A0A093JSA5_STRCA Loading...

Calsequestrin

Calsequestrin is a high-capacity, moderate affinity, calcium-binding protein and thus acts as an internal calcium store in muscle. Calcium ions are bound by clusters of acidic residues at the protein surface, especially at the interface between subunits. Can bind around 60 Ca(2+) ions. Regulates the release of lumenal Ca(2+) via the calcium release channel RYR2; this plays an important role in triggering muscle contraction. Plays a role in excitation-contraction coupling in the heart and in regulating the rate of heart beats.

AlphaFold DB , UniProt , Accession A0A093JSA5, Species STRCA (Struthio camelus australis), Gene n/a, Length 404 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	49.7	Very low	50.2	Low	211 Å²	211	119.2 Å²	119.2	100%	1.039	63%	0.633	S	S	*	*				0	-31.2	0	-66.1	-177.2	-146.3	0	0	113.9	T4	M1-T4 PolarHBondContact O-OG1 3.35Å
2	K	46.1	Very low	49.9	Very low	188 Å²	188	124 Å²	124	82%	0.817	64%	0.638	S	S	*	*	H	α-helix	trans	-78.6	-31.5	179.1	-72.5	-175	175.2	-177.3	0	115	W6	K2-W6 VanDerWaalsContact O-CD1 3.22Å
3	A	48.4	Very low	49.6	Very low	76 Å²	76	123.5 Å²	123.5	63%	0.628	64%	0.636	S	S	*	*	H	α-helix	trans	-72.8	-33.1	-179.8	0	0	0	0	0	113.5	W6	A3-W6 PolarHBondContact O-N 3.03Å
4	T	50.3	Low	49.4	Very low	89 Å²	89	123.8 Å²	123.8	55%	0.546	64%	0.638	S	S	.	*	H	α-helix	trans	-72.4	-26.6	-179.8	31	0	0	0	0	113.6	M1 L8	M1-T4 PolarHBondContact O-OG1 3.35Å; T4-L8 PolarHBondContact O-N 3.14Å
5	C	48.9	Very low	49.1	Very low	88 Å²	88	127.1 Å²	127.1	60%	0.595	65%	0.646	S	S	*	*	H	α-helix	trans	-73.5	-26.9	175.1	-77	0	0	0	0	113.4	A9	C5-A9 WeakPolarHBondContact O-CB 3.43Å; C5-A9 PolarHBondContact O-N 3.44Å; C5-A9 VanDerWaalsContact O-N 3.14Å
6	W	47.9	Very low	48.8	Very low	210 Å²	210	125.5 Å²	125.5	80%	0.795	65%	0.649	S	S	*	*	H	α-helix	trans	-78.3	-33.1	-179.2	-77.6	65.3	0	0	0	112.3	K2 A3 A9 G10	K2-W6 VanDerWaalsContact O-CD1 3.22Å; A3-W6 PolarHBondContact O-N 3.03Å; W6-A9 PolarHBondContact O-N 3.47Å; W6-G10 PolarHBondContact O-N 3.43Å
7	I	54.3	Low	48.6	Very low	113 Å²	113	124.1 Å²	124.1	58%	0.579	65%	0.651	S	S	*	*	H	α-helix	trans	-70.5	-39	175.6	-60.4	173	0	0	0	110.7	G10 F11	I7-G10 PolarHBondContact O-N 3.43Å; I7-F11 HydrophobicContact CG2-CD2 4.31Å; I7-F11 HydrophobicContact CG2-CE2 4.48Å; I7-F11 PolarHBondContact O-N 3.36Å; I7-F11 VanDerWaalsContact O-N 3.17Å
8	L	51.7	Low	48.7	Very low	114 Å²	114	126.6 Å²	126.6	60%	0.597	66%	0.656	S	S	*	*	H	α-helix	trans	-67.4	-35.3	174.7	-95.9	148.1	0	0	0	113	T4 Y12	T4-L8 PolarHBondContact O-N 3.14Å; L8-Y12 PolarHBondContact O-N 3.27Å
9	A	53.2	Low	49.1	Very low	51 Å²	51	124.4 Å²	124.4	42%	0.421	66%	0.658	S	S	.	*	H	α-helix	trans	-70.7	-36.3	174.8	0	0	0	0	0	112.5	C5 W6 Y12 L13	C5-A9 WeakPolarHBondContact O-CB 3.43Å; C5-A9 PolarHBondContact O-N 3.44Å; C5-A9 VanDerWaalsContact O-N 3.14Å; W6-A9 PolarHBondContact O-N 3.47Å; A9-Y12 PolarHBondContact O-N 3.05Å; A9-L13 PolarHBondContact O-N 3.17Å
10	G	50.8	Low	49.4	Very low	32 Å²	32	127.6 Å²	127.6	33%	0.33	67%	0.669	S	S	.	*	H	α-helix	trans	-64.6	-38.5	174.5	0	0	0	0	0	113.4	W6 I7 L13 L14	W6-G10 PolarHBondContact O-N 3.43Å; I7-G10 PolarHBondContact O-N 3.43Å; G10-L13 PolarHBondContact O-N 3.42Å; G10-L14 PolarHBondContact O-N 3.34Å; G10-L14 VanDerWaalsContact O-N 3.1Å
11	F	50.3	Low	50	Low	139 Å²	139	129 Å²	129	61%	0.61	67%	0.672	S	S	*	*	H	α-helix	trans	-69.6	-31.6	175	-95.5	-85.3	0	0	0	113.4	I7 F15	I7-F11 HydrophobicContact CG2-CD2 4.31Å; I7-F11 HydrophobicContact CG2-CE2 4.48Å; I7-F11 PolarHBondContact O-N 3.36Å; I7-F11 VanDerWaalsContact O-N 3.17Å; F11-F15 PolarHBondContact O-N 3.5Å
12	Y	47.6	Very low	50.7	Low	177 Å²	177	121.5 Å²	121.5	69%	0.694	65%	0.649	S	S	*	*	H	α-helix	trans	-73	-35.4	173.5	-102.8	-88.6	0	0	0	112.6	L8 A9 F15 C16	L8-Y12 PolarHBondContact O-N 3.27Å; A9-Y12 PolarHBondContact O-N 3.05Å; Y12-F15 PolarHBondContact O-N 3.3Å; Y12-C16 PolarHBondContact O-N 3.37Å
13	L	46	Very low	51.6	Low	117 Å²	117	119.6 Å²	119.6	61%	0.613	65%	0.647	S	S	*	*	H	α-helix	trans	-71.4	-30.8	176.3	-85.3	156.1	0	0	0	113	A9 G10 F15 C16 C17	A9-L13 PolarHBondContact O-N 3.17Å; G10-L13 PolarHBondContact O-N 3.42Å; L13-F15 VanDerWaalsContact C-N 3.33Å; L13-C16 PolarHBondContact O-N 3.34Å; L13-C17 PolarHBondContact O-N 3.35Å; L13-C17 PolarHBondContact O-SG 3.46Å; L13-C17 VanDerWaalsContact O-SG 3.34Å
14	L	45.8	Very low	52.5	Low	128 Å²	128	121.9 Å²	121.9	67%	0.67	65%	0.649	S	S	*	*	H	α-helix	trans	-68.8	-28.4	172.6	-88.8	153.3	0	0	0	113.1	G10	G10-L14 PolarHBondContact O-N 3.34Å; G10-L14 VanDerWaalsContact O-N 3.1Å
15	F	44.8	Very low	53.5	Low	173 Å²	173	125.3 Å²	125.3	76%	0.759	66%	0.656	S	S	*	*	H	α-helix	trans	-81.4	-18.2	174.1	-103.2	-85	0	0	0	113.8	F11 Y12 L13	F11-F15 PolarHBondContact O-N 3.5Å; Y12-F15 PolarHBondContact O-N 3.3Å; L13-F15 VanDerWaalsContact C-N 3.33Å
16	C	44.3	Very low	54.4	Low	102 Å²	102	126.5 Å²	126.5	69%	0.689	66%	0.663	S	S	*	*	S	Bend	trans	-94.2	-2.5	176.6	-73.9	0	0	0	0	113.8	Y12 L13 K18	Y12-C16 PolarHBondContact O-N 3.37Å; L13-C16 PolarHBondContact O-N 3.34Å; C16-K18 VanDerWaalsContact C-N 3.33Å; C16-K18 PolarHBondContact O-N 3.1Å
17	C	45.8	Very low	56.1	Low	101 Å²	101	121.7 Å²	121.7	68%	0.682	66%	0.657	S	S	*	*			trans	-98.2	55.1	168.2	-60.7	0	0	0	0	109.7	L13 A19	L13-C17 PolarHBondContact O-N 3.35Å; L13-C17 PolarHBondContact O-SG 3.46Å; L13-C17 VanDerWaalsContact O-SG 3.34Å; C17-A19 PolarHBondContact O-N 3.36Å
18	K	50.1	Low	57.9	Low	170 Å²	170	119.8 Å²	119.8	74%	0.739	64%	0.643	S	S	*	*			trans	-68.2	111.9	148.2	-80.3	-167.2	170.3	-163.6	0	104.4	C16 E20	C16-K18 VanDerWaalsContact C-N 3.33Å; C16-K18 PolarHBondContact O-N 3.1Å; K18-E20 PolarHBondContact O-N 3.26Å
19	A	56.4	Low	59.8	Low	84 Å²	84	117.4 Å²	117.4	69%	0.694	63%	0.631	S	S	*	*			trans	-48.2	136.3	162.2	0	0	0	0	0	106.8	C17 E21	C17-A19 PolarHBondContact O-N 3.36Å; A19-E21 PolarHBondContact O-N 2.81Å
20	E	55.6	Low	61.8	Low	188 Å²	188	117.3 Å²	117.3	88%	0.879	64%	0.635	S	S	*	*			trans	-48.9	120.9	169.3	-71.5	174.2	161.7	0	0	106.6	K18 G22	K18-E20 PolarHBondContact O-N 3.26Å; E20-G22 PolarHBondContact O-N 3.04Å
21	E	61.8	Low	63.9	Low	159 Å²	159	121.6 Å²	121.6	74%	0.743	64%	0.644	S	S	*	*			trans	-61.7	97.9	172.2	-77.7	168.8	-169.4	0	0	105.1	A19	A19-E21 PolarHBondContact O-N 2.81Å
22	G	64.5	Low	66.1	Low	53 Å²	53	121.8 Å²	121.8	55%	0.546	65%	0.652	S	S	.	*			trans	-68.5	-168.8	178.8	0	0	0	0	0	111.3	E20 N24	E20-G22 PolarHBondContact O-N 3.04Å; G22-N24 PolarHBondContact O-N 2.92Å
23	L	64.1	Low	68.5	Low	147 Å²	147	115 Å²	115	77%	0.77	63%	0.625	S	S	*	*			trans	-60.3	103.1	170.1	-173.8	72.1	0	0	0	109	F25	L23-F25 HydrophobicContact CD2-CE1 3.97Å; L23-F25 HydrophobicContact CD2-CE2 4.33Å; L23-F25 HydrophobicContact CD2-CZ 3.75Å
24	N	67.9	Low	71	Confident	125 Å²	125	110.1 Å²	110.1	67%	0.668	60%	0.6	S	S	*	*			trans	-88.8	113.7	170	-69.8	-48.2	0	0	0	107.5	G22	G22-N24 PolarHBondContact O-N 2.92Å
25	F	71.3	Confident	73.4	Confident	161 Å²	161	106.1 Å²	106.1	71%	0.706	58%	0.579	S	S	*	*			trans	-62.8	128.4	170.7	-66	-80.2	0	0	0	109	L23 T27	L23-F25 HydrophobicContact CD2-CE1 3.97Å; L23-F25 HydrophobicContact CD2-CE2 4.33Å; L23-F25 HydrophobicContact CD2-CZ 3.75Å; F25-T27 PolarHBondContact O-N 2.88Å
26	P	67.8	Low	75.9	Confident	112 Å²	112	101.4 Å²	101.4	73%	0.727	56%	0.561	S	S	*	*			trans	-56.7	135	176.4	-23.4	33.3	0	0	0	110.6
27	T	85.2	Confident	78.5	Confident	110 Å²	110	96.6 Å²	96.6	68%	0.675	53%	0.529	S	S	*	.			trans	-113	155.5	168.3	58.4	0	0	0	0	108.7	F25 D29 Q82	F25-T27 PolarHBondContact O-N 2.88Å; T27-D29 PolarHBondContact O-N 2.74Å; T27-Q82 PolarHBondContact O-NE2 2.99Å
28	Y	90.4	Very high	80.9	Confident	72 Å²	72	93.5 Å²	93.5	28%	0.282	51%	0.506	S	S	.	.			trans	-51.5	128.1	170.5	179.4	-123.3	0	0	0	110.6	G30 K31 M75 E78	Y28-G30 VanDerWaalsContact CE1-CA 3.43Å; Y28-K31 PolarHBondContact OH-O 2.86Å; Y28-M75 HydrophobicContact CD1-CE 3.6Å; Y28-M75 HydrophobicContact CD2-CE 4.45Å; Y28-M75 HydrophobicContact CE1-CE 3.61Å; Y28-M75 HydrophobicContact CE1-SD 4.13Å; Y28-M75 HydrophobicContact CG-CE 4.02Å; Y28-E78 HydrophobicContact CE2-CB 3.94Å
29	D	92.8	Very high	83.1	Confident	65 Å²	65	90.8 Å²	90.8	35%	0.348	50%	0.496	S	S	.	.			trans	-92.8	-0.9	-171.4	77.6	-5.3	0	0	0	113.6	T27 K31 R33 Q82	T27-D29 PolarHBondContact O-N 2.74Å; D29-K31 VanDerWaalsContact C-N 3.34Å; D29-K31 WeakPolarHBondContact OD1-CB 3.46Å; D29-K31 WeakPolarHBondContact OD1-CG 3.39Å; D29-K31 PolarHBondContact OD1-N 3.28Å; D29-K31 VanDerWaalsContact OD1-N 3.07Å; D29-K31 WeakPolarHBondContact OD2-CE 3.08Å; D29-K31 IonicContact OD2-NZ 2.63Å; D29-K31 PolarHBondContact OD2-NZ 3.46Å; D29-R33 IonicContact OD1-CZ 3.68Å; D29-R33 IonicContact OD1-NH1 3.49Å; D29-R33 PolarHBondContact OD1-NH1 3.11Å; D29-R33 IonicContact OD1-NH2 3.72Å; D29-R33 PolarHBondContact OD1-NH2 2.77Å; D29-R33 IonicContact OD2-CZ 3.85Å; D29-R33 IonicContact OD2-NH1 3.69Å; D29-R33 IonicContact OD2-NH2 3.38Å; D29-R33 PolarHBondContact OD2-NH2 3.36Å; D29-Q82 PolarHBondContact OD1-OE1 3.38Å
30	G	93.8	Very high	85	Confident	49 Å²	49	96.3 Å²	96.3	51%	0.505	50%	0.504	S	S	.	.			trans	78.1	11.9	176.2	0	0	0	0	0	114.9	Y28	Y28-G30 VanDerWaalsContact CE1-CA 3.43Å
31	K	96.1	Very high	87	Confident	121 Å²	121	89.3 Å²	89.3	53%	0.526	47%	0.472	S	S	.	.			trans	-95.8	133.2	175.6	-56.8	-178	-165.5	122.7	0	111.3	Y28 D29 R33	Y28-K31 PolarHBondContact OH-O 2.86Å; D29-K31 VanDerWaalsContact C-N 3.34Å; D29-K31 WeakPolarHBondContact OD1-CB 3.46Å; D29-K31 WeakPolarHBondContact OD1-CG 3.39Å; D29-K31 PolarHBondContact OD1-N 3.28Å; D29-K31 VanDerWaalsContact OD1-N 3.07Å; D29-K31 WeakPolarHBondContact OD2-CE 3.08Å; D29-K31 IonicContact OD2-NZ 2.63Å; D29-K31 PolarHBondContact OD2-NZ 3.46Å; K31-R33 PolarHBondContact O-N 2.73Å; K31-R33 PolarHBondContact O-NH1 3.4Å; K31-R33 VanDerWaalsContact O-NH1 3.15Å
32	D	96.8	Very high	88.7	Confident	144 Å²	144	82.6 Å²	82.6	77%	0.77	44%	0.44	S	S	*	.			trans	-71.9	119.3	172.5	-44.7	-25.7	0	0	0	110.5	E78	D32-E78 WeakPolarHBondContact CA-OE1 3.42Å
33	R	97.4	Very high	90.2	Very high	33 Å²	33	86.1 Å²	86.1	13%	0.125	44%	0.441	C	S	.	.			trans	-118.5	-26.3	178.2	-64.9	177.7	174.6	77.9	-2.5	112.1	D29 K31 E78 A81 E85	D29-R33 IonicContact OD1-CZ 3.68Å; D29-R33 IonicContact OD1-NH1 3.49Å; D29-R33 PolarHBondContact OD1-NH1 3.11Å; D29-R33 IonicContact OD1-NH2 3.72Å; D29-R33 PolarHBondContact OD1-NH2 2.77Å; D29-R33 IonicContact OD2-CZ 3.85Å; D29-R33 IonicContact OD2-NH1 3.69Å; D29-R33 IonicContact OD2-NH2 3.38Å; D29-R33 PolarHBondContact OD2-NH2 3.36Å; K31-R33 PolarHBondContact O-N 2.73Å; K31-R33 PolarHBondContact O-NH1 3.4Å; K31-R33 VanDerWaalsContact O-NH1 3.15Å; R33-E78 WeakPolarHBondContact CA-OE2 3.4Å; R33-E78 WeakPolarHBondContact CB-OE2 3.49Å; R33-E78 VanDerWaalsContact N-CD 3.29Å; R33-E78 PolarHBondContact N-OE1 2.8Å; R33-E78 PolarHBondContact N-OE2 3.21Å; R33-A81 HydrophobicContact CB-CB 3.68Å; R33-E85 IonicContact CZ-OE2 2.77Å; R33-E85 IonicContact NE-OE2 3.57Å; R33-E85 PolarHBondContact NE-OE2 3.39Å; R33-E85 VanDerWaalsContact NE-OE2 3.1Å; R33-E85 IonicContact NH2-OE2 2.74Å; R33-E85 PolarHBondContact NH2-OE2 2.74Å
34	V	97.9	Very high	91.7	Very high	16 Å²	16	86.1 Å²	86.1	10%	0.097	44%	0.437	C	S	.	.			trans	-73.8	128.4	-179.4	-177.7	0	0	0	0	109.6	L77 E78 F91 M93	V34-L77 HydrophobicContact CG2-CB 3.68Å; V34-E78 HydrophobicContact CB-CG 4.42Å; V34-E78 WeakPolarHBondContact CB-OE1 3.26Å; V34-E78 HydrophobicContact CG2-CB 4.4Å; V34-E78 VanDerWaalsContact CG2-CD 3.47Å; V34-E78 HydrophobicContact CG2-CG 3.75Å; V34-E78 WeakPolarHBondContact CG2-OE1 3.35Å; V34-E78 PolarHBondContact N-OE1 3.33Å; V34-E78 PolarHBondContact N-OE2 2.89Å; V34-F91 HydrophobicContact CG2-CB 4.01Å; V34-M93 HydrophobicContact CG1-CE 3.79Å; V34-M93 HydrophobicContact CG1-CG 3.68Å; V34-M93 HydrophobicContact CG1-SD 4.17Å
35	I	97.6	Very high	93	Very high	43 Å²	43	80.5 Å²	80.5	22%	0.221	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.1	-172.5	-50	172.4	0	0	0	110.9	L37 Y49 F91 G92 M93	I35-L37 HydrophobicContact CB-CD2 4.27Å; I35-L37 HydrophobicContact CG2-CD2 3.75Å; I35-L37 HydrophobicContact CG2-CG 4.41Å; I35-L37 PolarHBondContact O-N 3.27Å; I35-L37 VanDerWaalsContact O-N 3.11Å; I35-Y49 HydrophobicContact CD1-CE2 3.83Å; I35-F91 PolarHBondContact N-O 3.46Å; I35-G92 CarbonylContact O-C 3.59Å; I35-G92 WeakPolarHBondContact O-CA 3.41Å; I35-M93 PolarHBondContact O-N 3.22Å
