Å; S423-D426 WeakPolarHBondContact CB-OD2 3.47Å; S423-D426 PolarHBondContact O-N 2.85Å; D426-M428 PolarHBondContact O-N 3.11Å; D426-S429 PolarHBondContact O-N 3.43Å; D426-R430 WeakPolarHBondContact O-CG 3.38Å; D426-R430 PolarHBondContact O-N 3Å; D426-R430 VanDerWaalsContact O-N 3.09Å
427	K	88.6	Confident	82.2	Confident	121 Å²	121	72.8 Å²	72.8	53%	0.526	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-40.1	177.9	-70.3	-170	-176.2	-174.1	0	112.7	V422 S423 I425	V422-K427 HydrophobicContact CG1-CD 4.41Å; V422-K427 HydrophobicContact CG1-CG 3.72Å; S423-K427 PolarHBondContact O-N 3.45Å; S423-K427 VanDerWaalsContact O-N 3.13Å; I425-K427 PolarHBondContact O-N 3.43Å; I425-K427 VanDerWaalsContact O-N 3.17Å
428	M	91.3	Very high	84.4	Confident	122 Å²	122	68.5 Å²	68.5	60%	0.601	37%	0.368	S	S	*	.	H	α-helix	trans	-71.7	-46	178	-169.9	64.8	73.2	0	0	110.6	K424 I425 D426 R430 I431 V432	K424-M428 PolarHBondContact O-N 3.11Å; K424-M428 VanDerWaalsContact O-N 3.13Å; I425-M428 PolarHBondContact O-N 2.75Å; D426-M428 PolarHBondContact O-N 3.11Å; M428-R430 VanDerWaalsContact C-N 3.25Å; M428-R430 PolarHBondContact O-N 3.41Å; M428-I431 PolarHBondContact O-N 3.13Å; M428-V432 HydrophobicContact CG-CG2 3.77Å; M428-V432 WeakPolarHBondContact O-CG2 3.47Å; M428-V432 PolarHBondContact O-N 3.12Å; M428-V432 HydrophobicContact SD-CG2 3.84Å
429	S	92.9	Very high	86.4	Confident	10 Å²	10	67.4 Å²	67.4	7%	0.07	36%	0.361	C	S	.	.	H	α-helix	trans	-57.6	-37.1	-179.8	-55.1	0	0	0	0	112.4	E337 I425 D426 I431 F433	E337-S429 VanDerWaalsContact CG-OG 3.29Å; E337-S429 WeakPolarHBondContact CG-OG 3.24Å; E337-S429 PolarHBondContact OE1-OG 3.47Å; I425-S429 PolarHBondContact O-N 2.94Å; I425-S429 PolarHBondContact O-OG 2.92Å; D426-S429 PolarHBondContact O-N 3.43Å; S429-I431 PolarHBondContact O-N 3.22Å; S429-F433 WeakPolarHBondContact O-CB 3.36Å; S429-F433 PolarHBondContact O-N 3.01Å; S429-F433 VanDerWaalsContact O-N 3.16Å
430	R	93.4	Very high	88.2	Confident	62 Å²	62	66.3 Å²	66.3	23%	0.234	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-25.2	175.5	-75.9	169.1	-165.6	-166.3	1	114.7	F279 W280 D426 M428 P434	F279-R430 HydrophobicContact CB-CG 3.89Å; F279-R430 PolarHBondContact O-NE 3.07Å; F279-R430 PolarHBondContact O-NH2 2.82Å; W280-R430 HydrophobicContact CZ2-CG 4.39Å; D426-R430 WeakPolarHBondContact O-CG 3.38Å; D426-R430 PolarHBondContact O-N 3Å; D426-R430 VanDerWaalsContact O-N 3.09Å; M428-R430 VanDerWaalsContact C-N 3.25Å; M428-R430 PolarHBondContact O-N 3.41Å; R430-P434 WeakPolarHBondContact O-CD 3.42Å; R430-P434 WeakPolarHBondContact O-CG 3.41Å