36	D	97.2	Very high	94.2	Very high	74 Å²	74	75.8 Å²	75.8	40%	0.396	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	104.9	163.8	178.2	29.5	0	0	0	110	N41 K98	D36-N41 PolarHBondContact O-ND2 3.08Å; D36-K98 VanDerWaalsContact CG-NZ 3.32Å; D36-K98 IonicContact OD1-NZ 3.38Å; D36-K98 PolarHBondContact OD1-NZ 3.21Å; D36-K98 IonicContact OD2-NZ 3.77Å; D36-K98 PolarHBondContact OD2-NZ 3.09Å
37	L	97.5	Very high	95.5	Very high	1 Å²	1	79.1 Å²	79.1	1%	0.005	39%	0.393	C	S	.	.			trans	-90.8	136.2	-174.9	-74.1	-171.2	0	0	0	112.7	I35 N41 A45 L52 L54 M93 V94 L102	I35-L37 HydrophobicContact CB-CD2 4.27Å; I35-L37 HydrophobicContact CG2-CD2 3.75Å; I35-L37 HydrophobicContact CG2-CG 4.41Å; I35-L37 PolarHBondContact O-N 3.27Å; I35-L37 VanDerWaalsContact O-N 3.11Å; L37-N41 WeakPolarHBondContact CA-OD1 3.47Å; L37-N41 WeakPolarHBondContact CD2-OD1 3.43Å; L37-A45 HydrophobicContact CD2-CB 3.72Å; L37-L52 HydrophobicContact CD1-CD2 4.14Å; L37-L54 HydrophobicContact CD1-CD1 3.86Å; L37-L54 HydrophobicContact CD1-CD2 3.32Å; L37-L54 HydrophobicContact CD1-CG 4.27Å; L37-L54 HydrophobicContact CG-CD2 4.39Å; L37-M93 PolarHBondContact N-O 2.82Å; L37-V94 HydrophobicContact CB-CG2 3.92Å; L37-L102 HydrophobicContact CB-CD2 4.02Å
38	N	96.6	Very high	96	Very high	37 Å²	37	80.1 Å²	80.1	20%	0.198	39%	0.387	C	S	.	.			trans	-146.7	176.2	177.6	58.5	71.3	0	0	0	110.6	K40 N41 Y42 D99	N38-K40 PolarHBondContact O-N 3.07Å; N38-K40 WeakPolarHBondContact OD1-CA 3.4Å; N38-K40 WeakPolarHBondContact OD1-CB 3.35Å; N38-K40 PolarHBondContact OD1-N 3.35Å; N38-N41 PolarHBondContact N-OD1 2.7Å; N38-N41 PolarHBondContact O-N 3.1Å; N38-N41 PolarHBondContact O-OD1 3.16Å; N38-Y42 PolarHBondContact O-N 3.11Å; N38-Y42 VanDerWaalsContact O-N 3.15Å; N38-D99 WeakPolarHBondContact CA-OD1 3.26Å; N38-D99 WeakPolarHBondContact CB-OD1 3.41Å
39	E	96.8	Very high	96.3	Very high	113 Å²	113	78.6 Å²	78.6	53%	0.528	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.4	-177.6	-67.7	-169.2	129.1	0	0	114.2
40	K	97	Very high	96.4	Very high	200 Å²	200	80.8 Å²	80.8	87%	0.87	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-33.4	-177.1	-52.4	176.4	-176.6	166	0	113.4	N38	N38-K40 PolarHBondContact O-N 3.07Å; N38-K40 WeakPolarHBondContact OD1-CA 3.4Å; N38-K40 WeakPolarHBondContact OD1-CB 3.35Å; N38-K40 PolarHBondContact OD1-N 3.35Å
41	N	97.4	Very high	96.5	Very high	40 Å²	40	78.6 Å²	78.6	21%	0.214	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-19.9	-170.9	63.7	2.3	0	0	0	114.2	D36 L37 N38 K43 Q44 A45	D36-N41 PolarHBondContact O-ND2 3.08Å; L37-N41 WeakPolarHBondContact CA-OD1 3.47Å; L37-N41 WeakPolarHBondContact CD2-OD1 3.43Å; N38-N41 PolarHBondContact N-OD1 2.7Å; N38-N41 PolarHBondContact O-N 3.1Å; N38-N41 PolarHBondContact O-OD1 3.16Å; N41-K43 VanDerWaalsContact C-N 3.33Å; N41-K43 PolarHBondContact O-N 3.06Å; N41-Q44 WeakPolarHBondContact O-CB 3.3Å; N41-Q44 PolarHBondContact O-N 3.45Å; N41-A45 PolarHBondContact O-N 2.8Å; N41-A45 VanDerWaalsContact O-N 3.14Å
42	Y	96.1	Very high	96.6	Very high	18 Å²	18	73 Å²	73	7%	0.071	35%	0.346	C	S	.	.	H	α-helix	trans	-56.4	-40.1	-172.2	85.9	-81.2	0	0	0	114.2	N38 Q44 A45 L46 L102 K105 L106	N38-Y42 PolarHBondContact O-N 3.11Å; N38-Y42 VanDerWaalsContact O-N 3.15Å; Y42-Q44 PolarHBondContact O-N 2.91Å; Y42-A45 PolarHBondContact O-N 3.22Å; Y42-L46 HydrophobicContact CD2-CD1 3.82Å; Y42-L46 HydrophobicContact CE2-CD1 4.2Å; Y42-L46 PolarHBondContact O-N 2.88Å; Y42-L102 HydrophobicContact CD1-CD1 3.68Å; Y42-L102 HydrophobicContact CD2-CD1 3.66Å; Y42-L102 HydrophobicContact CE1-CD1 4.19Å; Y42-L102 HydrophobicContact CE2-CD1 4.19Å; Y42-L102 HydrophobicContact CG-CD1 3.38Å; Y42-L102 HydrophobicContact CG-CD2 4.48Å; Y42-K105 WeakPolarHBondContact OH-CE 3.4Å; Y42-K105 PolarHBondContact OH-NZ 3.42Å; Y42-L106 HydrophobicContact CD2-CD2 4.07Å; Y42-L106 HydrophobicContact CE2-CD2 4.33Å
43	K	96	Very high	96.7	Very high	127 Å²	127	66.1 Å²	66.1	55%	0.552	31%	0.309	S	S	*	.	H	α-helix	trans	-63.6	-29.1	177.6	-65.5	-171.7	-179.9	179.8	0	113.4	N41 K47	N41-K43 VanDerWaalsContact C-N 3.33Å; N41-K43 PolarHBondContact O-N 3.06Å; K43-K47 WeakPolarHBondContact O-CD 3.27Å; K43-K47 VanDerWaalsContact O-CG 3.28Å; K43-K47 WeakPolarHBondContact O-CG 3.46Å
44	Q	96.9	Very high	96.7	Very high	147 Å²	147	64.6 Å²	64.6	69%	0.687	30%	0.303	S	S	*	.	H	α-helix	trans	-78.8	-39.3	177.7	-175.9	178.2	-1.7	0	0	109.9	N41 Y42 K47 K48	N41-Q44 WeakPolarHBondContact O-CB 3.3Å; N41-Q44 PolarHBondContact O-N 3.45Å; Y42-Q44 PolarHBondContact O-N 2.91Å; Q44-K47 PolarHBondContact O-N 3.25Å; Q44-K48 WeakPolarHBondContact O-CB 3.37Å; Q44-K48 PolarHBondContact O-N 3Å; Q44-K48 VanDerWaalsContact O-N 3.09Å
45	A	95.7	Very high	96.7	Very high	7 Å²	7	64 Å²	64	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-51.8	175.8	0	0	0	0	0	111.5	L37 N41 Y42 K47 K48 Y49 L52	L37-A45 HydrophobicContact CD2-CB 3.72Å; N41-A45 PolarHBondContact O-N 2.8Å; N41-A45 VanDerWaalsContact O-N 3.14Å; Y42-A45 PolarHBondContact O-N 3.22Å; A45-K47 PolarHBondContact O-N 2.89Å; A45-K48 PolarHBondContact O-N 2.98Å; A45-Y49 WeakPolarHBondContact O-CD2 3.42Å; A45-Y49 PolarHBondContact O-N 3.28Å; A45-L52 HydrophobicContact CB-CD2 3.94Å
46	L	94.6	Very high	96.8	Very high	63 Å²	63	62.5 Å²	62.5	33%	0.33	29%	0.292	S	S	.	.	H	α-helix	trans	-58.4	-19.1	177.3	-73.5	170.9	0	0	0	114.5	Y42 L52 L106 F117	Y42-L46 HydrophobicContact CD2-CD1 3.82Å; Y42-L46 HydrophobicContact CE2-CD1 4.2Å; Y42-L46 PolarHBondContact O-N 2.88Å; L46-L52 HydrophobicContact CD2-CD2 3.73Å; L46-L52 HydrophobicContact CG-CD2 4.07Å; L46-L106 HydrophobicContact CD1-CD2 4.11Å; L46-F117 HydrophobicContact CD2-CB 3.92Å; L46-F117 HydrophobicContact CD2-CD1 3.88Å; L46-F117 HydrophobicContact CD2-CD2 4.31Å; L46-F117 HydrophobicContact CD2-CG 3.74Å
47	K	94.9	Very high	96.7	Very high	181 Å²	181	59.9 Å²	59.9	79%	0.787	28%	0.277	S	S	*	.	H	α-helix	trans	-99.7	-15.9	177.8	-72.2	-178.5	179.4	-167	0	113.7	K43 Q44 A45	K43-K47 WeakPolarHBondContact O-CD 3.27Å; K43-K47 VanDerWaalsContact O-CG 3.28Å; K43-K47 WeakPolarHBondContact O-CG 3.46Å; Q44-K47 PolarHBondContact O-N 3.25Å; A45-K47 PolarHBondContact O-N 2.89Å
48	K	96.1	Very high	96.6	Very high	131 Å²	131	65.3 Å²	65.3	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-83.7	-35	-173.7	178.7	-175.9	170.7	-157.8	0	110.9	Q44 A45	Q44-K48 WeakPolarHBondContact O-CB 3.37Å; Q44-K48 PolarHBondContact O-N 3Å; Q44-K48 VanDerWaalsContact O-N 3.09Å; A45-K48 PolarHBondContact O-N 2.98Å
49	Y	96.5	Very high	96.4	Very high	40 Å²	40	65.4 Å²	65.4	16%	0.157	31%	0.305	C	S	.	.			trans	-111	149.3	-172.4	-57.1	-69.2	0	0	0	109.9	I35 A45 M51 L52 S88	I35-Y49 HydrophobicContact CD1-CE2 3.83Å; A45-Y49 WeakPolarHBondContact O-CD2 3.42Å; A45-Y49 PolarHBondContact O-N 3.28Å; Y49-M51 VanDerWaalsContact C-N 3.28Å; Y49-M51 WeakPolarHBondContact CB-O 3.39Å; Y49-L52 HydrophobicContact CD2-CD1 3.99Å; Y49-L52 HydrophobicContact CE2-CD1 4.34Å; Y49-S88 WeakPolarHBondContact CA-O 3.48Å; Y49-S88 VanDerWaalsContact CB-O 3.3Å; Y49-S88 WeakPolarHBondContact CB-O 3.37Å
50	D	95.2	Very high	96.2	Very high	112 Å²	112	62.9 Å²	62.9	60%	0.599	30%	0.297	S	S	*	.	S	Bend	trans	-74.1	-30.8	174	-59.8	-32.3	0	0	0	109.9	S88	D50-S88 PolarHBondContact N-O 3.19Å; D50-S88 WeakPolarHBondContact OD2-CB 3.29Å; D50-S88 PolarHBondContact OD2-OG 3.33Å
51	M	97.3	Very high	95.8	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.5	172.2	-172	-173.2	-65.1	0	0	110.6	Y49 I89 G90 V116 F117 K118 L138 L141 L142	Y49-M51 VanDerWaalsContact C-N 3.28Å; Y49-M51 WeakPolarHBondContact CB-O 3.39Å; M51-I89 HydrophobicContact CB-CG1 4.24Å; M51-I89 HydrophobicContact CB-CG2 4.25Å; M51-I89 HydrophobicContact CG-CG2 4.44Å; M51-I89 WeakPolarHBondContact O-CA 3.3Å; M51-I89 HydrophobicContact SD-CD1 4.26Å; M51-I89 HydrophobicContact SD-CG2 4.39Å; M51-G90 PolarHBondContact O-N 3.26Å; M51-V116 HydrophobicContact CG-CG1 3.29Å; M51-V116 HydrophobicContact SD-CG1 3.37Å; M51-V116 WeakPolarHBondContact SD-CG1 3.14Å; M51-F117 CarbonylContact C-O 3.56Å; M51-F117 VanDerWaalsContact CA-O 3.25Å; M51-F117 WeakPolarHBondContact CA-O 3.17Å; M51-F117 WeakPolarHBondContact CG-O 3.37Å; M51-K118 HydrophobicContact CE-CB 4.44Å; M51-K118 HydrophobicContact CE-CD 4.15Å; M51-K118 HydrophobicContact CE-CG 4.31Å; M51-L138 HydrophobicContact SD-CB 4.41Å; M51-L138 HydrophobicContact SD-CD2 3.46Å; M51-L138 WeakPolarHBondContact SD-CD2 3.43Å; M51-L141 HydrophobicContact CE-CB 4.02Å; M51-L141 HydrophobicContact CE-CD2 3.99Å; M51-L141 HydrophobicContact CE-CG 3.65Å; M51-L141 HydrophobicContact SD-CD2 4.13Å; M51-L141 HydrophobicContact SD-CG 4.4Å; M51-L142 HydrophobicContact CE-CB 4.49Å
52	L	97.9	Very high	95.4	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	111.1	178	179	65	0	0	0	110.4	L37 A45 L46 Y49 L54 G90 F117	L37-L52 HydrophobicContact CD1-CD2 4.14Å; A45-L52 HydrophobicContact CB-CD2 3.94Å; L46-L52 HydrophobicContact CD2-CD2 3.73Å; L46-L52 HydrophobicContact CG-CD2 4.07Å; Y49-L52 HydrophobicContact CD2-CD1 3.99Å; Y49-L52 HydrophobicContact CE2-CD1 4.34Å; L52-L54 HydrophobicContact CD1-CD2 3.88Å; L52-L54 HydrophobicContact CD2-CD1 4.47Å; L52-L54 HydrophobicContact CD2-CD2 3.88Å; L52-L54 HydrophobicContact CD2-CG 4.37Å; L52-L54 HydrophobicContact CG-CD2 3.59Å; L52-L54 HydrophobicContact CG-CG 4.09Å; L52-G90 WeakPolarHBondContact CA-O 3.46Å; L52-F117 HydrophobicContact CB-CB 4.33Å; L52-F117 PolarHBondContact N-O 3.15Å; L52-F117 PolarHBondContact O-N 3.13Å
53	C	98.1	Very high	95.4	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.007	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.5	175.5	-177.5	0	0	0	0	110.2	G90 F91 G92 Y115 V116 L138	C53-G90 PolarHBondContact N-O 2.96Å; C53-F91 HydrophobicContact CB-CD1 3.9Å; C53-F91 HydrophobicContact CB-CE1 3.88Å; C53-F91 HydrophobicContact CB-CG 4.48Å; C53-F91 HydrophobicContact CB-CZ 4.44Å; C53-F91 CarbonylContact O-C 3.53Å; C53-F91 VanDerWaalsContact O-CA 3.29Å; C53-F91 WeakPolarHBondContact O-CA 3.47Å; C53-G92 PolarHBondContact O-N 3.06Å; C53-Y115 CarbonylContact C-O 3.52Å; C53-Y115 WeakPolarHBondContact CA-O 3.39Å; C53-V116 HydrophobicContact CB-CG2 4.27Å; C53-L138 HydrophobicContact CB-CD1 4.32Å; C53-L138 HydrophobicContact CB-CD2 4.25Å
54	L	98.1	Very high	95.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.7	-174.5	-60.1	-170	0	0	0	111.4	L37 L52 F56 G92 V94 L106 L114 Y115 F117	L37-L54 HydrophobicContact CD1-CD1 3.86Å; L37-L54 HydrophobicContact CD1-CD2 3.32Å; L37-L54 HydrophobicContact CD1-CG 4.27Å; L37-L54 HydrophobicContact CG-CD2 4.39Å; L52-L54 HydrophobicContact CD1-CD2 3.88Å; L52-L54 HydrophobicContact CD2-CD1 4.47Å; L52-L54 HydrophobicContact CD2-CD2 3.88Å; L52-L54 HydrophobicContact CD2-CG 4.37Å; L52-L54 HydrophobicContact CG-CD2 3.59Å; L52-L54 HydrophobicContact CG-CG 4.09Å; L54-F56 PolarHBondContact O-N 3Å; L54-G92 WeakPolarHBondContact CA-O 3.43Å; L54-V94 HydrophobicContact CD1-CG2 4.21Å; L54-L106 HydrophobicContact CD1-CD1 3.85Å; L54-L114 CarbonylContact O-C 3.44Å; L54-L114 WeakPolarHBondContact O-CA 3.42Å; L54-Y115 PolarHBondContact N-O 3.32Å; L54-Y115 PolarHBondContact O-N 2.96Å; L54-F117 HydrophobicContact CD1-CD2 3.94Å; L54-F117 HydrophobicContact CD1-CE2 3.53Å; L54-F117 HydrophobicContact CD1-CZ 4.49Å; L54-F117 HydrophobicContact CG-CD2 4.16Å; L54-F117 HydrophobicContact CG-CE2 4.12Å
55	L	98.3	Very high	95.2	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.2	165.3	-178.8	70.7	0	0	0	109.4	H57 T73 L77 G92 M93 V94 G112 L114	L55-H57 HydrophobicContact CD2-CB 4.07Å; L55-H57 HydrophobicContact CG-CB 4.11Å; L55-T73 HydrophobicContact CD2-CG2 3.41Å; L55-T73 VanDerWaalsContact CD2-CG2 3.41Å; L55-L77 HydrophobicContact CB-CD1 3.8Å; L55-L77 HydrophobicContact CD2-CD1 4Å; L55-L77 HydrophobicContact CG-CD1 4.49Å; L55-G92 PolarHBondContact N-O 2.92Å; L55-M93 HydrophobicContact CB-CG 4.18Å; L55-M93 HydrophobicContact CD2-CG 4.42Å; L55-M93 HydrophobicContact CD2-SD 4.38Å; L55-M93 CarbonylContact O-C 3.56Å; L55-M93 WeakPolarHBondContact O-CA 3.22Å; L55-V94 PolarHBondContact O-N 3.05Å; L55-G112 WeakPolarHBondContact CD1-O 3.13Å; L55-L114 HydrophobicContact CB-CD2 3.71Å; L55-L114 HydrophobicContact CD1-CD2 3.96Å; L55-L114 HydrophobicContact CD1-CG 4.09Å; L55-L114 HydrophobicContact CG-CD2 4.46Å
56	F	97.8	Very high	95	Very high	11 Å²	11	61 Å²	61	5%	0.048	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	108.8	169.2	-176.9	-135.5	0	0	0	108.6	L54 V94 S96 A103 L108 E110 E111 G112 S113 Y115	L54-F56 PolarHBondContact O-N 3Å; F56-V94 HydrophobicContact CD2-CB 4.29Å; F56-V94 HydrophobicContact CD2-CG1 4.24Å; F56-V94 WeakPolarHBondContact CD2-O 3.25Å; F56-S96 VanDerWaalsContact CE2-CA 3.45Å; F56-S96 VanDerWaalsContact CE2-CB 3.49Å; F56-S96 VanDerWaalsContact CZ-CB 3.44Å; F56-A103 HydrophobicContact CD2-CB 4.12Å; F56-A103 HydrophobicContact CE2-CB 3.37Å; F56-A103 HydrophobicContact CZ-CB 3.86Å; F56-L108 HydrophobicContact CB-CB 4.09Å; F56-L108 HydrophobicContact CB-CD1 4.15Å; F56-L108 HydrophobicContact CD1-CB 3.8Å; F56-L108 HydrophobicContact CD2-CB 3.98Å; F56-L108 HydrophobicContact CD2-CD1 3.95Å; F56-L108 HydrophobicContact CE1-CB 4.28Å; F56-L108 HydrophobicContact CE2-CB 4.37Å; F56-L108 HydrophobicContact CG-CB 3.7Å; F56-L108 HydrophobicContact CG-CD1 4.17Å; F56-E110 WeakPolarHBondContact CD1-O 3.2Å; F56-E111 HydrophobicContact CD1-CG 4.45Å; F56-E111 HydrophobicContact CE1-CG 3.82Å; F56-E111 HydrophobicContact CZ-CG 4.2Å; F56-G112 PolarHBondContact O-N 2.87Å; F56-S113 PolarHBondContact N-O 3.34Å; F56-Y115 HydrophobicContact CB-CD2 3.98Å; F56-Y115 HydrophobicContact CB-CE2 3.88Å; F56-Y115 HydrophobicContact CD1-CE2 4.33Å
57	H	96.6	Very high	94.9	Very high	18 Å²	18	62.2 Å²	62.2	8%	0.083	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	151.6	-168.5	70.5	86.9	0	0	0	113.3	L55 F70 V94 D95 S96	L55-H57 HydrophobicContact CD2-CB 4.07Å; L55-H57 HydrophobicContact CG-CB 4.11Å; H57-F70 HydrophobicContact CB-CE2 4.31Å; H57-F70 AromaticContact CE1-CE2 3.85Å; H57-F70 AromaticContact CG-CE2 3.75Å; H57-F70 AromaticContact ND1-CE2 3.6Å; H57-V94 PolarHBondContact CD2-O 3.35Å; H57-V94 PolarHBondContact N-O 3.22Å; H57-D95 IonicContact CE1-OD2 3.92Å; H57-S96 WeakPolarHBondContact O-CB 3.35Å; H57-S96 PolarHBondContact O-N 3.22Å
58	E	94.6	Very high	94.9	Very high	115 Å²	115	59 Å²	59	54%	0.537	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-62.6	154.5	167.4	-71.8	-163.5	-161	0	0	112.2	V60 E111	E58-V60 PolarHBondContact O-N 3.15Å; E58-E111 HydrophobicContact CG-CB 3.93Å; E58-E111 HydrophobicContact CG-CG 4.4Å; E58-E111 WeakPolarHBondContact CG-OE2 3.47Å
59	P	93.2	Very high	94.7	Very high	40 Å²	40	58.3 Å²	58.3	26%	0.26	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-62.1	128.3	171.2	-11.4	22.7	0	0	0	110.7	G61 K97	P59-G61 PolarHBondContact O-N 3.24Å; P59-K97 HydrophobicContact CG-CB 3.75Å; P59-K97 HydrophobicContact CG-CD 3.38Å; P59-K97 HydrophobicContact CG-CG 3.41Å; P59-K97 VanDerWaalsContact CG-CG 3.41Å
60	V	92.1	Very high	94.6	Very high	60 Å²	60	58.5 Å²	58.5	36%	0.364	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-65.2	124.9	-176.3	-170.5	0	0	0	0	110.9	E58 Q67 F70	E58-V60 PolarHBondContact O-N 3.15Å; V60-Q67 HydrophobicContact CG1-CG 4.31Å; V60-F70 HydrophobicContact CB-CG 4.47Å; V60-F70 HydrophobicContact CG1-CB 3.86Å; V60-F70 HydrophobicContact CG1-CG 4.17Å; V60-F70 HydrophobicContact CG2-CB 4Å; V60-F70 HydrophobicContact CG2-CD1 3.74Å; V60-F70 HydrophobicContact CG2-CD2 3.45Å; V60-F70 VanDerWaalsContact CG2-CD2 3.45Å; V60-F70 HydrophobicContact CG2-CE1 4.03Å; V60-F70 HydrophobicContact CG2-CE2 3.75Å; V60-F70 HydrophobicContact CG2-CG 3.42Å; V60-F70 VanDerWaalsContact CG2-CG 3.42Å; V60-F70 HydrophobicContact CG2-CZ 4.02Å
61	G	88.4	Confident	94.6	Very high	29 Å²	29	58.3 Å²	58.3	30%	0.299	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-56.3	150.8	174.1	0	0	0	0	0	112.7	P59 D63	P59-G61 PolarHBondContact O-N 3.24Å; G61-D63 VanDerWaalsContact C-N 3.26Å; G61-D63 PolarHBondContact O-N 2.75Å
62	S	89.7	Confident	94.4	Very high	118 Å²	118	64.6 Å²	64.6	83%	0.825	34%	0.339	S	S	*	.	S	Bend	trans	-79.5	-9.4	178.2	62.2	0	0	0	0	113.6	Q67	S62-Q67 PolarHBondContact O-NE2 3.18Å
63	D	95.1	Very high	94.2	Very high	75 Å²	75	66 Å²	66	40%	0.401	35%	0.348	S	S	.	.	S	Bend	trans	-76.5	159.8	176.4	73.8	91.4	0	0	0	111.9	G61 V65 S66 Q67	G61-D63 VanDerWaalsContact C-N 3.26Å; G61-D63 PolarHBondContact O-N 2.75Å; D63-V65 VanDerWaalsContact C-N 3.31Å; D63-V65 PolarHBondContact O-N 3.1Å; D63-V65 WeakPolarHBondContact OD1-CA 3.46Å; D63-V65 WeakPolarHBondContact OD1-CB 3.44Å; D63-V65 PolarHBondContact OD1-N 3.07Å; D63-S66 VanDerWaalsContact CG-OG 3.27Å; D63-S66 PolarHBondContact OD1-N 3.29Å; D63-S66 PolarHBondContact OD1-OG 3.45Å; D63-S66 VanDerWaalsContact OD2-CB 3.27Å; D63-S66 WeakPolarHBondContact OD2-CB 3.39Å; D63-S66 PolarHBondContact OD2-OG 2.92Å; D63-Q67 WeakPolarHBondContact O-CG 3.35Å; D63-Q67 PolarHBondContact O-N 3.36Å
64	K	94.4	Very high	94.1	Very high	149 Å²	149	69 Å²	69	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-69.9	-26.5	-173.5	-173.4	177.5	178.5	-177.3	0	113.2	K68	K64-K68 VanDerWaalsContact O-CG 3.31Å; K64-K68 WeakPolarHBondContact O-CG 3.44Å; K64-K68 PolarHBondContact O-N 3.05Å
65	V	94.2	Very high	94	Very high	93 Å²	93	72.9 Å²	72.9	56%	0.564	38%	0.381	S	S	*	.	H	α-helix	trans	-74.9	-51.2	-177.8	179	0	0	0	0	108.7	D63 Q67 K68 Q69	D63-V65 VanDerWaalsContact C-N 3.31Å; D63-V65 PolarHBondContact O-N 3.1Å; D63-V65 WeakPolarHBondContact OD1-CA 3.46Å; D63-V65 WeakPolarHBondContact OD1-CB 3.44Å; D63-V65 PolarHBondContact OD1-N 3.07Å; V65-Q67 VanDerWaalsContact C-N 3.31Å; V65-Q67 PolarHBondContact O-N 3.17Å; V65-K68 WeakPolarHBondContact O-CB 3.38Å; V65-K68 PolarHBondContact O-N 3Å; V65-Q69 PolarHBondContact O-N 3Å
66	S	91.6	Very high	93.9	Very high	35 Å²	35	74 Å²	74	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-56.5	-43.2	176.4	-56.2	0	0	0	0	112.3	D63 K68 Q69 F70	D63-S66 VanDerWaalsContact CG-OG 3.27Å; D63-S66 PolarHBondContact OD1-N 3.29Å; D63-S66 PolarHBondContact OD1-OG 3.45Å; D63-S66 VanDerWaalsContact OD2-CB 3.27Å; D63-S66 WeakPolarHBondContact OD2-CB 3.39Å; D63-S66 PolarHBondContact OD2-OG 2.92Å; S66-K68 VanDerWaalsContact C-N 3.31Å; S66-K68 PolarHBondContact O-N 3.01Å; S66-Q69 PolarHBondContact O-N 2.74Å; S66-F70 WeakPolarHBondContact O-CB 3.35Å; S66-F70 PolarHBondContact O-N 3.37Å
67	Q	93.4	Very high	93.8	Very high	88 Å²	88	73.6 Å²	73.6	41%	0.411	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-36.4	176.3	-74	175.6	7.5	0	0	113.1	V60 S62 D63 V65 Q71	V60-Q67 HydrophobicContact CG1-CG 4.31Å; S62-Q67 PolarHBondContact O-NE2 3.18Å; D63-Q67 WeakPolarHBondContact O-CG 3.35Å; D63-Q67 PolarHBondContact O-N 3.36Å; V65-Q67 VanDerWaalsContact C-N 3.31Å; V65-Q67 PolarHBondContact O-N 3.17Å; Q67-Q71 WeakPolarHBondContact O-CB 3.47Å; Q67-Q71 WeakPolarHBondContact O-CG 3.33Å; Q67-Q71 PolarHBondContact O-N 3.19Å
68	K	94.9	Very high	93.9	Very high	115 Å²	115	73 Å²	73	50%	0.5	38%	0.384	S	S	.	.	H	α-helix	trans	-73.3	-41.5	178.7	-81.6	179.9	163.9	-158.1	0	112.1	K64 V65 S66 F70 Q71 M72	K64-K68 VanDerWaalsContact O-CG 3.31Å; K64-K68 WeakPolarHBondContact O-CG 3.44Å; K64-K68 PolarHBondContact O-N 3.05Å; V65-K68 WeakPolarHBondContact O-CB 3.38Å; V65-K68 PolarHBondContact O-N 3Å; S66-K68 VanDerWaalsContact C-N 3.31Å; S66-K68 PolarHBondContact O-N 3.01Å; K68-F70 VanDerWaalsContact C-N 3.35Å; K68-Q71 PolarHBondContact O-N 3.06Å; K68-M72 WeakPolarHBondContact O-CG 3.33Å; K68-M72 PolarHBondContact O-N 3.46Å
69	Q	92.3	Very high	94	Very high	115 Å²	115	70.3 Å²	70.3	54%	0.537	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-49.3	175.4	-73.8	170.8	-43.7	0	0	110.1	V65 S66 Q71 M72 T73	V65-Q69 PolarHBondContact O-N 3Å; S66-Q69 PolarHBondContact O-N 2.74Å; Q69-Q71 VanDerWaalsContact C-N 3.34Å; Q69-Q71 PolarHBondContact O-N 3.02Å; Q69-M72 WeakPolarHBondContact O-CB 3.34Å; Q69-M72 PolarHBondContact O-N 3.43Å; Q69-M72 VanDerWaalsContact O-N 3.09Å; Q69-T73 PolarHBondContact O-N 2.95Å; Q69-T73 PolarHBondContact O-OG1 3.27Å
70	F	93.8	Very high	94.1	Very high	44 Å²	44	68.4 Å²	68.4	19%	0.193	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-40.8	176.7	-172	-99.4	0	0	0	112.9	H57 V60 S66 K68 M72 T73 E74 M93	H57-F70 HydrophobicContact CB-CE2 4.31Å; H57-F70 AromaticContact CE1-CE2 3.85Å; H57-F70 AromaticContact CG-CE2 3.75Å; H57-F70 AromaticContact ND1-CE2 3.6Å; V60-F70 HydrophobicContact CB-CG 4.47Å; V60-F70 HydrophobicContact CG1-CB 3.86Å; V60-F70 HydrophobicContact CG1-CG 4.17Å; V60-F70 HydrophobicContact CG2-CB 4Å; V60-F70 HydrophobicContact CG2-CD1 3.74Å; V60-F70 HydrophobicContact CG2-CD2 3.45Å; V60-F70 VanDerWaalsContact CG2-CD2 3.45Å; V60-F70 HydrophobicContact CG2-CE1 4.03Å; V60-F70 HydrophobicContact CG2-CE2 3.75Å; V60-F70 HydrophobicContact CG2-CG 3.42Å; V60-F70 VanDerWaalsContact CG2-CG 3.42Å; V60-F70 HydrophobicContact CG2-CZ 4.02Å; S66-F70 WeakPolarHBondContact O-CB 3.35Å; S66-F70 PolarHBondContact O-N 3.37Å; K68-F70 VanDerWaalsContact C-N 3.35Å; F70-M72 VanDerWaalsContact C-N 3.33Å; F70-M72 PolarHBondContact O-N 3.39Å; F70-T73 PolarHBondContact O-N 2.74Å; F70-E74 WeakPolarHBondContact O-CB 3.28Å; F70-E74 PolarHBondContact O-N 3.37Å; F70-M93 HydrophobicContact CE1-CE 4.45Å; F70-M93 HydrophobicContact CE1-SD 4.33Å; F70-M93 HydrophobicContact CE2-SD 4.14Å; F70-M93 HydrophobicContact CZ-CE 4.1Å; F70-M93 HydrophobicContact CZ-SD 3.55Å; F70-M93 VanDerWaalsContact CZ-SD 3.55Å
71	Q	94.2	Very high	94.4	Very high	109 Å²	109	65.8 Å²	65.8	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-37.7	174.5	-78.6	169	6.4	0	0	112.7	Q67 K68 Q69 M75	Q67-Q71 WeakPolarHBondContact O-CB 3.47Å; Q67-Q71 WeakPolarHBondContact O-CG 3.33Å; Q67-Q71 PolarHBondContact O-N 3.19Å; K68-Q71 PolarHBondContact O-N 3.06Å; Q69-Q71 VanDerWaalsContact C-N 3.34Å; Q69-Q71 PolarHBondContact O-N 3.02Å; Q71-M75 WeakPolarHBondContact O-CB 3.22Å; Q71-M75 WeakPolarHBondContact O-CG 3.25Å; Q71-M75 PolarHBondContact O-N 2.88Å
72	M	93.6	Very high	94.8	Very high	133 Å²	133	65.9 Å²	65.9	66%	0.655	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-47.4	175.4	-75.4	173.4	42.3	0	0	110.9	K68 Q69 F70 M75 V76	K68-M72 WeakPolarHBondContact O-CG 3.33Å; K68-M72 PolarHBondContact O-N 3.46Å; Q69-M72 WeakPolarHBondContact O-CB 3.34Å; Q69-M72 PolarHBondContact O-N 3.43Å; Q69-M72 VanDerWaalsContact O-N 3.09Å; F70-M72 VanDerWaalsContact C-N 3.33Å; F70-M72 PolarHBondContact O-N 3.39Å; M72-M75 WeakPolarHBondContact O-CB 3.47Å; M72-M75 PolarHBondContact O-N 2.86Å; M72-V76 PolarHBondContact O-N 3.15Å; M72-V76 VanDerWaalsContact O-N 3.07Å
73	T	94.3	Very high	95.1	Very high	32 Å²	32	63.7 Å²	63.7	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-48.3	175.3	-63.8	0	0	0	0	112.1	L55 Q69 F70 M75 V76 L77 L129	L55-T73 HydrophobicContact CD2-CG2 3.41Å; L55-T73 VanDerWaalsContact CD2-CG2 3.41Å; Q69-T73 PolarHBondContact O-N 2.95Å; Q69-T73 PolarHBondContact O-OG1 3.27Å; F70-T73 PolarHBondContact O-N 2.74Å; T73-M75 VanDerWaalsContact C-N 3.27Å; T73-M75 PolarHBondContact O-N 2.98Å; T73-V76 WeakPolarHBondContact O-CB 3.26Å; T73-V76 PolarHBondContact O-N 3.25Å; T73-L77 PolarHBondContact O-N 2.9Å; T73-L129 HydrophobicContact CG2-CD2 3.75Å
74	E	95.3	Very high	95.1	Very high	64 Å²	64	60.2 Å²	60.2	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-58.7	-40.5	177.3	-176.4	177	-152.9	0	0	111.3	F70 V76 L77 E78 M93	F70-E74 WeakPolarHBondContact O-CB 3.28Å; F70-E74 PolarHBondContact O-N 3.37Å; E74-V76 PolarHBondContact O-N 3.11Å; E74-L77 PolarHBondContact O-N 2.83Å; E74-E78 HydrophobicContact CG-CG 4.42Å; E74-E78 WeakPolarHBondContact O-CB 3.4Å; E74-E78 WeakPolarHBondContact O-CG 3.36Å; E74-E78 PolarHBondContact O-N 3.15Å; E74-M93 HydrophobicContact CG-CE 4.08Å
75	M	95.8	Very high	95.2	Very high	82 Å²	82	58.5 Å²	58.5	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-35.9	177.6	-76.3	-61	-41.5	0	0	113.5	Y28 Q71 M72 T73 L77 E78 L79	Y28-M75 HydrophobicContact CD1-CE 3.6Å; Y28-M75 HydrophobicContact CD2-CE 4.45Å; Y28-M75 HydrophobicContact CE1-CE 3.61Å; Y28-M75 HydrophobicContact CE1-SD 4.13Å; Y28-M75 HydrophobicContact CG-CE 4.02Å; Q71-M75 WeakPolarHBondContact O-CB 3.22Å; Q71-M75 WeakPolarHBondContact O-CG 3.25Å; Q71-M75 PolarHBondContact O-N 2.88Å; M72-M75 WeakPolarHBondContact O-CB 3.47Å; M72-M75 PolarHBondContact O-N 2.86Å; T73-M75 VanDerWaalsContact C-N 3.27Å; T73-M75 PolarHBondContact O-N 2.98Å; M75-L77 VanDerWaalsContact C-N 3.34Å; M75-E78 PolarHBondContact O-N 3.29Å; M75-L79 WeakPolarHBondContact O-CB 3.45Å; M75-L79 PolarHBondContact O-N 3.46Å