431	I	94.1	Very high	89.8	Confident	115 Å²	115	64.7 Å²	64.7	59%	0.59	35%	0.349	S	S	*	.	H	α-helix	trans	-103.3	-46.7	-179.3	-58	172.6	0	0	0	109.7	M428 S429 P434 V435	M428-I431 PolarHBondContact O-N 3.13Å; S429-I431 PolarHBondContact O-N 3.22Å; I431-P434 WeakPolarHBondContact O-CD 3.37Å; I431-V435 HydrophobicContact CG2-CG2 4.33Å; I431-V435 WeakPolarHBondContact O-CB 3.47Å; I431-V435 WeakPolarHBondContact O-CG2 3.44Å; I431-V435 PolarHBondContact O-N 3.28Å
432	V	95.2	Very high	91.3	Very high	56 Å²	56	66 Å²	66	34%	0.339	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-47	-172.9	172.8	0	0	0	0	111.9	M428 V435 L436	M428-V432 HydrophobicContact CG-CG2 3.77Å; M428-V432 WeakPolarHBondContact O-CG2 3.47Å; M428-V432 PolarHBondContact O-N 3.12Å; M428-V432 HydrophobicContact SD-CG2 3.84Å; V432-V435 PolarHBondContact O-N 3.45Å; V432-L436 HydrophobicContact CG1-CD1 3.54Å; V432-L436 HydrophobicContact CG1-CG 4.11Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 VanDerWaalsContact O-CG 3.26Å; V432-L436 WeakPolarHBondContact O-CG 3.42Å; V432-L436 PolarHBondContact O-N 3.31Å
433	F	94.9	Very high	92.7	Very high	30 Å²	30	67 Å²	67	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-49.1	-176.1	-83.3	-111.9	0	0	0	112.9	Q276 F279 F330 S429 V435 L436 F437	Q276-F433 HydrophobicContact CG-CB 4.22Å; F279-F433 HydrophobicContact CE2-CB 3.85Å; F279-F433 HydrophobicContact CE2-CD1 4.03Å; F279-F433 HydrophobicContact CE2-CD2 4.02Å; F279-F433 AromaticContact CE2-CG 3.72Å; F279-F433 HydrophobicContact CE2-CG 3.72Å; F279-F433 AromaticContact CZ-CD1 3.93Å; F279-F433 HydrophobicContact CZ-CD1 3.93Å; F279-F433 HydrophobicContact CZ-CD2 4.11Å; F279-F433 HydrophobicContact CZ-CE1 4.04Å; F279-F433 HydrophobicContact CZ-CE2 4.22Å; F279-F433 AromaticContact CZ-CG 3.97Å; F279-F433 HydrophobicContact CZ-CG 3.97Å; F279-F433 HydrophobicContact CZ-CZ 4.18Å; F330-F433 HydrophobicContact CD1-CD1 4.06Å; S429-F433 WeakPolarHBondContact O-CB 3.36Å; S429-F433 PolarHBondContact O-N 3.01Å; S429-F433 VanDerWaalsContact O-N 3.16Å; F433-V435 PolarHBondContact O-N 2.99Å; F433-L436 PolarHBondContact O-N 3.1Å; F433-F437 WeakPolarHBondContact O-CB 3.37Å; F433-F437 PolarHBondContact O-N 2.92Å
434	P	95.3	Very high	93.6	Very high	52 Å²	52	66.4 Å²	66.4	34%	0.338	35%	0.348	S	S	.	.	H	α-helix	trans	-61.7	-40.2	176.1	-24.4	33.5	0	0	0	113.4	R430 I431 F437 G438	R430-P434 WeakPolarHBondContact O-CD 3.42Å; R430-P434 WeakPolarHBondContact O-CG 3.41Å; I431-P434 WeakPolarHBondContact O-CD 3.37Å; P434-F437 PolarHBondContact O-N 3.3Å; P434-G438 PolarHBondContact O-N 3.2Å
435	V	96.3	Very high	94.2	Very high	87 Å²	87	60.1 Å²	60.1	53%	0.527	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-44.3	-179.8	170.6	0	0	0	0	111.3	I431 V432 F433 G438 T439	I431-V435 HydrophobicContact CG2-CG2 4.33Å; I431-V435 WeakPolarHBondContact O-CB 3.47Å; I431-V435 WeakPolarHBondContact O-CG2 3.44Å; I431-V435 PolarHBondContact O-N 3.28Å; V432-V435 PolarHBondContact O-N 3.45Å; F433-V435 PolarHBondContact O-N 2.99Å; V435-G438 PolarHBondContact O-N 3.29Å; V435-T439 WeakPolarHBondContact O-CB 3.47Å; V435-T439 PolarHBondContact O-N 3.19Å; V435-T439 PolarHBondContact O-OG1 2.99Å