76	V	95.9	Very high	95.2	Very high	30 Å²	30	59.4 Å²	59.4	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-47.9	173.2	167.6	0	0	0	0	110	M72 T73 E74 L79 A80 T131 L134	M72-V76 PolarHBondContact O-N 3.15Å; M72-V76 VanDerWaalsContact O-N 3.07Å; T73-V76 WeakPolarHBondContact O-CB 3.26Å; T73-V76 PolarHBondContact O-N 3.25Å; E74-V76 PolarHBondContact O-N 3.11Å; V76-L79 PolarHBondContact O-N 3.22Å; V76-A80 PolarHBondContact O-N 3.05Å; V76-T131 PolarHBondContact O-OG1 2.99Å; V76-T131 VanDerWaalsContact O-OG1 3.1Å; V76-L134 HydrophobicContact CG1-CD1 3.95Å
77	L	97.4	Very high	95.4	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-67.4	-38.9	179	-58.8	-179.8	0	0	0	112.4	V34 L55 T73 E74 M75 L79 A80 A81 F91 M93 L114 L134	V34-L77 HydrophobicContact CG2-CB 3.68Å; L55-L77 HydrophobicContact CB-CD1 3.8Å; L55-L77 HydrophobicContact CD2-CD1 4Å; L55-L77 HydrophobicContact CG-CD1 4.49Å; T73-L77 PolarHBondContact O-N 2.9Å; E74-L77 PolarHBondContact O-N 2.83Å; M75-L77 VanDerWaalsContact C-N 3.34Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.24Å; L77-A80 PolarHBondContact O-N 3.01Å; L77-A81 WeakPolarHBondContact O-CB 3.32Å; L77-A81 PolarHBondContact O-N 3.2Å; L77-F91 HydrophobicContact CB-CD1 4.32Å; L77-F91 HydrophobicContact CD2-CD1 4.09Å; L77-F91 HydrophobicContact CD2-CE1 4.35Å; L77-M93 HydrophobicContact CD1-CG 4.26Å; L77-L114 HydrophobicContact CD2-CD1 4.41Å; L77-L114 HydrophobicContact CD2-CD2 3.97Å; L77-L134 HydrophobicContact CD2-CD1 3.93Å
78	E	97.6	Very high	95.6	Very high	5 Å²	5	62.6 Å²	62.6	2%	0.023	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-39.3	177	-78	-65.3	174.9	0	0	112.1	Y28 D32 R33 V34 E74 M75 Q82	Y28-E78 HydrophobicContact CE2-CB 3.94Å; D32-E78 WeakPolarHBondContact CA-OE1 3.42Å; R33-E78 WeakPolarHBondContact CA-OE2 3.4Å; R33-E78 WeakPolarHBondContact CB-OE2 3.49Å; R33-E78 VanDerWaalsContact N-CD 3.29Å; R33-E78 PolarHBondContact N-OE1 2.8Å; R33-E78 PolarHBondContact N-OE2 3.21Å; V34-E78 HydrophobicContact CB-CG 4.42Å; V34-E78 WeakPolarHBondContact CB-OE1 3.26Å; V34-E78 HydrophobicContact CG2-CB 4.4Å; V34-E78 VanDerWaalsContact CG2-CD 3.47Å; V34-E78 HydrophobicContact CG2-CG 3.75Å; V34-E78 WeakPolarHBondContact CG2-OE1 3.35Å; V34-E78 PolarHBondContact N-OE1 3.33Å; V34-E78 PolarHBondContact N-OE2 2.89Å; E74-E78 HydrophobicContact CG-CG 4.42Å; E74-E78 WeakPolarHBondContact O-CB 3.4Å; E74-E78 WeakPolarHBondContact O-CG 3.36Å; E74-E78 PolarHBondContact O-N 3.15Å; M75-E78 PolarHBondContact O-N 3.29Å; E78-Q82 WeakPolarHBondContact O-CB 3.24Å; E78-Q82 PolarHBondContact O-N 2.67Å
79	L	96.2	Very high	95.7	Very high	60 Å²	60	57.3 Å²	57.3	31%	0.314	29%	0.289	S	S	.	.	H	α-helix	trans	-69.4	-44.2	176.7	-170.7	62	0	0	0	111.3	M75 V76 L77 A81 Q82 V83 T131	M75-L79 WeakPolarHBondContact O-CB 3.45Å; M75-L79 PolarHBondContact O-N 3.46Å; V76-L79 PolarHBondContact O-N 3.22Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.24Å; L79-A81 VanDerWaalsContact C-N 3.33Å; L79-A81 PolarHBondContact O-N 3.39Å; L79-Q82 WeakPolarHBondContact O-CB 3.41Å; L79-Q82 PolarHBondContact O-N 3.21Å; L79-V83 WeakPolarHBondContact O-CG2 3.48Å; L79-V83 PolarHBondContact O-N 2.89Å; L79-T131 HydrophobicContact CB-CG2 3.96Å; L79-T131 HydrophobicContact CD2-CG2 3.86Å; L79-T131 HydrophobicContact CG-CG2 3.78Å
80	A	96.6	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-44.5	174.1	0	0	0	0	0	111.4	V76 L77 Q82 V83 L84 F91 T131 V135	V76-A80 PolarHBondContact O-N 3.05Å; L77-A80 PolarHBondContact O-N 3.01Å; A80-Q82 VanDerWaalsContact C-N 3.3Å; A80-Q82 PolarHBondContact O-N 2.91Å; A80-V83 PolarHBondContact O-N 3.05Å; A80-V83 VanDerWaalsContact O-N 3.15Å; A80-L84 WeakPolarHBondContact O-CB 3.44Å; A80-L84 PolarHBondContact O-N 3Å; A80-F91 HydrophobicContact CB-CE1 3.83Å; A80-F91 HydrophobicContact CB-CE2 4.23Å; A80-F91 HydrophobicContact CB-CZ 3.54Å; A80-T131 HydrophobicContact CB-CG2 4.15Å; A80-V135 HydrophobicContact CB-CG2 4.05Å
81	A	97.6	Very high	96.2	Very high	5 Å²	5	49.9 Å²	49.9	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-37.4	175.7	0	0	0	0	0	112.6	R33 L77 L79 E85 F91	R33-A81 HydrophobicContact CB-CB 3.68Å; L77-A81 WeakPolarHBondContact O-CB 3.32Å; L77-A81 PolarHBondContact O-N 3.2Å; L79-A81 VanDerWaalsContact C-N 3.33Å; L79-A81 PolarHBondContact O-N 3.39Å; A81-E85 WeakPolarHBondContact O-CB 3.4Å; A81-E85 PolarHBondContact O-N 3.13Å; A81-F91 VanDerWaalsContact CA-CD2 3.42Å; A81-F91 HydrophobicContact CB-CB 4.04Å; A81-F91 HydrophobicContact CB-CD2 3.44Å; A81-F91 VanDerWaalsContact CB-CD2 3.44Å; A81-F91 HydrophobicContact CB-CE2 4.1Å; A81-F91 HydrophobicContact CB-CG 3.89Å
82	Q	96.3	Very high	96.4	Very high	31 Å²	31	44.7 Å²	44.7	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-43.6	174.5	177	177.5	-48.6	0	0	111.9	T27 D29 E78 L79 A80	T27-Q82 PolarHBondContact O-NE2 2.99Å; D29-Q82 PolarHBondContact OD1-OE1 3.38Å; E78-Q82 WeakPolarHBondContact O-CB 3.24Å; E78-Q82 PolarHBondContact O-N 2.67Å; L79-Q82 WeakPolarHBondContact O-CB 3.41Å; L79-Q82 PolarHBondContact O-N 3.21Å; A80-Q82 VanDerWaalsContact C-N 3.3Å; A80-Q82 PolarHBondContact O-N 2.91Å
83	V	95.6	Very high	96.6	Very high	72 Å²	72	39 Å²	39	44%	0.436	20%	0.203	S	C	.	.	H	α-helix	trans	-67.4	-41.6	-179.1	173.5	0	0	0	0	111	L79 A80 P86 V135	L79-V83 WeakPolarHBondContact O-CG2 3.48Å; L79-V83 PolarHBondContact O-N 2.89Å; A80-V83 PolarHBondContact O-N 3.05Å; A80-V83 VanDerWaalsContact O-N 3.15Å; V83-P86 WeakPolarHBondContact O-CD 3.25Å; V83-V135 HydrophobicContact CB-CG2 4.14Å; V83-V135 HydrophobicContact CG1-CG1 3.92Å; V83-V135 HydrophobicContact CG1-CG2 4.07Å
84	L	96.8	Very high	96.8	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-95.1	-0.6	-173	-62.4	172.1	0	0	0	114.7	A80 P86 R87 I89 F91 V135 L138 L139	A80-L84 WeakPolarHBondContact O-CB 3.44Å; A80-L84 PolarHBondContact O-N 3Å; L84-P86 VanDerWaalsContact C-CD 3.4Å; L84-P86 VanDerWaalsContact C-N 3.32Å; L84-R87 HydrophobicContact CD2-CG 4.32Å; L84-R87 WeakPolarHBondContact O-CA 3.13Å; L84-R87 WeakPolarHBondContact O-CB 3.28Å; L84-R87 PolarHBondContact O-N 3.09Å; L84-I89 HydrophobicContact CB-CB 4.02Å; L84-I89 HydrophobicContact CB-CD1 4.37Å; L84-I89 HydrophobicContact CB-CG1 4.5Å; L84-I89 HydrophobicContact CD1-CD1 4.16Å; L84-I89 HydrophobicContact CD1-CG2 4.44Å; L84-I89 HydrophobicContact CD2-CD1 4.3Å; L84-F91 HydrophobicContact CB-CE2 4.4Å; L84-F91 HydrophobicContact CD1-CE2 4.04Å; L84-F91 HydrophobicContact CD1-CZ 3.94Å; L84-V135 HydrophobicContact CD1-CG2 4.15Å; L84-V135 HydrophobicContact CD2-CG1 4.23Å; L84-V135 HydrophobicContact CG-CG2 4.2Å; L84-L138 HydrophobicContact CD1-CB 3.84Å; L84-L138 HydrophobicContact CD1-CD1 3.59Å; L84-L138 HydrophobicContact CD1-CG 4.38Å; L84-L139 HydrophobicContact CD2-CD1 4.43Å; L84-L139 HydrophobicContact CD2-CD2 3.73Å; L84-L139 HydrophobicContact CD2-CG 3.87Å
85	E	95.1	Very high	96.9	Very high	112 Å²	112	35.4 Å²	35.4	52%	0.523	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-49.9	-43.1	174.1	178	171.1	-144.8	0	0	113.3	R33 A81 R87 S88	R33-E85 IonicContact CZ-OE2 2.77Å; R33-E85 IonicContact NE-OE2 3.57Å; R33-E85 PolarHBondContact NE-OE2 3.39Å; R33-E85 VanDerWaalsContact NE-OE2 3.1Å; R33-E85 IonicContact NH2-OE2 2.74Å; R33-E85 PolarHBondContact NH2-OE2 2.74Å; A81-E85 WeakPolarHBondContact O-CB 3.4Å; A81-E85 PolarHBondContact O-N 3.13Å; E85-R87 PolarHBondContact O-N 2.93Å; E85-S88 PolarHBondContact O-N 3.36Å
86	P	95.6	Very high	96.9	Very high	113 Å²	113	32 Å²	32	73%	0.734	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-67.3	-17.4	176.8	-20	34.3	0	0	0	114.6	V83 L84	V83-P86 WeakPolarHBondContact O-CD 3.25Å; L84-P86 VanDerWaalsContact C-CD 3.4Å; L84-P86 VanDerWaalsContact C-N 3.32Å
87	R	96.1	Very high	96.9	Very high	150 Å²	150	37.5 Å²	37.5	57%	0.566	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-93.2	5.2	179.9	-58.1	-62.5	-171.9	-173.6	5.7	113	L84 E85 I89 L139 L142	L84-R87 HydrophobicContact CD2-CG 4.32Å; L84-R87 WeakPolarHBondContact O-CA 3.13Å; L84-R87 WeakPolarHBondContact O-CB 3.28Å; L84-R87 PolarHBondContact O-N 3.09Å; E85-R87 PolarHBondContact O-N 2.93Å; R87-I89 HydrophobicContact CB-CD1 4.24Å; R87-I89 HydrophobicContact CB-CG1 4.07Å; R87-I89 PolarHBondContact O-N 2.86Å; R87-L139 HydrophobicContact CG-CD2 4.23Å; R87-L142 HydrophobicContact CB-CD2 4.21Å
88	S	95.8	Very high	96.9	Very high	39 Å²	39	43.3 Å²	43.3	27%	0.273	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	28	-179.7	-155.1	0	0	0	0	113.4	Y49 D50 E85	Y49-S88 WeakPolarHBondContact CA-O 3.48Å; Y49-S88 VanDerWaalsContact CB-O 3.3Å; Y49-S88 WeakPolarHBondContact CB-O 3.37Å; D50-S88 PolarHBondContact N-O 3.19Å; D50-S88 WeakPolarHBondContact OD2-CB 3.29Å; D50-S88 PolarHBondContact OD2-OG 3.33Å; E85-S88 PolarHBondContact O-N 3.36Å
89	I	97.9	Very high	96.9	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.1	174.8	-53.1	-175.8	0	0	0	108.8	M51 L84 R87 F91 L138	M51-I89 HydrophobicContact CB-CG1 4.24Å; M51-I89 HydrophobicContact CB-CG2 4.25Å; M51-I89 HydrophobicContact CG-CG2 4.44Å; M51-I89 WeakPolarHBondContact O-CA 3.3Å; M51-I89 HydrophobicContact SD-CD1 4.26Å; M51-I89 HydrophobicContact SD-CG2 4.39Å; L84-I89 HydrophobicContact CB-CB 4.02Å; L84-I89 HydrophobicContact CB-CD1 4.37Å; L84-I89 HydrophobicContact CB-CG1 4.5Å; L84-I89 HydrophobicContact CD1-CD1 4.16Å; L84-I89 HydrophobicContact CD1-CG2 4.44Å; L84-I89 HydrophobicContact CD2-CD1 4.3Å; R87-I89 HydrophobicContact CB-CD1 4.24Å; R87-I89 HydrophobicContact CB-CG1 4.07Å; R87-I89 PolarHBondContact O-N 2.86Å; I89-F91 HydrophobicContact CG2-CE2 4.06Å; I89-L138 HydrophobicContact CD1-CB 4.12Å; I89-L138 HydrophobicContact CG2-CD1 4.29Å
90	G	97.8	Very high	97	Very high	2 Å²	2	43.3 Å²	43.3	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	152.1	178.5	0	0	0	0	0	112	M51 L52 C53	M51-G90 PolarHBondContact O-N 3.26Å; L52-G90 WeakPolarHBondContact CA-O 3.46Å; C53-G90 PolarHBondContact N-O 2.96Å
91	F	98.6	Very high	97	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.7	172.3	-72.2	-101.2	0	0	0	110.6	V34 I35 C53 L77 A80 A81 L84 I89 L138	V34-F91 HydrophobicContact CG2-CB 4.01Å; I35-F91 PolarHBondContact N-O 3.46Å; C53-F91 HydrophobicContact CB-CD1 3.9Å; C53-F91 HydrophobicContact CB-CE1 3.88Å; C53-F91 HydrophobicContact CB-CG 4.48Å; C53-F91 HydrophobicContact CB-CZ 4.44Å; C53-F91 CarbonylContact O-C 3.53Å; C53-F91 VanDerWaalsContact O-CA 3.29Å; C53-F91 WeakPolarHBondContact O-CA 3.47Å; L77-F91 HydrophobicContact CB-CD1 4.32Å; L77-F91 HydrophobicContact CD2-CD1 4.09Å; L77-F91 HydrophobicContact CD2-CE1 4.35Å; A80-F91 HydrophobicContact CB-CE1 3.83Å; A80-F91 HydrophobicContact CB-CE2 4.23Å; A80-F91 HydrophobicContact CB-CZ 3.54Å; A81-F91 VanDerWaalsContact CA-CD2 3.42Å; A81-F91 HydrophobicContact CB-CB 4.04Å; A81-F91 HydrophobicContact CB-CD2 3.44Å; A81-F91 VanDerWaalsContact CB-CD2 3.44Å; A81-F91 HydrophobicContact CB-CE2 4.1Å; A81-F91 HydrophobicContact CB-CG 3.89Å; L84-F91 HydrophobicContact CB-CE2 4.4Å; L84-F91 HydrophobicContact CD1-CE2 4.04Å; L84-F91 HydrophobicContact CD1-CZ 3.94Å; I89-F91 HydrophobicContact CG2-CE2 4.06Å; F91-L138 HydrophobicContact CE1-CD1 3.83Å; F91-L138 HydrophobicContact CE2-CD1 4.21Å; F91-L138 HydrophobicContact CZ-CD1 3.3Å
92	G	98.1	Very high	97	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	170.7	177.1	0	0	0	0	0	112.9	I35 C53 L54 L55	I35-G92 CarbonylContact O-C 3.59Å; I35-G92 WeakPolarHBondContact O-CA 3.41Å; C53-G92 PolarHBondContact O-N 3.06Å; L54-G92 WeakPolarHBondContact CA-O 3.43Å; L55-G92 PolarHBondContact N-O 2.92Å