436	L	96.4	Very high	94.5	Very high	94 Å²	94	60 Å²	60	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-43.9	176.6	-72.9	176.5	0	0	0	111.4	F330 V432 F433 T439 F440	F330-L436 HydrophobicContact CE1-CB 3.94Å; F330-L436 HydrophobicContact CZ-CB 3.96Å; V432-L436 HydrophobicContact CG1-CD1 3.54Å; V432-L436 HydrophobicContact CG1-CG 4.11Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 VanDerWaalsContact O-CG 3.26Å; V432-L436 WeakPolarHBondContact O-CG 3.42Å; V432-L436 PolarHBondContact O-N 3.31Å; F433-L436 PolarHBondContact O-N 3.1Å; L436-T439 PolarHBondContact O-N 3.17Å; L436-F440 WeakPolarHBondContact O-CB 3.42Å; L436-F440 PolarHBondContact O-N 2.66Å
437	F	96.7	Very high	94.8	Very high	10 Å²	10	63.4 Å²	63.4	4%	0.044	35%	0.347	C	S	.	.	H	α-helix	trans	-66.1	-40.8	177.6	-173.7	-119.1	0	0	0	111.8	F269 V272 F330 F433 P434 F440 N441	F269-F437 AromaticContact CD1-CE1 3.53Å; F269-F437 HydrophobicContact CD1-CE1 3.53Å; F269-F437 AromaticContact CD1-CZ 3.77Å; F269-F437 HydrophobicContact CD1-CZ 3.77Å; F269-F437 AromaticContact CE1-CE1 3.79Å; F269-F437 HydrophobicContact CE1-CE1 3.79Å; F269-F437 AromaticContact CE1-CZ 3.99Å; F269-F437 HydrophobicContact CE1-CZ 3.99Å; F269-F437 HydrophobicContact CG-CE1 4.42Å; F269-F437 HydrophobicContact CG-CZ 4.3Å; V272-F437 HydrophobicContact CB-CE1 4.1Å; V272-F437 HydrophobicContact CB-CE2 4.28Å; V272-F437 HydrophobicContact CB-CZ 3.91Å; V272-F437 HydrophobicContact CG1-CD1 3.87Å; V272-F437 HydrophobicContact CG1-CD2 3.93Å; V272-F437 HydrophobicContact CG1-CE1 3.83Å; V272-F437 HydrophobicContact CG1-CE2 3.91Å; V272-F437 HydrophobicContact CG1-CG 3.92Å; V272-F437 HydrophobicContact CG1-CZ 3.85Å; V272-F437 HydrophobicContact CG2-CE2 4.14Å; V272-F437 HydrophobicContact CG2-CZ 4.08Å; F330-F437 AromaticContact CD2-CD2 3.77Å; F330-F437 HydrophobicContact CD2-CD2 3.77Å; F330-F437 HydrophobicContact CD2-CE2 4.46Å; F330-F437 HydrophobicContact CE1-CB 4.23Å; F330-F437 HydrophobicContact CE2-CB 4.34Å; F330-F437 AromaticContact CE2-CD2 3.8Å; F330-F437 HydrophobicContact CE2-CD2 3.8Å; F330-F437 HydrophobicContact CG-CD2 4.37Å; F330-F437 HydrophobicContact CZ-CB 4.1Å; F330-F437 HydrophobicContact CZ-CD2 4.41Å; F433-F437 WeakPolarHBondContact O-CB 3.37Å; F433-F437 PolarHBondContact O-N 2.92Å; P434-F437 PolarHBondContact O-N 3.3Å; F437-F440 HydrophobicContact CD2-CD1 4.16Å; F437-F440 HydrophobicContact CE2-CD1 4.17Å; F437-F440 PolarHBondContact O-N 3.36Å; F437-N441 WeakPolarHBondContact CD1-ND2 3.17Å; F437-N441 VanDerWaalsContact CE1-ND2 3.27Å; F437-N441 WeakPolarHBondContact CE1-ND2 3.18Å; F437-N441 WeakPolarHBondContact CE2-ND2 3.39Å; F437-N441 WeakPolarHBondContact CZ-ND2 3.5Å; F437-N441 PolarHBondContact O-N 3.14Å; F437-N441 PolarHBondContact O-ND2 3.03Å
438	G	96.5	Very high	94.9	Very high	32 Å²	32	59.8 Å²	59.8	33%	0.33	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-44.5	174.1	0	0	0	0	0	112.5	P434 V435 N441 L442	P434-G438 PolarHBondContact O-N 3.2Å; V435-G438 PolarHBondContact O-N 3.29Å; G438-N441 PolarHBondContact O-N 3.41Å; G438-L442 WeakPolarHBondContact O-CG 3.22Å; G438-L442 PolarHBondContact O-N 3.3Å
439	T	96.5	Very high	94.8	Very high	77 Å²	77	58.8 Å²	58.8	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-45.5	176.6	-54.1	0	0	0	0	111.3	V435 L436 N441 L442 V443	V435-T439 WeakPolarHBondContact O-CB 3.47Å; V435-T439 PolarHBondContact O-N 3.19Å; V435-T439 PolarHBondContact O-OG1 2.99Å; L436-T439 PolarHBondContact O-N 3.17Å; T439-N441 VanDerWaalsContact C-N 3.32Å; T439-N441 PolarHBondContact O-N 3.19Å; T439-L442 PolarHBondContact O-N 3.34Å; T439-V443 WeakPolarHBondContact O-CG2 3.18Å; T439-V443 PolarHBondContact O-N 2.95Å
440	F	96.8	Very high	94.5	Very high	43 Å²	43	64.4 Å²	64.4	19%	0.189	36%	0.356	C	S	.	.	H	α-helix	trans	-56	-46.5	174.8	165.3	-105.1	0	0	0	111.8	F323 V326 L436 F437 V443 Y444	F323-F440 AromaticContact CD2-CE1 3.75Å; F323-F440 HydrophobicContact CD2-CE1 3.75Å; F323-F440 AromaticContact CD2-CZ 3.93Å; F323-F440 HydrophobicContact CD2-CZ 3.93Å; F323-F440 AromaticContact CE2-CE1 3.83Å; F323-F440 HydrophobicContact CE2-CE1 3.83Å; F323-F440 HydrophobicContact CE2-CZ 4.46Å; V326-F440 HydrophobicContact CB-CD2 4.44Å; V326-F440 HydrophobicContact CB-CE1 4.07Å; V326-F440 HydrophobicContact CB-CE2 3.84Å; V326-F440 HydrophobicContact CB-CZ 3.63Å; V326-F440 HydrophobicContact CG1-CD1 3.84Å; V326-F440 HydrophobicContact CG1-CD2 3.77Å; V326-F440 HydrophobicContact CG1-CE1 3.73Å; V326-F440 HydrophobicContact CG1-CE2 3.66Å; V326-F440 HydrophobicContact CG1-CG 3.85Å; V326-F440 HydrophobicContact CG1-CZ 3.64Å; V326-F440 HydrophobicContact CG2-CD2 4.44Å; V326-F440 HydrophobicContact CG2-CE2 3.76Å; V326-F440 HydrophobicContact CG2-CZ 3.99Å; L436-F440 WeakPolarHBondContact O-CB 3.42Å; L436-F440 PolarHBondContact O-N 2.66Å; F437-F440 HydrophobicContact CD2-CD1 4.16Å; F437-F440 HydrophobicContact CE2-CD1 4.17Å; F437-F440 PolarHBondContact O-N 3.36Å; F440-V443 PolarHBondContact O-N 3.44Å; F440-Y444 HydrophobicContact CZ-CD2 4.19Å; F440-Y444 HydrophobicContact CZ-CG 4.46Å; F440-Y444 VanDerWaalsContact O-CB 3.28Å; F440-Y444 WeakPolarHBondContact O-CB 3.39Å; F440-Y444 PolarHBondContact O-N 2.77Å