93	M	98.1	Very high	97	Very high	12 Å²	12	49 Å²	49	6%	0.059	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142.8	177.6	-65.6	-173.5	-72.5	0	0	109.4	V34 I35 L37 L55 F70 E74 L77	V34-M93 HydrophobicContact CG1-CE 3.79Å; V34-M93 HydrophobicContact CG1-CG 3.68Å; V34-M93 HydrophobicContact CG1-SD 4.17Å; I35-M93 PolarHBondContact O-N 3.22Å; L37-M93 PolarHBondContact N-O 2.82Å; L55-M93 HydrophobicContact CB-CG 4.18Å; L55-M93 HydrophobicContact CD2-CG 4.42Å; L55-M93 HydrophobicContact CD2-SD 4.38Å; L55-M93 CarbonylContact O-C 3.56Å; L55-M93 WeakPolarHBondContact O-CA 3.22Å; F70-M93 HydrophobicContact CE1-CE 4.45Å; F70-M93 HydrophobicContact CE1-SD 4.33Å; F70-M93 HydrophobicContact CE2-SD 4.14Å; F70-M93 HydrophobicContact CZ-CE 4.1Å; F70-M93 HydrophobicContact CZ-SD 3.55Å; F70-M93 VanDerWaalsContact CZ-SD 3.55Å; E74-M93 HydrophobicContact CG-CE 4.08Å; L77-M93 HydrophobicContact CD1-CG 4.26Å
94	V	98.3	Very high	97.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	117	175	-179	0	0	0	0	108.5	L37 L54 L55 F56 H57 D99 L102 A103 L108	L37-V94 HydrophobicContact CB-CG2 3.92Å; L54-V94 HydrophobicContact CD1-CG2 4.21Å; L55-V94 PolarHBondContact O-N 3.05Å; F56-V94 HydrophobicContact CD2-CB 4.29Å; F56-V94 HydrophobicContact CD2-CG1 4.24Å; F56-V94 WeakPolarHBondContact CD2-O 3.25Å; H57-V94 PolarHBondContact CD2-O 3.35Å; H57-V94 PolarHBondContact N-O 3.22Å; V94-D99 HydrophobicContact CG1-CB 4.02Å; V94-L102 HydrophobicContact CG1-CD2 4.38Å; V94-L102 HydrophobicContact CG2-CD2 4.21Å; V94-A103 HydrophobicContact CG1-CB 4.13Å; V94-L108 HydrophobicContact CB-CD1 3.87Å; V94-L108 HydrophobicContact CG1-CD1 3.98Å; V94-L108 HydrophobicContact CG2-CD1 3.92Å
95	D	97.5	Very high	97	Very high	21 Å²	21	60.3 Å²	60.3	11%	0.112	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.2	176.8	179.6	-55.4	0	0	0	110.6	H57 K97 K98 D99	H57-D95 IonicContact CE1-OD2 3.92Å; D95-K97 VanDerWaalsContact C-N 3.29Å; D95-K97 PolarHBondContact O-N 3.42Å; D95-K97 PolarHBondContact OD1-N 2.98Å; D95-K98 HydrophobicContact CB-CB 3.91Å; D95-K98 WeakPolarHBondContact OD1-CB 3.36Å; D95-K98 PolarHBondContact OD1-N 3.01Å; D95-D99 CarbonylContact O-C 3.36Å; D95-D99 WeakPolarHBondContact O-CA 3.49Å; D95-D99 WeakPolarHBondContact O-CB 3.44Å; D95-D99 PolarHBondContact O-N 3.49Å
96	S	96.7	Very high	97	Very high	10 Å²	10	55.9 Å²	55.9	7%	0.07	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.5	-174.2	78.1	0	0	0	0	115.6	F56 H57 A100 E111	F56-S96 VanDerWaalsContact CE2-CA 3.45Å; F56-S96 VanDerWaalsContact CE2-CB 3.49Å; F56-S96 VanDerWaalsContact CZ-CB 3.44Å; H57-S96 WeakPolarHBondContact O-CB 3.35Å; H57-S96 PolarHBondContact O-N 3.22Å; S96-A100 WeakPolarHBondContact O-CA 3.28Å; S96-A100 VanDerWaalsContact O-CB 3.22Å; S96-A100 WeakPolarHBondContact O-CB 3.48Å; S96-E111 WeakPolarHBondContact CB-OE1 3.48Å; S96-E111 PolarHBondContact OG-OE1 2.71Å
97	K	96	Very high	97.1	Very high	147 Å²	147	52.1 Å²	52.1	64%	0.639	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-45.3	179.4	-59	-170.3	-162.6	149.6	0	112.3	P59 D95	P59-K97 HydrophobicContact CG-CB 3.75Å; P59-K97 HydrophobicContact CG-CD 3.38Å; P59-K97 HydrophobicContact CG-CG 3.41Å; P59-K97 VanDerWaalsContact CG-CG 3.41Å; D95-K97 VanDerWaalsContact C-N 3.29Å; D95-K97 PolarHBondContact O-N 3.42Å; D95-K97 PolarHBondContact OD1-N 2.98Å
98	K	97	Very high	97.1	Very high	123 Å²	123	45.4 Å²	45.4	54%	0.535	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-39.7	-179.9	176.6	-171.7	151.2	-133.7	0	110.9	D36 D95	D36-K98 VanDerWaalsContact CG-NZ 3.32Å; D36-K98 IonicContact OD1-NZ 3.38Å; D36-K98 PolarHBondContact OD1-NZ 3.21Å; D36-K98 IonicContact OD2-NZ 3.77Å; D36-K98 PolarHBondContact OD2-NZ 3.09Å; D95-K98 HydrophobicContact CB-CB 3.91Å; D95-K98 WeakPolarHBondContact OD1-CB 3.36Å; D95-K98 PolarHBondContact OD1-N 3.01Å
99	D	97.5	Very high	97	Very high	17 Å²	17	49.4 Å²	49.4	9%	0.091	25%	0.249	C	C	.	.	S	Bend	trans	-116.2	23.9	-173.9	-65.3	-69.3	0	0	0	112.5	N38 V94 D95 K101 L102 A103	N38-D99 WeakPolarHBondContact CA-OD1 3.26Å; N38-D99 WeakPolarHBondContact CB-OD1 3.41Å; V94-D99 HydrophobicContact CG1-CB 4.02Å; D95-D99 CarbonylContact O-C 3.36Å; D95-D99 WeakPolarHBondContact O-CA 3.49Å; D95-D99 WeakPolarHBondContact O-CB 3.44Å; D95-D99 PolarHBondContact O-N 3.49Å; D99-K101 PolarHBondContact O-N 3.31Å; D99-L102 HydrophobicContact CB-CB 4.45Å; D99-L102 WeakPolarHBondContact O-CA 3.36Å; D99-L102 VanDerWaalsContact O-CB 3.29Å; D99-L102 WeakPolarHBondContact O-CB 3.36Å; D99-L102 PolarHBondContact O-N 3.49Å; D99-A103 PolarHBondContact O-N 2.76Å
100	A	97	Very high	96.8	Very high	47 Å²	47	53 Å²	53	39%	0.388	27%	0.266	S	S	.	.	H	α-helix	trans	-47.9	-36.8	-179.5	0	0	0	0	0	115.4	S96 L102 K104	S96-A100 WeakPolarHBondContact O-CA 3.28Å; S96-A100 VanDerWaalsContact O-CB 3.22Å; S96-A100 WeakPolarHBondContact O-CB 3.48Å; A100-L102 VanDerWaalsContact C-N 3.34Å; A100-K104 WeakPolarHBondContact O-CB 3.48Å; A100-K104 PolarHBondContact O-N 3.18Å
101	K	97.5	Very high	96.6	Very high	152 Å²	152	57 Å²	57	66%	0.661	28%	0.284	S	S	*	.	H	α-helix	trans	-67.9	-36.1	177.1	-70.7	-178.1	-176.9	172.2	0	112.3	D99 K105	D99-K101 PolarHBondContact O-N 3.31Å; K101-K105 WeakPolarHBondContact O-CB 3.2Å; K101-K105 PolarHBondContact O-N 3.14Å
102	L	97.3	Very high	96.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-48.3	175.1	176.7	64.1	0	0	0	109.7	L37 Y42 V94 D99 A100 K104 K105 L106	L37-L102 HydrophobicContact CB-CD2 4.02Å; Y42-L102 HydrophobicContact CD1-CD1 3.68Å; Y42-L102 HydrophobicContact CD2-CD1 3.66Å; Y42-L102 HydrophobicContact CE1-CD1 4.19Å; Y42-L102 HydrophobicContact CE2-CD1 4.19Å; Y42-L102 HydrophobicContact CG-CD1 3.38Å; Y42-L102 HydrophobicContact CG-CD2 4.48Å; V94-L102 HydrophobicContact CG1-CD2 4.38Å; V94-L102 HydrophobicContact CG2-CD2 4.21Å; D99-L102 HydrophobicContact CB-CB 4.45Å; D99-L102 WeakPolarHBondContact O-CA 3.36Å; D99-L102 VanDerWaalsContact O-CB 3.29Å; D99-L102 WeakPolarHBondContact O-CB 3.36Å; D99-L102 PolarHBondContact O-N 3.49Å; A100-L102 VanDerWaalsContact C-N 3.34Å; L102-K104 VanDerWaalsContact C-N 3.35Å; L102-K104 PolarHBondContact O-N 3.03Å; L102-K105 CarbonylContact O-C 3.42Å; L102-K105 WeakPolarHBondContact O-CA 3.48Å; L102-K105 WeakPolarHBondContact O-CB 3.35Å; L102-K105 PolarHBondContact O-N 3.4Å; L102-L106 HydrophobicContact CD1-CD1 3.72Å; L102-L106 HydrophobicContact CD1-CD2 4.38Å; L102-L106 HydrophobicContact CD1-CG 3.76Å; L102-L106 HydrophobicContact CD2-CD1 4.25Å; L102-L106 HydrophobicContact CG-CD1 3.76Å; L102-L106 HydrophobicContact CG-CG 4.15Å; L102-L106 WeakPolarHBondContact O-CB 3.42Å; L102-L106 WeakPolarHBondContact O-CG 3.32Å; L102-L106 PolarHBondContact O-N 2.99Å
103	A	97.3	Very high	96.1	Very high	3 Å²	3	59.9 Å²	59.9	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-51.6	-53	177.2	0	0	0	0	0	111.6	F56 V94 D99 K105 L106 G107 L108	F56-A103 HydrophobicContact CD2-CB 4.12Å; F56-A103 HydrophobicContact CE2-CB 3.37Å; F56-A103 HydrophobicContact CZ-CB 3.86Å; V94-A103 HydrophobicContact CG1-CB 4.13Å; D99-A103 PolarHBondContact O-N 2.76Å; A103-K105 PolarHBondContact O-N 3.46Å; A103-K105 VanDerWaalsContact O-N 3.17Å; A103-L106 CarbonylContact O-C 3.6Å; A103-L106 PolarHBondContact O-N 2.92Å; A103-L106 VanDerWaalsContact O-N 3.09Å; A103-G107 PolarHBondContact O-N 3.29Å; A103-L108 HydrophobicContact CB-CB 4.26Å; A103-L108 HydrophobicContact CB-CD1 4.34Å; A103-L108 PolarHBondContact O-N 3.34Å
104	K	96.5	Very high	96	Very high	186 Å²	186	59.4 Å²	59.4	81%	0.809	31%	0.31	S	S	*	.	H	α-helix	trans	-58.5	-32.8	175.5	-177.4	169.6	-175.3	166.6	0	113.8	A100 L102	A100-K104 WeakPolarHBondContact O-CB 3.48Å; A100-K104 PolarHBondContact O-N 3.18Å; L102-K104 VanDerWaalsContact C-N 3.35Å; L102-K104 PolarHBondContact O-N 3.03Å
105	K	96	Very high	96	Very high	126 Å²	126	59.7 Å²	59.7	55%	0.548	31%	0.311	S	S	.	.	H	α-helix	trans	-75.9	-34.1	179.6	-178.1	176.6	-168.7	168.6	0	112.3	Y42 K101 L102 A103	Y42-K105 WeakPolarHBondContact OH-CE 3.4Å; Y42-K105 PolarHBondContact OH-NZ 3.42Å; K101-K105 WeakPolarHBondContact O-CB 3.2Å; K101-K105 PolarHBondContact O-N 3.14Å; L102-K105 CarbonylContact O-C 3.42Å; L102-K105 WeakPolarHBondContact O-CA 3.48Å; L102-K105 WeakPolarHBondContact O-CB 3.35Å; L102-K105 PolarHBondContact O-N 3.4Å; A103-K105 PolarHBondContact O-N 3.46Å; A103-K105 VanDerWaalsContact O-N 3.17Å
106	L	95.6	Very high	96.1	Very high	19 Å²	19	58.8 Å²	58.8	10%	0.099	31%	0.306	C	S	.	.	H	α-helix	trans	-84.4	-13.8	179	-70.5	-175.7	0	0	0	112.3	Y42 L46 L54 L102 A103 L108 F117 L122	Y42-L106 HydrophobicContact CD2-CD2 4.07Å; Y42-L106 HydrophobicContact CE2-CD2 4.33Å; L46-L106 HydrophobicContact CD1-CD2 4.11Å; L54-L106 HydrophobicContact CD1-CD1 3.85Å; L102-L106 HydrophobicContact CD1-CD1 3.72Å; L102-L106 HydrophobicContact CD1-CD2 4.38Å; L102-L106 HydrophobicContact CD1-CG 3.76Å; L102-L106 HydrophobicContact CD2-CD1 4.25Å; L102-L106 HydrophobicContact CG-CD1 3.76Å; L102-L106 HydrophobicContact CG-CG 4.15Å; L102-L106 WeakPolarHBondContact O-CB 3.42Å; L102-L106 WeakPolarHBondContact O-CG 3.32Å; L102-L106 PolarHBondContact O-N 2.99Å; A103-L106 CarbonylContact O-C 3.6Å; A103-L106 PolarHBondContact O-N 2.92Å; A103-L106 VanDerWaalsContact O-N 3.09Å; L106-L108 HydrophobicContact CB-CD1 4.33Å; L106-L108 HydrophobicContact CB-CD2 4.05Å; L106-L108 HydrophobicContact CB-CG 3.88Å; L106-L108 HydrophobicContact CD1-CD1 4.37Å; L106-F117 HydrophobicContact CB-CZ 3.89Å; L106-F117 HydrophobicContact CD1-CZ 4.42Å; L106-F117 HydrophobicContact CD2-CE1 4.22Å; L106-F117 HydrophobicContact CD2-CZ 4.08Å; L106-F117 HydrophobicContact CG-CZ 4.34Å; L106-L122 WeakPolarHBondContact O-CD2 3.43Å
107	G	96.5	Very high	96.1	Very high	35 Å²	35	59.6 Å²	59.6	36%	0.361	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	21.1	-178.9	0	0	0	0	0	113.3	A103	A103-G107 PolarHBondContact O-N 3.29Å
108	L	96.7	Very high	96	Very high	9 Å²	9	53.6 Å²	53.6	5%	0.047	28%	0.282	C	S	.	.			trans	-78.6	123.3	175.9	-38.4	177.6	0	0	0	108.2	F56 V94 A103 L106 Y115 F117	F56-L108 HydrophobicContact CB-CB 4.09Å; F56-L108 HydrophobicContact CB-CD1 4.15Å; F56-L108 HydrophobicContact CD1-CB 3.8Å; F56-L108 HydrophobicContact CD2-CB 3.98Å; F56-L108 HydrophobicContact CD2-CD1 3.95Å; F56-L108 HydrophobicContact CE1-CB 4.28Å; F56-L108 HydrophobicContact CE2-CB 4.37Å; F56-L108 HydrophobicContact CG-CB 3.7Å; F56-L108 HydrophobicContact CG-CD1 4.17Å; V94-L108 HydrophobicContact CB-CD1 3.87Å; V94-L108 HydrophobicContact CG1-CD1 3.98Å; V94-L108 HydrophobicContact CG2-CD1 3.92Å; A103-L108 HydrophobicContact CB-CB 4.26Å; A103-L108 HydrophobicContact CB-CD1 4.34Å; A103-L108 PolarHBondContact O-N 3.34Å; L106-L108 HydrophobicContact CB-CD1 4.33Å; L106-L108 HydrophobicContact CB-CD2 4.05Å; L106-L108 HydrophobicContact CB-CG 3.88Å; L106-L108 HydrophobicContact CD1-CD1 4.37Å; L108-Y115 HydrophobicContact CB-CD2 4.17Å; L108-Y115 HydrophobicContact CB-CE2 4Å; L108-Y115 HydrophobicContact CD2-CD1 4.18Å; L108-Y115 HydrophobicContact CD2-CD2 3.61Å; L108-Y115 HydrophobicContact CD2-CE2 4.25Å; L108-Y115 HydrophobicContact CD2-CG 3.55Å; L108-Y115 HydrophobicContact CG-CD2 4.37Å; L108-F117 HydrophobicContact CD2-CE2 4.18Å; L108-F117 HydrophobicContact CD2-CZ 4.19Å
109	V	94.1	Very high	95.6	Very high	122 Å²	122	55.1 Å²	55.1	74%	0.739	29%	0.291	S	S	*	.			trans	-116.5	-44.3	-172.1	-176.5	0	0	0	0	111.1	Y115	V109-Y115 PolarHBondContact N-OH 3.36Å
110	E	93.8	Very high	95	Very high	80 Å²	80	64.1 Å²	64.1	37%	0.374	33%	0.333	S	S	.	.	S	Bend	trans	-100.4	113.5	-168.8	-171.5	164.6	-172.9	0	0	112.8	F56 G112 S113 Y115	F56-E110 WeakPolarHBondContact CD1-O 3.2Å; E110-G112 PolarHBondContact O-N 2.73Å; E110-S113 WeakPolarHBondContact CB-OG 3.35Å; E110-S113 VanDerWaalsContact CG-OG 3.23Å; E110-S113 WeakPolarHBondContact CG-OG 3.21Å; E110-S113 PolarHBondContact O-N 3.01Å; E110-S113 PolarHBondContact O-OG 3.36Å; E110-Y115 WeakPolarHBondContact CB-OH 3.2Å; E110-Y115 PolarHBondContact N-OH 3.43Å
111	E	93.3	Very high	94.8	Very high	87 Å²	87	63.9 Å²	63.9	41%	0.407	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	124.6	179.4	-62.5	-177.9	153	0	0	109.6	F56 E58 S96	F56-E111 HydrophobicContact CD1-CG 4.45Å; F56-E111 HydrophobicContact CE1-CG 3.82Å; F56-E111 HydrophobicContact CZ-CG 4.2Å; E58-E111 HydrophobicContact CG-CB 3.93Å; E58-E111 HydrophobicContact CG-CG 4.4Å; E58-E111 WeakPolarHBondContact CG-OE2 3.47Å; S96-E111 WeakPolarHBondContact CB-OE1 3.48Å; S96-E111 PolarHBondContact OG-OE1 2.71Å
112	G	90.8	Very high	94.6	Very high	50 Å²	50	59.9 Å²	59.9	52%	0.515	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	111.1	-28.7	-174.1	0	0	0	0	0	112.5	L55 F56 E110	L55-G112 WeakPolarHBondContact CD1-O 3.13Å; F56-G112 PolarHBondContact O-N 2.87Å; E110-G112 PolarHBondContact O-N 2.73Å
113	S	94.2	Very high	94.6	Very high	11 Å²	11	60.9 Å²	60.9	8%	0.077	31%	0.313	C	S	.	.			trans	-77.6	154.5	-173.1	-48.9	0	0	0	0	113.6	F56 E110	F56-S113 PolarHBondContact N-O 3.34Å; E110-S113 WeakPolarHBondContact CB-OG 3.35Å; E110-S113 VanDerWaalsContact CG-OG 3.23Å; E110-S113 WeakPolarHBondContact CG-OG 3.21Å; E110-S113 PolarHBondContact O-N 3.01Å; E110-S113 PolarHBondContact O-OG 3.36Å
114	L	97.5	Very high	94.5	Very high	3 Å²	3	64.2 Å²	64.2	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135	171.8	-78.5	167.1	0	0	0	110.1	L54 L55 L77 F125 L129 L134	L54-L114 CarbonylContact O-C 3.44Å; L54-L114 WeakPolarHBondContact O-CA 3.42Å; L55-L114 HydrophobicContact CB-CD2 3.71Å; L55-L114 HydrophobicContact CD1-CD2 3.96Å; L55-L114 HydrophobicContact CD1-CG 4.09Å; L55-L114 HydrophobicContact CG-CD2 4.46Å; L77-L114 HydrophobicContact CD2-CD1 4.41Å; L77-L114 HydrophobicContact CD2-CD2 3.97Å; L114-F125 HydrophobicContact CB-CB 3.98Å; L114-F125 HydrophobicContact CB-CD1 4.06Å; L114-F125 HydrophobicContact CB-CG 4.47Å; L114-F125 HydrophobicContact CD1-CD1 3.85Å; L114-F125 HydrophobicContact CD1-CE1 4.33Å; L114-F125 PolarHBondContact O-N 2.9Å; L114-L129 HydrophobicContact CD1-CD1 3.43Å; L114-L129 VanDerWaalsContact CD1-CD1 3.43Å; L114-L129 HydrophobicContact CG-CD1 4.28Å; L114-L134 HydrophobicContact CD1-CD1 3.88Å; L114-L134 HydrophobicContact CD1-CD2 3.42Å; L114-L134 VanDerWaalsContact CD1-CD2 3.42Å; L114-L134 HydrophobicContact CD1-CG 4.27Å
115	Y	97.9	Very high	94.5	Very high	6 Å²	6	55.7 Å²	55.7	2%	0.024	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.5	-179.6	-70.4	-82.7	0	0	0	110.6	C53 L54 F56 L108 V109 E110 L122 I123 E124	C53-Y115 CarbonylContact C-O 3.52Å; C53-Y115 WeakPolarHBondContact CA-O 3.39Å; L54-Y115 PolarHBondContact N-O 3.32Å; L54-Y115 PolarHBondContact O-N 2.96Å; F56-Y115 HydrophobicContact CB-CD2 3.98Å; F56-Y115 HydrophobicContact CB-CE2 3.88Å; F56-Y115 HydrophobicContact CD1-CE2 4.33Å; L108-Y115 HydrophobicContact CB-CD2 4.17Å; L108-Y115 HydrophobicContact CB-CE2 4Å; L108-Y115 HydrophobicContact CD2-CD1 4.18Å; L108-Y115 HydrophobicContact CD2-CD2 3.61Å; L108-Y115 HydrophobicContact CD2-CE2 4.25Å; L108-Y115 HydrophobicContact CD2-CG 3.55Å; L108-Y115 HydrophobicContact CG-CD2 4.37Å; V109-Y115 PolarHBondContact N-OH 3.36Å; E110-Y115 WeakPolarHBondContact CB-OH 3.2Å; E110-Y115 PolarHBondContact N-OH 3.43Å; Y115-L122 HydrophobicContact CD1-CD1 4.02Å; Y115-L122 HydrophobicContact CD1-CD2 4.26Å; Y115-L122 HydrophobicContact CD1-CG 4.15Å; Y115-L122 HydrophobicContact CG-CD1 4.33Å; Y115-I123 CarbonylContact C-O 3.57Å; Y115-I123 WeakPolarHBondContact CA-O 3.28Å; Y115-E124 HydrophobicContact CD1-CB 4.32Å; Y115-E124 HydrophobicContact CE1-CB 4.1Å; Y115-E124 HydrophobicContact CE1-CG 4Å; Y115-E124 WeakPolarHBondContact CE1-OE1 3.43Å; Y115-E124 PolarHBondContact OH-OE1 3.35Å
116	V	98.1	Very high	94.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.1	-179.4	-173.3	0	0	0	0	110.3	M51 C53 I123 F137 L138 L141	M51-V116 HydrophobicContact CG-CG1 3.29Å; M51-V116 HydrophobicContact SD-CG1 3.37Å; M51-V116 WeakPolarHBondContact SD-CG1 3.14Å; C53-V116 HydrophobicContact CB-CG2 4.27Å; V116-I123 HydrophobicContact CB-CB 4.45Å; V116-I123 PolarHBondContact N-O 3.05Å; V116-I123 PolarHBondContact O-N 3.13Å; V116-F137 HydrophobicContact CG2-CE1 4.04Å; V116-L138 HydrophobicContact CB-CD2 4.49Å; V116-L138 HydrophobicContact CG1-CD2 3.89Å; V116-L138 HydrophobicContact CG2-CD2 3.72Å; V116-L141 HydrophobicContact CB-CD2 4.1Å; V116-L141 HydrophobicContact CG1-CD2 3.64Å
117	F	96.9	Very high	94.5	Very high	27 Å²	27	50.6 Å²	50.6	12%	0.118	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112.2	169.9	-68.8	-94.7	0	0	0	108.8	L46 M51 L52 L54 L106 L108 R121 L122	L46-F117 HydrophobicContact CD2-CB 3.92Å; L46-F117 HydrophobicContact CD2-CD1 3.88Å; L46-F117 HydrophobicContact CD2-CD2 4.31Å; L46-F117 HydrophobicContact CD2-CG 3.74Å; M51-F117 CarbonylContact C-O 3.56Å; M51-F117 VanDerWaalsContact CA-O 3.25Å; M51-F117 WeakPolarHBondContact CA-O 3.17Å; M51-F117 WeakPolarHBondContact CG-O 3.37Å; L52-F117 HydrophobicContact CB-CB 4.33Å; L52-F117 PolarHBondContact N-O 3.15Å; L52-F117 PolarHBondContact O-N 3.13Å; L54-F117 HydrophobicContact CD1-CD2 3.94Å; L54-F117 HydrophobicContact CD1-CE2 3.53Å; L54-F117 HydrophobicContact CD1-CZ 4.49Å; L54-F117 HydrophobicContact CG-CD2 4.16Å; L54-F117 HydrophobicContact CG-CE2 4.12Å; L106-F117 HydrophobicContact CB-CZ 3.89Å; L106-F117 HydrophobicContact CD1-CZ 4.42Å; L106-F117 HydrophobicContact CD2-CE1 4.22Å; L106-F117 HydrophobicContact CD2-CZ 4.08Å; L106-F117 HydrophobicContact CG-CZ 4.34Å; L108-F117 HydrophobicContact CD2-CE2 4.18Å; L108-F117 HydrophobicContact CD2-CZ 4.19Å; F117-R121 WeakPolarHBondContact CA-O 3.3Å; F117-L122 HydrophobicContact CD1-CD1 4.08Å; F117-L122 HydrophobicContact CD2-CD1 3.95Å; F117-L122 HydrophobicContact CE1-CD1 3.67Å; F117-L122 HydrophobicContact CE2-CD1 3.48Å; F117-L122 VanDerWaalsContact CE2-CD1 3.48Å; F117-L122 HydrophobicContact CG-CD1 4.21Å; F117-L122 HydrophobicContact CZ-CD1 3.32Å; F117-L122 HydrophobicContact CZ-CD2 4.43Å; F117-L122 HydrophobicContact CZ-CG 4.42Å
118	K	94.5	Very high	94.5	Very high	21 Å²	21	51.7 Å²	51.7	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.1	169.3	-177.3	-176.7	177.2	-177.6	0	107.1	M51 E120 R121 I123 L141 E143	M51-K118 HydrophobicContact CE-CB 4.44Å; M51-K118 HydrophobicContact CE-CD 4.15Å; M51-K118 HydrophobicContact CE-CG 4.31Å; K118-E120 PolarHBondContact O-N 2.97Å; K118-E120 VanDerWaalsContact O-N 3.16Å; K118-R121 PolarHBondContact N-O 2.92Å; K118-R121 WeakPolarHBondContact O-CB 3.31Å; K118-R121 PolarHBondContact O-N 3.25Å; K118-I123 HydrophobicContact CB-CD1 4.49Å; K118-L141 HydrophobicContact CD-CD1 3.93Å; K118-L141 HydrophobicContact CD-CG 4.11Å; K118-L141 WeakPolarHBondContact CD-O 3.45Å; K118-L141 VanDerWaalsContact CE-O 3.25Å; K118-L141 WeakPolarHBondContact CE-O 3.47Å; K118-L141 PolarHBondContact NZ-O 2.67Å; K118-E143 PolarHBondContact NZ-O 3.16Å
119	E	87.9	Confident	94.4	Very high	155 Å²	155	54.2 Å²	54.2	72%	0.724	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-113.5	-175	-53	-172.9	166.3	0	0	113.5
120	E	86.3	Confident	94.5	Very high	206 Å²	206	49.1 Å²	49.1	96%	0.963	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-1.2	175.3	-59.8	-166.1	166.3	0	0	113	K118	K118-E120 PolarHBondContact O-N 2.97Å; K118-E120 VanDerWaalsContact O-N 3.16Å
121	R	91.3	Very high	94.6	Very high	43 Å²	43	46.5 Å²	46.5	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	146	-179	-65.4	-176.2	-83.6	150	-9.3	111.6	F117 K118 E187 Q190	F117-R121 WeakPolarHBondContact CA-O 3.3Å; K118-R121 PolarHBondContact N-O 2.92Å; K118-R121 WeakPolarHBondContact O-CB 3.31Å; K118-R121 PolarHBondContact O-N 3.25Å; R121-E187 VanDerWaalsContact CZ-CB 3.48Å; R121-E187 IonicContact CZ-OE1 2.71Å; R121-E187 IonicContact NE-OE1 3.05Å; R121-E187 IonicContact NE-OE2 2.75Å; R121-E187 PolarHBondContact NH1-O 2.76Å; R121-E187 VanDerWaalsContact NH2-CD 3.3Å; R121-E187 IonicContact NH2-OE1 3.6Å; R121-E187 PolarHBondContact NH2-OE1 3.32Å; R121-Q190 VanDerWaalsContact NH2-OE1 3.17Å
122	L	94.8	Very high	94.7	Very high	67 Å²	67	47.7 Å²	47.7	35%	0.351	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.4	171.6	-179.4	61.9	0	0	0	107.4	L106 Y115 F117	L106-L122 WeakPolarHBondContact O-CD2 3.43Å; Y115-L122 HydrophobicContact CD1-CD1 4.02Å; Y115-L122 HydrophobicContact CD1-CD2 4.26Å; Y115-L122 HydrophobicContact CD1-CG 4.15Å; Y115-L122 HydrophobicContact CG-CD1 4.33Å; F117-L122 HydrophobicContact CD1-CD1 4.08Å; F117-L122 HydrophobicContact CD2-CD1 3.95Å; F117-L122 HydrophobicContact CE1-CD1 3.67Å; F117-L122 HydrophobicContact CE2-CD1 3.48Å; F117-L122 VanDerWaalsContact CE2-CD1 3.48Å; F117-L122 HydrophobicContact CG-CD1 4.21Å; F117-L122 HydrophobicContact CZ-CD1 3.32Å; F117-L122 HydrophobicContact CZ-CD2 4.43Å; F117-L122 HydrophobicContact CZ-CG 4.42Å
123	I	95.9	Very high	95	Very high	21 Å²	21	46 Å²	46	11%	0.108	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.5	-178.9	-61.9	149.5	0	0	0	107.3	Y115 V116 K118 F137 L141	Y115-I123 CarbonylContact C-O 3.57Å; Y115-I123 WeakPolarHBondContact CA-O 3.28Å; V116-I123 HydrophobicContact CB-CB 4.45Å; V116-I123 PolarHBondContact N-O 3.05Å; V116-I123 PolarHBondContact O-N 3.13Å; K118-I123 HydrophobicContact CB-CD1 4.49Å; I123-F137 HydrophobicContact CG2-CZ 4.11Å; I123-L141 HydrophobicContact CD1-CD1 3.52Å; I123-L141 HydrophobicContact CD1-CD2 3.63Å; I123-L141 HydrophobicContact CD1-CG 4.16Å
124	E	96	Very high	95.2	Very high	74 Å²	74	45.6 Å²	45.6	35%	0.346	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.6	173	-174.4	151.7	-137.6	0	0	108.6	Y115 Y192	Y115-E124 HydrophobicContact CD1-CB 4.32Å; Y115-E124 HydrophobicContact CE1-CB 4.1Å; Y115-E124 HydrophobicContact CE1-CG 4Å; Y115-E124 WeakPolarHBondContact CE1-OE1 3.43Å; Y115-E124 PolarHBondContact OH-OE1 3.35Å; E124-Y192 PolarHBondContact O-OH 3.43Å
125	F	96.9	Very high	95.2	Very high	7 Å²	7	46.4 Å²	46.4	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.8	172.5	172.2	-95.9	0	0	0	107.8	L114 G127 V133 L134 F137 E255	L114-F125 HydrophobicContact CB-CB 3.98Å; L114-F125 HydrophobicContact CB-CD1 4.06Å; L114-F125 HydrophobicContact CB-CG 4.47Å; L114-F125 HydrophobicContact CD1-CD1 3.85Å; L114-F125 HydrophobicContact CD1-CE1 4.33Å; L114-F125 PolarHBondContact O-N 2.9Å; F125-G127 WeakPolarHBondContact CE1-O 3.27Å; F125-V133 HydrophobicContact CE2-CG1 4.32Å; F125-V133 HydrophobicContact CZ-CG1 3.89Å; F125-L134 HydrophobicContact CD1-CD2 3.65Å; F125-L134 HydrophobicContact CD2-CD2 4.46Å; F125-L134 HydrophobicContact CE1-CD2 3.41Å; F125-L134 VanDerWaalsContact CE1-CD2 3.41Å; F125-L134 HydrophobicContact CE1-CG 4.44Å; F125-L134 HydrophobicContact CE2-CD2 4.27Å; F125-L134 HydrophobicContact CG-CD2 4.17Å; F125-L134 HydrophobicContact CZ-CD2 3.75Å; F125-F137 HydrophobicContact CB-CE1 4.17Å; F125-F137 HydrophobicContact CB-CZ 4.36Å; F125-F137 HydrophobicContact CD2-CB 4.32Å; F125-F137 AromaticContact CD2-CD1 3.71Å; F125-F137 HydrophobicContact CD2-CD1 3.71Å; F125-F137 AromaticContact CD2-CD2 3.71Å; F125-F137 HydrophobicContact CD2-CD2 3.71Å; F125-F137 AromaticContact CD2-CE1 3.88Å; F125-F137 HydrophobicContact CD2-CE1 3.88Å; F125-F137 AromaticContact CD2-CE2 3.87Å; F125-F137 HydrophobicContact CD2-CE2 3.87Å; F125-F137 AromaticContact CD2-CG 3.62Å; F125-F137 HydrophobicContact CD2-CG 3.62Å; F125-F137 AromaticContact CD2-CZ 3.96Å; F125-F137 HydrophobicContact CD2-CZ 3.96Å; F125-F137 HydrophobicContact CE2-CB 4.07Å; F125-F137 HydrophobicContact CE2-CD1 4.31Å; F125-F137 AromaticContact CE2-CD2 3.97Å; F125-F137 HydrophobicContact CE2-CD2 3.97Å; F125-F137 AromaticContact CE2-CG 3.85Å; F125-F137 HydrophobicContact CE2-CG 3.85Å; F125-F137 HydrophobicContact CG-CD1 4.46Å; F125-F137 HydrophobicContact CG-CE1 4.43Å; F125-E255 HydrophobicContact CE2-CB 4.37Å; F125-E255 WeakPolarHBondContact CE2-O 3.39Å
126	D	94	Very high	95.2	Very high	30 Å²	30	52 Å²	52	16%	0.16	26%	0.257	C	S	.	.			trans	-125.3	48.9	-173.2	-159.9	25.3	0	0	0	111	D256 F258 E259	D126-D256 CarbonylContact O-C 3.56Å; D126-F258 WeakPolarHBondContact O-CB 3.47Å; D126-F258 PolarHBondContact O-N 3.24Å; D126-F258 VanDerWaalsContact O-N 3.16Å; D126-F258 VanDerWaalsContact OD1-CB 3.27Å; D126-F258 WeakPolarHBondContact OD1-CB 3.36Å; D126-E259 HydrophobicContact CB-CB 4.25Å; D126-E259 PolarHBondContact O-N 3.27Å; D126-E259 WeakPolarHBondContact OD2-CA 3.36Å; D126-E259 PolarHBondContact OD2-N 2.85Å
127	G	96.4	Very high	95.2	Very high	7 Å²	7	52.2 Å²	52.2	7%	0.072	26%	0.258	C	S	.	.	S	Bend	trans	-126.5	-172.2	179.8	0	0	0	0	0	112.6	F125 L129 P254 E255 F258	F125-G127 WeakPolarHBondContact CE1-O 3.27Å; G127-L129 PolarHBondContact O-N 3.39Å; G127-P254 CarbonylContact C-O 3.56Å; G127-P254 WeakPolarHBondContact CA-O 3.33Å; G127-E255 WeakPolarHBondContact CA-O 3.27Å; G127-F258 WeakPolarHBondContact O-CD2 3.45Å; G127-F258 VanDerWaalsContact O-CE2 3.3Å; G127-F258 WeakPolarHBondContact O-CE2 3.23Å