441	N	96.4	Very high	93.8	Very high	12 Å²	12	67.3 Å²	67.3	6%	0.064	37%	0.367	C	S	.	.	H	α-helix	trans	-64.4	-42.6	179.7	-78.1	-63.7	0	0	0	112.4	F269 F323 F437 G438 T439 V443 Y444 W445	F269-N441 HydrophobicContact CE1-CB 4.27Å; F269-N441 VanDerWaalsContact CE1-ND2 3.3Å; F269-N441 WeakPolarHBondContact CE1-ND2 3.18Å; F269-N441 WeakPolarHBondContact CE1-OD1 3.28Å; F269-N441 WeakPolarHBondContact CE2-OD1 3.47Å; F269-N441 HydrophobicContact CZ-CB 4.01Å; F269-N441 WeakPolarHBondContact CZ-OD1 3.41Å; F323-N441 WeakPolarHBondContact CE2-OD1 3.34Å; F437-N441 WeakPolarHBondContact CD1-ND2 3.17Å; F437-N441 VanDerWaalsContact CE1-ND2 3.27Å; F437-N441 WeakPolarHBondContact CE1-ND2 3.18Å; F437-N441 WeakPolarHBondContact CE2-ND2 3.39Å; F437-N441 WeakPolarHBondContact CZ-ND2 3.5Å; F437-N441 PolarHBondContact O-N 3.14Å; F437-N441 PolarHBondContact O-ND2 3.03Å; G438-N441 PolarHBondContact O-N 3.41Å; T439-N441 VanDerWaalsContact C-N 3.32Å; T439-N441 PolarHBondContact O-N 3.19Å; N441-V443 VanDerWaalsContact C-N 3.34Å; N441-V443 PolarHBondContact O-N 3.18Å; N441-Y444 PolarHBondContact O-N 3.26Å; N441-W445 PolarHBondContact O-N 3.48Å
442	L	95.8	Very high	92.4	Very high	133 Å²	133	69.7 Å²	69.7	70%	0.696	38%	0.376	S	S	*	.	H	α-helix	trans	-58.4	-47.4	175.1	-73	172.7	0	0	0	111.3	G438 T439 A446	G438-L442 WeakPolarHBondContact O-CG 3.22Å; G438-L442 PolarHBondContact O-N 3.3Å; T439-L442 PolarHBondContact O-N 3.34Å; L442-A446 WeakPolarHBondContact O-CB 3.45Å; L442-A446 PolarHBondContact O-N 3.01Å
443	V	96.2	Very high	90.8	Very high	84 Å²	84	69.8 Å²	69.8	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-45.6	177.8	173.8	0	0	0	0	111.2	T439 F440 N441 T447	T439-V443 WeakPolarHBondContact O-CG2 3.18Å; T439-V443 PolarHBondContact O-N 2.95Å; F440-V443 PolarHBondContact O-N 3.44Å; N441-V443 VanDerWaalsContact C-N 3.34Å; N441-V443 PolarHBondContact O-N 3.18Å; V443-T447 VanDerWaalsContact O-CB 3.29Å; V443-T447 WeakPolarHBondContact O-CB 3.26Å; V443-T447 PolarHBondContact O-N 3.37Å; V443-T447 PolarHBondContact O-OG1 2.9Å
444	Y	95.5	Very high	89	Confident	8 Å²	8	73.7 Å²	73.7	3%	0.031	40%	0.404	C	S	.	.	H	α-helix	trans	-58.7	-56.9	-179	-180	-94.2	0	0	0	111.7	M182 Y265 A319 F323 F440 N441 A446 T447 Y448	M182-Y444 HydrophobicContact CE-CE1 3.98Å; Y265-Y444 AromaticContact CE1-CE1 3.7Å; Y265-Y444 HydrophobicContact CE1-CE1 3.7Å; Y265-Y444 AromaticContact CE1-CZ 3.91Å; Y265-Y444 WeakPolarHBondContact CE1-OH 3.28Å; Y265-Y444 PolarHBondContact OH-OH 3.02Å; A319-Y444 WeakPolarHBondContact O-CE2 3.27Å; A319-Y444 PolarHBondContact O-OH 3.36Å; F323-Y444 HydrophobicContact CB-CD2 4.42Å; F323-Y444 HydrophobicContact CB-CE1 4.47Å; F323-Y444 HydrophobicContact CB-CE2 3.72Å; F323-Y444 AromaticContact CD2-CD1 3.82Å; F323-Y444 HydrophobicContact CD2-CD1 3.82Å; F323-Y444 HydrophobicContact CD2-CD2 4.05Å; F323-Y444 AromaticContact CD2-CE1 3.77Å; F323-Y444 HydrophobicContact CD2-CE1 3.77Å; F323-Y444 HydrophobicContact CD2-CE2 4.01Å; F323-Y444 AromaticContact CD2-CG 3.97Å; F323-Y444 HydrophobicContact CD2-CG 3.97Å; F323-Y444 AromaticContact CD2-CZ 3.87Å; F323-Y444 HydrophobicContact