128	E	97.1	Very high	95.2	Very high	58 Å²	58	50.9 Å²	50.9	27%	0.271	25%	0.253	S	S	.	.			trans	-60.4	130.3	-179.7	-168.7	-178.5	174	0	0	111.5	A130 V133 P254 M257	E128-A130 HydrophobicContact CG-CB 4.03Å; E128-A130 PolarHBondContact O-N 2.97Å; E128-V133 HydrophobicContact CB-CG2 4.38Å; E128-P254 HydrophobicContact CB-CB 4.42Å; E128-P254 PolarHBondContact N-O 3.13Å; E128-M257 HydrophobicContact CB-SD 3.81Å; E128-M257 HydrophobicContact CG-SD 4.44Å
129	L	95.4	Very high	95.4	Very high	62 Å²	62	52.7 Å²	52.7	33%	0.325	26%	0.263	S	S	.	.			trans	-78.6	65.8	174.8	-168.9	68.2	0	0	0	111.5	T73 L114 G127 L134	T73-L129 HydrophobicContact CG2-CD2 3.75Å; L114-L129 HydrophobicContact CD1-CD1 3.43Å; L114-L129 VanDerWaalsContact CD1-CD1 3.43Å; L114-L129 HydrophobicContact CG-CD1 4.28Å; G127-L129 PolarHBondContact O-N 3.39Å; L129-L134 HydrophobicContact CD1-CD1 4.19Å
130	A	95.9	Very high	95.8	Very high	15 Å²	15	47.9 Å²	47.9	12%	0.124	24%	0.242	C	C	.	.			trans	-121.9	150.5	177.7	0	0	0	0	0	111.3	E128 D132 V133 L134	E128-A130 HydrophobicContact CG-CB 4.03Å; E128-A130 PolarHBondContact O-N 2.97Å; A130-D132 VanDerWaalsContact CB-OD1 3.31Å; A130-D132 WeakPolarHBondContact CB-OD1 3.23Å; A130-V133 HydrophobicContact CB-CB 4.31Å; A130-V133 HydrophobicContact CB-CG2 3.99Å; A130-L134 WeakPolarHBondContact O-CB 3.28Å; A130-L134 VanDerWaalsContact O-CG 3.23Å; A130-L134 WeakPolarHBondContact O-CG 3.37Å; A130-L134 PolarHBondContact O-N 3.39Å
131	T	95.4	Very high	96.3	Very high	26 Å²	26	38 Å²	38	16%	0.16	20%	0.196	C	C	.	.	H	α-helix	trans	-68.5	-44	-172.2	-66.5	0	0	0	0	112.5	V76 L79 A80 V135	V76-T131 PolarHBondContact O-OG1 2.99Å; V76-T131 VanDerWaalsContact O-OG1 3.1Å; L79-T131 HydrophobicContact CB-CG2 3.96Å; L79-T131 HydrophobicContact CD2-CG2 3.86Å; L79-T131 HydrophobicContact CG-CG2 3.78Å; A80-T131 HydrophobicContact CB-CG2 4.15Å; T131-V135 HydrophobicContact CG2-CG2 4.2Å; T131-V135 VanDerWaalsContact O-CB 3.28Å; T131-V135 WeakPolarHBondContact O-CB 3.45Å; T131-V135 WeakPolarHBondContact O-CG2 3.48Å; T131-V135 PolarHBondContact O-N 3.21Å
132	D	95.3	Very high	96.4	Very high	112 Å²	112	39.1 Å²	39.1	60%	0.599	21%	0.205	S	C	*	.	H	α-helix	trans	-59	-52.8	175.3	38.4	3	0	0	0	111.4	A130 L134 V135 E136	A130-D132 VanDerWaalsContact CB-OD1 3.31Å; A130-D132 WeakPolarHBondContact CB-OD1 3.23Å; D132-L134 PolarHBondContact O-N 2.83Å; D132-V135 PolarHBondContact O-N 2.78Å; D132-V135 VanDerWaalsContact O-N 3.09Å; D132-E136 WeakPolarHBondContact O-CB 3.31Å; D132-E136 PolarHBondContact O-N 3.06Å
133	V	97.6	Very high	96.4	Very high	15 Å²	15	41.3 Å²	41.3	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-48.3	177.9	-178.5	0	0	0	0	111.3	F125 E128 A130 V135 E136 F137 P254 E255	F125-V133 HydrophobicContact CE2-CG1 4.32Å; F125-V133 HydrophobicContact CZ-CG1 3.89Å; E128-V133 HydrophobicContact CB-CG2 4.38Å; A130-V133 HydrophobicContact CB-CB 4.31Å; A130-V133 HydrophobicContact CB-CG2 3.99Å; V133-V135 VanDerWaalsContact C-N 3.35Å; V133-V135 PolarHBondContact O-N 2.89Å; V133-E136 PolarHBondContact O-N 3.21Å; V133-F137 VanDerWaalsContact O-CB 3.31Å; V133-F137 WeakPolarHBondContact O-CB 3.43Å; V133-F137 PolarHBondContact O-N 3.38Å; V133-P254 HydrophobicContact CG1-CB 4.05Å; V133-P254 HydrophobicContact CG2-CB 3.68Å; V133-E255 HydrophobicContact CG1-CB 4.31Å
134	L	97.6	Very high	96.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-38.6	177	-71.2	177.3	0	0	0	113.3	V76 L77 L114 F125 L129 A130 D132 L138	V76-L134 HydrophobicContact CG1-CD1 3.95Å; L77-L134 HydrophobicContact CD2-CD1 3.93Å; L114-L134 HydrophobicContact CD1-CD1 3.88Å; L114-L134 HydrophobicContact CD1-CD2 3.42Å; L114-L134 VanDerWaalsContact CD1-CD2 3.42Å; L114-L134 HydrophobicContact CD1-CG 4.27Å; F125-L134 HydrophobicContact CD1-CD2 3.65Å; F125-L134 HydrophobicContact CD2-CD2 4.46Å; F125-L134 HydrophobicContact CE1-CD2 3.41Å; F125-L134 VanDerWaalsContact CE1-CD2 3.41Å; F125-L134 HydrophobicContact CE1-CG 4.44Å; F125-L134 HydrophobicContact CE2-CD2 4.27Å; F125-L134 HydrophobicContact CG-CD2 4.17Å; F125-L134 HydrophobicContact CZ-CD2 3.75Å; L129-L134 HydrophobicContact CD1-CD1 4.19Å; A130-L134 WeakPolarHBondContact O-CB 3.28Å; A130-L134 VanDerWaalsContact O-CG 3.23Å; A130-L134 WeakPolarHBondContact O-CG 3.37Å; A130-L134 PolarHBondContact O-N 3.39Å; D132-L134 PolarHBondContact O-N 2.83Å; L134-L138 VanDerWaalsContact O-CB 3.29Å; L134-L138 WeakPolarHBondContact O-CB 3.23Å; L134-L138 WeakPolarHBondContact O-CD1 3.29Å; L134-L138 WeakPolarHBondContact O-CG 3.11Å; L134-L138 PolarHBondContact O-N 3.25Å
135	V	97.4	Very high	96.5	Very high	21 Å²	21	44.1 Å²	44.1	13%	0.127	23%	0.232	C	C	.	.	H	α-helix	trans	-66.3	-44.3	179.4	163.4	0	0	0	0	110.3	A80 V83 L84 T131 D132 V133 L139	A80-V135 HydrophobicContact CB-CG2 4.05Å; V83-V135 HydrophobicContact CB-CG2 4.14Å; V83-V135 HydrophobicContact CG1-CG1 3.92Å; V83-V135 HydrophobicContact CG1-CG2 4.07Å; L84-V135 HydrophobicContact CD1-CG2 4.15Å; L84-V135 HydrophobicContact CD2-CG1 4.23Å; L84-V135 HydrophobicContact CG-CG2 4.2Å; T131-V135 HydrophobicContact CG2-CG2 4.2Å; T131-V135 VanDerWaalsContact O-CB 3.28Å; T131-V135 WeakPolarHBondContact O-CB 3.45Å; T131-V135 WeakPolarHBondContact O-CG2 3.48Å; T131-V135 PolarHBondContact O-N 3.21Å; D132-V135 PolarHBondContact O-N 2.78Å; D132-V135 VanDerWaalsContact O-N 3.09Å; V133-V135 VanDerWaalsContact C-N 3.35Å; V133-V135 PolarHBondContact O-N 2.89Å; V135-L139 HydrophobicContact CG1-CD1 3.87Å; V135-L139 HydrophobicContact CG1-CG 4.49Å; V135-L139 WeakPolarHBondContact O-CB 3.42Å; V135-L139 WeakPolarHBondContact O-CG 3.45Å; V135-L139 PolarHBondContact O-N 3.13Å
136	E	97.8	Very high	96.5	Very high	122 Å²	122	44.1 Å²	44.1	57%	0.57	23%	0.232	S	C	*	.	H	α-helix	trans	-61.3	-55.3	176.2	-177.2	159	-167.5	0	0	111	D132 V133 L138 L139 D140	D132-E136 WeakPolarHBondContact O-CB 3.31Å; D132-E136 PolarHBondContact O-N 3.06Å; V133-E136 PolarHBondContact O-N 3.21Å; E136-L138 VanDerWaalsContact C-N 3.3Å; E136-L138 PolarHBondContact O-N 3.17Å; E136-L139 WeakPolarHBondContact O-CB 3.22Å; E136-L139 PolarHBondContact O-N 3.22Å; E136-D140 PolarHBondContact O-N 3.28Å
137	F	98.2	Very high	96.7	Very high	6 Å²	6	47 Å²	47	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-51.3	-46.5	177	177.8	-95.5	0	0	0	113.2	V116 I123 F125 V133 L139 L141 P191 Y192 E255	V116-F137 HydrophobicContact CG2-CE1 4.04Å; I123-F137 HydrophobicContact CG2-CZ 4.11Å; F125-F137 HydrophobicContact CB-CE1 4.17Å; F125-F137 HydrophobicContact CB-CZ 4.36Å; F125-F137 HydrophobicContact CD2-CB 4.32Å; F125-F137 AromaticContact CD2-CD1 3.71Å; F125-F137 HydrophobicContact CD2-CD1 3.71Å; F125-F137 AromaticContact CD2-CD2 3.71Å; F125-F137 HydrophobicContact CD2-CD2 3.71Å; F125-F137 AromaticContact CD2-CE1 3.88Å; F125-F137 HydrophobicContact CD2-CE1 3.88Å; F125-F137 AromaticContact CD2-CE2 3.87Å; F125-F137 HydrophobicContact CD2-CE2 3.87Å; F125-F137 AromaticContact CD2-CG 3.62Å; F125-F137 HydrophobicContact CD2-CG 3.62Å; F125-F137 AromaticContact CD2-CZ 3.96Å; F125-F137 HydrophobicContact CD2-CZ 3.96Å; F125-F137 HydrophobicContact CE2-CB 4.07Å; F125-F137 HydrophobicContact CE2-CD1 4.31Å; F125-F137 AromaticContact CE2-CD2 3.97Å; F125-F137 HydrophobicContact CE2-CD2 3.97Å; F125-F137 AromaticContact CE2-CG 3.85Å; F125-F137 HydrophobicContact CE2-CG 3.85Å; F125-F137 HydrophobicContact CG-CD1 4.46Å; F125-F137 HydrophobicContact CG-CE1 4.43Å; V133-F137 VanDerWaalsContact O-CB 3.31Å; V133-F137 WeakPolarHBondContact O-CB 3.43Å; V133-F137 PolarHBondContact O-N 3.38Å; F137-L139 VanDerWaalsContact C-N 3.35Å; F137-L141 HydrophobicContact CE1-CD2 3.97Å; F137-L141 HydrophobicContact CZ-CD2 4.32Å; F137-L141 WeakPolarHBondContact O-CB 3.31Å; F137-L141 PolarHBondContact O-N 3.42Å; F137-P191 HydrophobicContact CD2-CG 3.49Å; F137-P191 VanDerWaalsContact CD2-CG 3.49Å; F137-P191 HydrophobicContact CE2-CG 3.25Å; F137-P191 HydrophobicContact CG-CG 4.33Å; F137-P191 HydrophobicContact CZ-CG 3.94Å; F137-Y192 HydrophobicContact CD2-CE1 4.29Å; F137-Y192 HydrophobicContact CE2-CD1 4.44Å; F137-Y192 AromaticContact CE2-CE1 3.63Å; F137-Y192 HydrophobicContact CE2-CE1 3.63Å; F137-Y192 HydrophobicContact CE2-CE2 4.09Å; F137-Y192 AromaticContact CE2-CZ 3.44Å; F137-Y192 VanDerWaalsContact CE2-CZ 3.44Å; F137-Y192 WeakPolarHBondContact CE2-OH 3.33Å; F137-Y192 HydrophobicContact CZ-CE2 4.41Å; F137-Y192 AromaticContact CZ-CZ 3.99Å; F137-E255 HydrophobicContact CD2-CB 4.43Å
138	L	97.9	Very high	96.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-73.7	-25.8	-178.7	-67.9	169.2	0	0	0	113	M51 C53 L84 I89 F91 V116 L134 E136 L142	M51-L138 HydrophobicContact SD-CB 4.41Å; M51-L138 HydrophobicContact SD-CD2 3.46Å; M51-L138 WeakPolarHBondContact SD-CD2 3.43Å; C53-L138 HydrophobicContact CB-CD1 4.32Å; C53-L138 HydrophobicContact CB-CD2 4.25Å; L84-L138 HydrophobicContact CD1-CB 3.84Å; L84-L138 HydrophobicContact CD1-CD1 3.59Å; L84-L138 HydrophobicContact CD1-CG 4.38Å; I89-L138 HydrophobicContact CD1-CB 4.12Å; I89-L138 HydrophobicContact CG2-CD1 4.29Å; F91-L138 HydrophobicContact CE1-CD1 3.83Å; F91-L138 HydrophobicContact CE2-CD1 4.21Å; F91-L138 HydrophobicContact CZ-CD1 3.3Å; V116-L138 HydrophobicContact CB-CD2 4.49Å; V116-L138 HydrophobicContact CG1-CD2 3.89Å; V116-L138 HydrophobicContact CG2-CD2 3.72Å; L134-L138 VanDerWaalsContact O-CB 3.29Å; L134-L138 WeakPolarHBondContact O-CB 3.23Å; L134-L138 WeakPolarHBondContact O-CD1 3.29Å; L134-L138 WeakPolarHBondContact O-CG 3.11Å; L134-L138 PolarHBondContact O-N 3.25Å; E136-L138 VanDerWaalsContact C-N 3.3Å; E136-L138 PolarHBondContact O-N 3.17Å; L138-L142 WeakPolarHBondContact O-CB 3.39Å; L138-L142 PolarHBondContact O-N 3.45Å; L138-L142 VanDerWaalsContact O-N 3.13Å
139	L	97.4	Very high	96.9	Very high	58 Å²	58	46.3 Å²	46.3	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-74.2	-45.2	173.1	-74.8	172.3	0	0	0	110.6	L84 R87 V135 E136 F137 L141 L142 E143	L84-L139 HydrophobicContact CD2-CD1 4.43Å; L84-L139 HydrophobicContact CD2-CD2 3.73Å; L84-L139 HydrophobicContact CD2-CG 3.87Å; R87-L139 HydrophobicContact CG-CD2 4.23Å; V135-L139 HydrophobicContact CG1-CD1 3.87Å; V135-L139 HydrophobicContact CG1-CG 4.49Å; V135-L139 WeakPolarHBondContact O-CB 3.42Å; V135-L139 WeakPolarHBondContact O-CG 3.45Å; V135-L139 PolarHBondContact O-N 3.13Å; E136-L139 WeakPolarHBondContact O-CB 3.22Å; E136-L139 PolarHBondContact O-N 3.22Å; F137-L139 VanDerWaalsContact C-N 3.35Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 3.04Å; L139-L142 WeakPolarHBondContact O-CA 3.33Å; L139-L142 VanDerWaalsContact O-CB 3.24Å; L139-L142 WeakPolarHBondContact O-CB 3.11Å; L139-L142 PolarHBondContact O-N 2.82Å; L139-E143 WeakPolarHBondContact O-CG 3.37Å; L139-E143 PolarHBondContact O-N 2.91Å
140	D	96.8	Very high	96.7	Very high	54 Å²	54	47.6 Å²	47.6	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-44.4	174	-83.1	24.1	0	0	0	111.1	E136 L142 E143 P191 K194	E136-D140 PolarHBondContact O-N 3.28Å; D140-L142 PolarHBondContact O-N 2.74Å; D140-E143 WeakPolarHBondContact O-CB 3.29Å; D140-E143 PolarHBondContact O-N 2.9Å; D140-P191 HydrophobicContact CB-CB 3.75Å; D140-P191 HydrophobicContact CB-CG 4.4Å; D140-K194 IonicContact OD2-NZ 3.24Å; D140-K194 PolarHBondContact OD2-NZ 3.21Å; D140-K194 VanDerWaalsContact OD2-NZ 3.13Å
141	L	96.5	Very high	96.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.7	175.7	-176.4	56.5	0	0	0	112.7	M51 V116 K118 I123 F137 L139 E143 Q190 P191	M51-L141 HydrophobicContact CE-CB 4.02Å; M51-L141 HydrophobicContact CE-CD2 3.99Å; M51-L141 HydrophobicContact CE-CG 3.65Å; M51-L141 HydrophobicContact SD-CD2 4.13Å; M51-L141 HydrophobicContact SD-CG 4.4Å; V116-L141 HydrophobicContact CB-CD2 4.1Å; V116-L141 HydrophobicContact CG1-CD2 3.64Å; K118-L141 HydrophobicContact CD-CD1 3.93Å; K118-L141 HydrophobicContact CD-CG 4.11Å; K118-L141 WeakPolarHBondContact CD-O 3.45Å; K118-L141 VanDerWaalsContact CE-O 3.25Å; K118-L141 WeakPolarHBondContact CE-O 3.47Å; K118-L141 PolarHBondContact NZ-O 2.67Å; I123-L141 HydrophobicContact CD1-CD1 3.52Å; I123-L141 HydrophobicContact CD1-CD2 3.63Å; I123-L141 HydrophobicContact CD1-CG 4.16Å; F137-L141 HydrophobicContact CE1-CD2 3.97Å; F137-L141 HydrophobicContact CZ-CD2 4.32Å; F137-L141 WeakPolarHBondContact O-CB 3.31Å; F137-L141 PolarHBondContact O-N 3.42Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 3.04Å; L141-E143 VanDerWaalsContact C-N 3.3Å; L141-Q190 HydrophobicContact CD1-CB 3.73Å; L141-P191 HydrophobicContact CB-CB 4.45Å; L141-P191 HydrophobicContact CB-CG 4.24Å