CE2-CD1 4.29Å; F323-Y444 HydrophobicContact CE2-CE1 4.46Å; F323-Y444 HydrophobicContact CG-CE1 4.37Å; F323-Y444 HydrophobicContact CG-CE2 4.33Å; F440-Y444 HydrophobicContact CZ-CD2 4.19Å; F440-Y444 HydrophobicContact CZ-CG 4.46Å; F440-Y444 VanDerWaalsContact O-CB 3.28Å; F440-Y444 WeakPolarHBondContact O-CB 3.39Å; F440-Y444 PolarHBondContact O-N 2.77Å; N441-Y444 PolarHBondContact O-N 3.26Å; Y444-A446 PolarHBondContact O-N 3.3Å; Y444-T447 PolarHBondContact O-N 3.36Å; Y444-Y448 HydrophobicContact CD1-CD2 4.41Å; Y444-Y448 AromaticContact CD2-CD2 3.6Å; Y444-Y448 HydrophobicContact CD2-CD2 3.6Å; Y444-Y448 AromaticContact CD2-CE2 3.51Å; Y444-Y448 HydrophobicContact CD2-CE2 3.51Å; Y444-Y448 HydrophobicContact CE1-CD2 4.29Å; Y444-Y448 AromaticContact CE2-CD2 3.44Å; Y444-Y448 HydrophobicContact CE2-CD2 3.44Å; Y444-Y448 VanDerWaalsContact CE2-CD2 3.44Å; Y444-Y448 AromaticContact CE2-CE2 3.32Å; Y444-Y448 HydrophobicContact CE2-CE2 3.32Å; Y444-Y448 HydrophobicContact CG-CD2 4.09Å; Y444-Y448 HydrophobicContact CG-CE2 4.4Å; Y444-Y448 AromaticContact CZ-CD2 3.81Å; Y444-Y448 WeakPolarHBondContact O-CD2 3.1Å; Y444-Y448 PolarHBondContact O-N 2.86Å
445	W	94.8	Very high	87.2	Confident	57 Å²	57	73.6 Å²	73.6	22%	0.216	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-38	-177.2	-68.6	111.2	0	0	0	111.8	M182 Y265 F269 N441 T447 L449	M182-W445 HydrophobicContact CE-CZ3 4.49Å; M182-W445 HydrophobicContact SD-CE3 4.23Å; M182-W445 HydrophobicContact SD-CZ3 4.01Å; Y265-W445 AromaticContact CD1-CH2 3.93Å; Y265-W445 HydrophobicContact CD1-CH2 3.93Å; Y265-W445 AromaticContact CD1-CZ2 3.74Å; Y265-W445 HydrophobicContact CD1-CZ2 3.74Å; Y265-W445 HydrophobicContact CD2-CH2 4.14Å; Y265-W445 HydrophobicContact CE1-CH2 4.06Å; Y265-W445 HydrophobicContact CE1-CZ2 4.14Å; Y265-W445 HydrophobicContact CE2-CH2 4.27Å; Y265-W445 AromaticContact CG-CH2 3.98Å; Y265-W445 HydrophobicContact CG-CH2 3.98Å; Y265-W445 HydrophobicContact CG-CZ2 4.01Å; F269-W445 HydrophobicContact CE2-CZ2 4.44Å; F269-W445 AromaticContact CE2-NE1 3.94Å; F269-W445 AromaticContact CZ-NE1 3.89Å; N441-W445 PolarHBondContact O-N 3.48Å; W445-T447 VanDerWaalsContact C-N 3.31Å; W445-T447 PolarHBondContact O-N 2.97Å; W445-L449 HydrophobicContact CB-CD1 4.2Å; W445-L449 HydrophobicContact CE3-CD1 3.9Å; W445-L449 HydrophobicContact CE3-CD2 4.42Å; W445-L449 HydrophobicContact CE3-CG 4.1Å; W445-L449 WeakPolarHBondContact O-CB 3.44Å; W445-L449 VanDerWaalsContact O-CG 3.27Å; W445-L449 WeakPolarHBondContact O-CG 3.43Å; W445-L449 PolarHBondContact O-N 2.79Å
446	A	93.9	Very high	84.9	Confident	52 Å²	52	78.5 Å²	78.5	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-66.1	-33.2	176.2	0	0	0	0	0	112.7	L442 Y444 N450	L442-A446 WeakPolarHBondContact O-CB 3.45Å; L442-A446 PolarHBondContact O-N 3.01Å; Y444-A446 PolarHBondContact O-N 3.3Å; A446-N450 VanDerWaalsContact O-CB 3.26Å; A446-N450 WeakPolarHBondContact O-CB 3.25Å; A446-N450 PolarHBondContact O-ND2 3.31Å
447	T	92.8	Very high	82.5	Confident	75 Å²	75	76 Å²	76	46%	0.46	41%	0.411	S	S	.	.	H	α-helix	trans	-75	-52.6	179.8	-55	0	0	0	0	110.9	V443 Y444 W445 R451	V443-T447 VanDerWaalsContact O-CB 3.29Å; V443-T447 WeakPolarHBondContact O-CB 3.26Å; V443-T447 PolarHBondContact O-N 3.37Å; V443-T447 PolarHBondContact O-OG1 2.9Å; Y444-T447 PolarHBondContact O-N 3.36Å; W445-T447 VanDerWaalsContact C-N 3.31Å; W445-T447 PolarHBondContact O-N 2.97Å; T447-R451 PolarHBondContact O-N 2.86Å
448	Y	90.9	Very high	79.7	Confident	45 Å²	45	78.4 Å²	78.4	18%	0.176	43%	0.433	C	S	.	.	H	α-helix	trans	-81.2	-23.7	-172	-69	-69.6	0	0	0	114.3	D179 M182 A319 Y444	D179-Y448 WeakPolarHBondContact OD1-CD1 3.28Å; D179-Y448 WeakPolarHBondContact OD1-CE1 3.42Å; M182-Y448 HydrophobicContact CE-CG 4.13Å; M182-Y448 VanDerWaalsContact SD-CB 3.58Å; A319-Y448 HydrophobicContact CB-CD1 3.69Å; A319-Y448 HydrophobicContact CB-CD2 4.29Å; A319-Y448 HydrophobicContact CB-CE1 3.34Å; A319-Y448 HydrophobicContact CB-CE2 4Å; A319-Y448 HydrophobicContact CB-CG 4.15Å; Y444-Y448 HydrophobicContact CD1-CD2 4.41Å; Y444-Y448 AromaticContact CD2-CD2 3.6Å; Y444-Y448 HydrophobicContact CD2-CD2 3.6Å; Y444-Y448 AromaticContact CD2-CE2 3.51Å; Y444-Y448 HydrophobicContact CD2-CE2 3.51Å; Y444-Y448 HydrophobicContact CE1-CD2 4.29Å; Y444-Y448 AromaticContact CE2-CD2 3.44Å; Y444-Y448 HydrophobicContact CE2-CD2 3.44Å; Y444-Y448 VanDerWaalsContact CE2-CD2 3.44Å; Y444-Y448 AromaticContact CE2-CE2 3.32Å; Y444-Y448 HydrophobicContact CE2-CE2 3.32Å; Y444-Y448 HydrophobicContact CG-CD2 4.09Å; Y444-Y448 HydrophobicContact CG-CE2 4.4Å; Y444-Y448 AromaticContact CZ-CD2 3.81Å; Y444-Y448 WeakPolarHBondContact O-CD2 3.1Å; Y444-Y448 PolarHBondContact O-N 2.86Å
449	L	89	Confident	76.6	Confident	101 Å²	101	89.6 Å²	89.6	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-83.2	-28	175.3	-64.9	174.3	0	0	0	113.5	M182 W445	M182-L449 HydrophobicContact CG-CD2 4.19Å; M182-L449 HydrophobicContact SD-CD2 3.73Å; M182-L449 HydrophobicContact SD-CG 4.18Å; W445-L449 HydrophobicContact CB-CD1 4.2Å; W445-L449 HydrophobicContact CE3-CD1 3.9Å; W445-L449 HydrophobicContact CE3-CD2 4.42Å; W445-L449 HydrophobicContact CE3-CG 4.1Å; W445-L449 WeakPolarHBondContact O-CB 3.44Å; W445-L449 VanDerWaalsContact O-CG 3.27Å; W445-L449 WeakPolarHBondContact O-CG 3.43Å; W445-L449 PolarHBondContact O-N 2.79Å
450	N	86.2	Confident	75.6	Confident	127 Å²	127	90.3 Å²	90.3	68%	0.679	48%	0.477	S	S	*	.	H	α-helix	trans	-92.6	-7.4	179.9	-65.9	-36.1	0	0	0	113.2	A446 E452	A446-N450 VanDerWaalsContact O-CB 3.26Å; A446-N450 WeakPolarHBondContact O-CB 3.25Å; A446-N450 PolarHBondContact O-ND2 3.31Å; N450-E452 PolarHBondContact O-N 2.89Å; N450-E452 VanDerWaalsContact O-N 3.11Å
451	R	78.8	Confident	74.5	Confident	123 Å²	123	92.7 Å²	92.7	46%	0.464	49%	0.492	S	S	.	.			trans	-66.5	114.2	175.4	-155.1	172.4	-171.5	-176	-0.4	107.9	D179 T447	D179-R451 IonicContact OD1-CZ 3.79Å; D179-R451 IonicContact OD1-NH1 2.97Å; D179-R451 PolarHBondContact OD1-NH1 3.06Å; D179-R451 IonicContact OD2-CZ 2.87Å; D179-R451 IonicContact OD2-NE 2.88Å; D179-R451 IonicContact OD2-NH1 2.7Å; D179-R451 PolarHBondContact OD2-NH1 2.87Å; T447-R451 PolarHBondContact O-N 2.86Å
452	E	66.4	Low	73.3	Confident	165 Å²	165	97.2 Å²	97.2	77%	0.771	52%	0.516	S	S	*	.			trans	-61.8	130.9	168	-70.1	-173.1	173	0	0	107.8	N450 V454	N450-E452 PolarHBondContact O-N 2.89Å; N450-E452 VanDerWaalsContact O-N 3.11Å; E452-V454 PolarHBondContact O-N 3.08Å
453	P	61.2	Low	72	Confident	58 Å²	58	95.1 Å²	95.1	38%	0.377	51%	0.505	S	S	.	.			trans	-62.5	115.4	178.9	23.9	-30.7	0	0	0	108.4	A184 I455	A184-P453 HydrophobicContact CB-CB 3.53Å; A184-P453 HydrophobicContact CB-CG 3.95Å; P453-I455 VanDerWaalsContact C-N 3.3Å; P453-I455 HydrophobicContact CB-CG1 4.26Å; P453-I455 PolarHBondContact O-N 3.22Å
454	V	55.9	Low	70.4	Confident	112 Å²	112	95.8 Å²	95.8	68%	0.679	51%	0.505	S	S	*	.			trans	-74.3	91	173.1	-177.6	0	0	0	0	107.1	E452 K456	E452-V454 PolarHBondContact O-N 3.08Å; V454-K456 HydrophobicContact CG1-CG 4.06Å; V454-K456 PolarHBondContact O-N 3.21Å
455	I	58.7	Low	68.8	Low	51 Å²	51	101.7 Å²	101.7	26%	0.262	54%	0.537	S	S	.	.			trans	-80.1	88.6	178.1	-53.1	174.4	0	0	0	108.1	A186 Y252 P453 G457	A186-I455 HydrophobicContact CB-CG2 3.36Å; Y252-I455 HydrophobicContact CD1-CD1 3.68Å; Y252-I455 HydrophobicContact CD1-CG2 3.94Å; Y252-I455 HydrophobicContact CE1-CD1 4.07Å; Y252-I455 HydrophobicContact CE1-CG2 3.71Å; P453-I455 VanDerWaalsContact C-N 3.3Å; P453-I455 HydrophobicContact CB-CG1 4.26Å; P453-I455 PolarHBondContact O-N 3.22Å; I455-G457 PolarHBondContact O-N 3.26Å
456	K	46.7	Very low	66.9	Low	189 Å²	189	104.9 Å²	104.9	82%	0.822	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	119.1	172.9	-67.4	-173.4	177.7	178.3	0	108.8	V454	V454-K456 HydrophobicContact CG1-CG 4.06Å; V454-K456 PolarHBondContact O-N 3.21Å
457	G	45.9	Very low	64.8	Low	42 Å²	42	108.9 Å²	108.9	43%	0.433	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	124.5	4.8	-177.5	0	0	0	0	0	115.3	H250 I455	H250-G457 PolarHBondContact CE1-O 3.48Å; I455-G457 PolarHBondContact O-N 3.26Å
458	A	39.4	Very low	62.5	Low	61 Å²	61	111.8 Å²	111.8	50%	0.504	58%	0.579	S	S	.	*			trans	-103.9	13.3	175.2	0	0	0	0	0	114.3
459	E	30.8	Very low	59.9	Low	267 Å²	267	117.8 Å²	117.8	100%	1.248	62%	0.615	S	S	*	*			trans	-97.8	0	169.4	-80.2	-174	156.5	0	0	111.3

Retrieved 459 of 459 residues in 110.2 ms (Link to these results)

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