142	L	94.5	Very high	96.4	Very high	66 Å²	66	54.4 Å²	54.4	35%	0.346	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-23	173.1	-174.4	64.7	0	0	0	111.8	M51 R87 L138 L139 D140	M51-L142 HydrophobicContact CE-CB 4.49Å; R87-L142 HydrophobicContact CB-CD2 4.21Å; L138-L142 WeakPolarHBondContact O-CB 3.39Å; L138-L142 PolarHBondContact O-N 3.45Å; L138-L142 VanDerWaalsContact O-N 3.13Å; L139-L142 WeakPolarHBondContact O-CA 3.33Å; L139-L142 VanDerWaalsContact O-CB 3.24Å; L139-L142 WeakPolarHBondContact O-CB 3.11Å; L139-L142 PolarHBondContact O-N 2.82Å; D140-L142 PolarHBondContact O-N 2.74Å
143	E	94.9	Very high	96.3	Very high	113 Å²	113	55.3 Å²	55.3	53%	0.528	28%	0.282	S	S	.	.	S	Bend	trans	-70.5	166.5	-179.5	-51.2	-157.2	150.3	0	0	112.4	K118 L139 D140 L141 Q190	K118-E143 PolarHBondContact NZ-O 3.16Å; L139-E143 WeakPolarHBondContact O-CG 3.37Å; L139-E143 PolarHBondContact O-N 2.91Å; D140-E143 WeakPolarHBondContact O-CB 3.29Å; D140-E143 PolarHBondContact O-N 2.9Å; L141-E143 VanDerWaalsContact C-N 3.3Å; E143-Q190 PolarHBondContact O-NE2 2.63Å
144	D	95.8	Very high	96.3	Very high	134 Å²	134	58.6 Å²	58.6	72%	0.717	30%	0.296	S	S	*	.			trans	-65.5	143.2	177.1	-69.1	-27.8	0	0	0	109.4	V146	D144-V146 PolarHBondContact O-N 3.02Å
145	P	96.7	Very high	96.2	Very high	19 Å²	19	58.8 Å²	58.8	12%	0.123	30%	0.297	C	S	.	.	S	Bend	trans	-66.1	-19.2	-177.2	27.4	-35.8	0	0	0	114.3	E183 A186 E187 Q190	P145-E183 HydrophobicContact CG-CG 3.99Å; P145-A186 HydrophobicContact CB-CB 3.91Å; P145-A186 WeakPolarHBondContact O-CB 3.49Å; P145-E187 HydrophobicContact CB-CG 3.97Å; P145-E187 HydrophobicContact CG-CG 3.94Å; P145-Q190 VanDerWaalsContact CA-CD 3.44Å; P145-Q190 VanDerWaalsContact CB-CD 3.47Å; P145-Q190 HydrophobicContact CB-CG 3.83Å
146	V	98.6	Very high	96.1	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.9	-179.2	-175.7	0	0	0	0	110.7	D144 I148 Y179 F182 E183 A186 F195 A197	D144-V146 PolarHBondContact O-N 3.02Å; V146-I148 HydrophobicContact CG1-CD1 4.25Å; V146-Y179 HydrophobicContact CG1-CE2 4.06Å; V146-F182 HydrophobicContact CG1-CD1 4.23Å; V146-F182 HydrophobicContact CG1-CE1 3.85Å; V146-F182 HydrophobicContact CG2-CD1 4.11Å; V146-F182 HydrophobicContact CG2-CE1 4.17Å; V146-E183 HydrophobicContact CG2-CB 4.13Å; V146-E183 HydrophobicContact CG2-CG 4.25Å; V146-A186 HydrophobicContact CG2-CB 3.68Å; V146-F195 CarbonylContact C-O 3.59Å; V146-F195 WeakPolarHBondContact CA-O 3.35Å; V146-F195 HydrophobicContact CG2-CB 4.11Å; V146-A197 HydrophobicContact CG1-CB 3.6Å
147	E	98.2	Very high	96	Very high	92 Å²	92	59.8 Å²	59.8	43%	0.43	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.2	174.8	-71.8	-174.9	-124	0	0	111.9	F195 F196 A197	E147-F195 PolarHBondContact N-O 2.71Å; E147-F196 HydrophobicContact CB-CD1 3.58Å; E147-F196 HydrophobicContact CB-CE1 3.72Å; E147-F196 HydrophobicContact CG-CE1 4.27Å; E147-F196 CarbonylContact O-C 3.54Å; E147-F196 VanDerWaalsContact O-CA 3.26Å; E147-F196 WeakPolarHBondContact O-CA 3.46Å; E147-A197 PolarHBondContact O-N 3.24Å
148	I	98.3	Very high	95.9	Very high	44 Å²	44	59.6 Å²	59.6	23%	0.226	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.4	-177.4	-46.8	-57.3	0	0	0	112.1	V146 N150 Y179 A197 F199	V146-I148 HydrophobicContact CG1-CD1 4.25Å; I148-N150 VanDerWaalsContact CG2-ND2 3.26Å; I148-N150 WeakPolarHBondContact CG2-ND2 3.37Å; I148-Y179 HydrophobicContact CD1-CE2 3.93Å; I148-A197 CarbonylContact C-O 3.59Å; I148-A197 WeakPolarHBondContact CA-O 3.36Å; I148-A197 HydrophobicContact CD1-CB 3.91Å; I148-F199 HydrophobicContact CD1-CE2 4.04Å; I148-F199 HydrophobicContact CD1-CZ 3.88Å; I148-F199 HydrophobicContact CG1-CE2 4.37Å; I148-F199 HydrophobicContact CG2-CD2 4.06Å; I148-F199 HydrophobicContact CG2-CE2 3.86Å
149	I	98	Very high	95.8	Very high	5 Å²	5	64.1 Å²	64.1	3%	0.026	33%	0.332	C	S	.	.			trans	-88.9	110.8	174	-56	-174.8	0	0	0	110.4	E154 L155 F158 I168 F196 A197 T198 V203	I149-E154 HydrophobicContact CG2-CB 3.9Å; I149-L155 HydrophobicContact CG2-CB 4.07Å; I149-F158 HydrophobicContact CD1-CB 3.49Å; I149-F158 VanDerWaalsContact CD1-CB 3.49Å; I149-F158 HydrophobicContact CD1-CD2 3.94Å; I149-F158 HydrophobicContact CD1-CG 3.77Å; I149-I168 HydrophobicContact CD1-CD1 3.67Å; I149-F196 HydrophobicContact CD1-CB 4.14Å; I149-F196 HydrophobicContact CD1-CD1 3.85Å; I149-F196 HydrophobicContact CD1-CG 4.2Å; I149-F196 HydrophobicContact CG1-CB 4.42Å; I149-F196 HydrophobicContact CG1-CD1 3.98Å; I149-A197 PolarHBondContact N-O 2.95Å; I149-T198 VanDerWaalsContact O-CB 3.3Å; I149-T198 WeakPolarHBondContact O-CB 3.42Å; I149-T198 PolarHBondContact O-OG1 3.1Å; I149-V203 HydrophobicContact CG2-CG1 3.86Å; I149-V203 HydrophobicContact CG2-CG2 4.46Å
150	N	92.2	Very high	95.7	Very high	90 Å²	90	68.7 Å²	68.7	48%	0.481	35%	0.352	S	S	.	.			trans	-117.6	-8.9	-178.7	-67.9	-56.1	0	0	0	113.3	I148 E154	I148-N150 VanDerWaalsContact CG2-ND2 3.26Å; I148-N150 WeakPolarHBondContact CG2-ND2 3.37Å; N150-E154 WeakPolarHBondContact CA-OE2 3.49Å; N150-E154 PolarHBondContact N-OE2 2.96Å
151	S	92.8	Very high	95.6	Very high	39 Å²	39	68.4 Å²	68.4	27%	0.273	35%	0.35	S	S	.	.	S	Bend	trans	-130.7	163.7	-176.3	83.5	0	0	0	0	113.4	L153 E154 L155	S151-L153 VanDerWaalsContact C-N 3.26Å; S151-L153 PolarHBondContact O-N 3.41Å; S151-L153 PolarHBondContact OG-N 2.86Å; S151-E154 PolarHBondContact N-OE2 3.07Å; S151-E154 VanDerWaalsContact OG-CD 3.3Å; S151-E154 WeakPolarHBondContact OG-CG 3.11Å; S151-E154 PolarHBondContact OG-N 3.1Å; S151-E154 VanDerWaalsContact OG-N 3.11Å; S151-E154 PolarHBondContact OG-OE2 3.17Å; S151-L155 PolarHBondContact O-N 2.87Å; S151-L155 VanDerWaalsContact O-N 3.1Å
152	K	91.9	Very high	95.6	Very high	144 Å²	144	71.2 Å²	71.2	63%	0.626	37%	0.365	S	S	*	.	H	α-helix	trans	-69.6	-25	174	-66.7	-177.3	-179.3	179.1	0	113	Q156	K152-Q156 WeakPolarHBondContact O-CG 3.47Å; K152-Q156 PolarHBondContact O-N 3.45Å
153	L	93.9	Very high	95.6	Very high	131 Å²	131	70.1 Å²	70.1	69%	0.686	36%	0.358	S	S	*	.	H	α-helix	trans	-77.2	-43.4	179.8	-70	171.8	0	0	0	109.8	S151 L155 Q156 A157	S151-L153 VanDerWaalsContact C-N 3.26Å; S151-L153 PolarHBondContact O-N 3.41Å; S151-L153 PolarHBondContact OG-N 2.86Å; L153-L155 VanDerWaalsContact C-N 3.29Å; L153-L155 PolarHBondContact O-N 3.48Å; L153-Q156 WeakPolarHBondContact O-CB 3.16Å; L153-Q156 PolarHBondContact O-N 2.86Å; L153-Q156 VanDerWaalsContact O-N 3.07Å; L153-A157 PolarHBondContact O-N 3.33Å
154	E	96.5	Very high	95.6	Very high	84 Å²	84	66.5 Å²	66.5	39%	0.393	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-40.7	171.9	-71	155	-166.3	0	0	111.1	I149 N150 S151 Q156 A157 F158	I149-E154 HydrophobicContact CG2-CB 3.9Å; N150-E154 WeakPolarHBondContact CA-OE2 3.49Å; N150-E154 PolarHBondContact N-OE2 2.96Å; S151-E154 PolarHBondContact N-OE2 3.07Å; S151-E154 VanDerWaalsContact OG-CD 3.3Å; S151-E154 WeakPolarHBondContact OG-CG 3.11Å; S151-E154 PolarHBondContact OG-N 3.1Å; S151-E154 VanDerWaalsContact OG-N 3.11Å; S151-E154 PolarHBondContact OG-OE2 3.17Å; E154-Q156 VanDerWaalsContact C-N 3.27Å; E154-Q156 PolarHBondContact O-N 3.27Å; E154-A157 WeakPolarHBondContact O-CB 3.5Å; E154-A157 PolarHBondContact O-N 3.22Å; E154-A157 VanDerWaalsContact O-N 3.11Å; E154-F158 PolarHBondContact O-N 2.9Å
155	L	95.9	Very high	95.7	Very high	6 Å²	6	61 Å²	61	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-36.5	173.4	-178.8	62.7	0	0	0	112.5	I149 S151 L153 A157 F158 D159 V203 K206 L207	I149-L155 HydrophobicContact CG2-CB 4.07Å; S151-L155 PolarHBondContact O-N 2.87Å; S151-L155 VanDerWaalsContact O-N 3.1Å; L153-L155 VanDerWaalsContact C-N 3.29Å; L153-L155 PolarHBondContact O-N 3.48Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-F158 HydrophobicContact CD1-CD1 4.06Å; L155-F158 WeakPolarHBondContact O-CB 3.39Å; L155-F158 PolarHBondContact O-N 3.01Å; L155-D159 PolarHBondContact O-N 3.11Å; L155-V203 HydrophobicContact CD1-CG1 4.39Å; L155-V203 HydrophobicContact CD2-CG1 4.45Å; L155-K206 HydrophobicContact CD2-CB 3.96Å; L155-K206 HydrophobicContact CD2-CD 3.46Å; L155-K206 VanDerWaalsContact CD2-CD 3.46Å; L155-K206 HydrophobicContact CD2-CG 4.42Å; L155-L207 HydrophobicContact CD1-CD1 3.97Å; L155-L207 HydrophobicContact CD1-CD2 3.71Å; L155-L207 HydrophobicContact CD1-CG 3.86Å
156	Q	95.3	Very high	95.8	Very high	114 Å²	114	60.7 Å²	60.7	53%	0.533	31%	0.309	S	S	.	.	H	α-helix	trans	-68.3	-33.7	175.2	-74.4	177.7	-55	0	0	112.4	K152 L153 E154 D159 Q160	K152-Q156 WeakPolarHBondContact O-CG 3.47Å; K152-Q156 PolarHBondContact O-N 3.45Å; L153-Q156 WeakPolarHBondContact O-CB 3.16Å; L153-Q156 PolarHBondContact O-N 2.86Å; L153-Q156 VanDerWaalsContact O-N 3.07Å; E154-Q156 VanDerWaalsContact C-N 3.27Å; E154-Q156 PolarHBondContact O-N 3.27Å; Q156-D159 PolarHBondContact O-N 3.22Å; Q156-Q160 WeakPolarHBondContact O-CG 3.32Å; Q156-Q160 PolarHBondContact O-N 2.92Å
157	A	96.1	Very high	95.8	Very high	50 Å²	50	60.4 Å²	60.4	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-42.7	173.3	0	0	0	0	0	110.7	L153 E154 L155 D159 Q160	L153-A157 PolarHBondContact O-N 3.33Å; E154-A157 WeakPolarHBondContact O-CB 3.5Å; E154-A157 PolarHBondContact O-N 3.22Å; E154-A157 VanDerWaalsContact O-N 3.11Å; L155-A157 VanDerWaalsContact C-N 3.33Å; A157-D159 VanDerWaalsContact C-N 3.31Å; A157-D159 PolarHBondContact O-N 3.26Å; A157-Q160 WeakPolarHBondContact O-CB 3.28Å; A157-Q160 PolarHBondContact O-N 3.18Å
158	F	96.6	Very high	95.8	Very high	2 Å²	2	56 Å²	56	1%	0.009	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-43.6	172.1	169.4	-91.9	0	0	0	112.3	I149 E154 L155 Q160 I161 K166 I168 F196 L207 Y217	I149-F158 HydrophobicContact CD1-CB 3.49Å; I149-F158 VanDerWaalsContact CD1-CB 3.49Å; I149-F158 HydrophobicContact CD1-CD2 3.94Å; I149-F158 HydrophobicContact CD1-CG 3.77Å; E154-F158 PolarHBondContact O-N 2.9Å; L155-F158 HydrophobicContact CD1-CD1 4.06Å; L155-F158 WeakPolarHBondContact O-CB 3.39Å; L155-F158 PolarHBondContact O-N 3.01Å; F158-Q160 PolarHBondContact O-N 3.15Å; F158-I161 PolarHBondContact O-N 3.01Å; F158-K166 HydrophobicContact CD2-CD 4.11Å; F158-K166 HydrophobicContact CE2-CB 4.4Å; F158-K166 HydrophobicContact CE2-CD 3.61Å; F158-K166 HydrophobicContact CE2-CG 3.95Å; F158-K166 HydrophobicContact CZ-CD 3.91Å; F158-K166 HydrophobicContact CZ-CG 4.23Å; F158-K166 PolarHBondContact O-NZ 2.87Å; F158-I168 HydrophobicContact CD2-CD1 4.27Å; F158-I168 HydrophobicContact CE1-CD1 4.37Å; F158-I168 HydrophobicContact CE1-CG2 4.28Å; F158-I168 HydrophobicContact CE2-CB 3.93Å; F158-I168 HydrophobicContact CE2-CD1 4.09Å; F158-I168 HydrophobicContact CE2-CG2 4.14Å; F158-I168 HydrophobicContact CG-CD1 4.49Å; F158-I168 HydrophobicContact CZ-CB 3.9Å; F158-I168 HydrophobicContact CZ-CD1 4.15Å; F158-I168 HydrophobicContact CZ-CG2 3.58Å; F158-F196 HydrophobicContact CD2-CB 4.29Å; F158-F196 HydrophobicContact CD2-CD1 4.16Å; F158-F196 AromaticContact CD2-CD2 3.52Å; F158-F196 HydrophobicContact CD2-CD2 3.52Å; F158-F196 HydrophobicContact CD2-CE1 4.42Å; F158-F196 AromaticContact CD2-CE2 3.8Å; F158-F196 HydrophobicContact CD2-CE2 3.8Å; F158-F196 AromaticContact CD2-CG 3.71Å; F158-F196 HydrophobicContact CD2-CG 3.71Å; F158-F196 HydrophobicContact CD2-CZ 4.26Å; F158-F196 HydrophobicContact CE2-CB 4.36Å; F158-F196 AromaticContact CE2-CD2 3.6Å; F158-F196 HydrophobicContact CE2-CD2 3.6Å; F158-F196 HydrophobicContact CE2-CE2 4.12Å; F158-F196 HydrophobicContact CE2-CG 4.05Å; F158-L207 HydrophobicContact CD1-CD2 4.4Å; F158-L207 HydrophobicContact CE1-CD2 3.97Å; F158-Y217 HydrophobicContact CE1-CE2 4.24Å; F158-Y217 AromaticContact CZ-CD2 3.99Å; F158-Y217 HydrophobicContact CZ-CD2 3.99Å; F158-Y217 AromaticContact CZ-CE2 3.76Å; F158-Y217 HydrophobicContact CZ-CE2 3.76Å
159	D	94.8	Very high	95.8	Very high	95 Å²	95	53.9 Å²	53.9	51%	0.508	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-18.5	178.5	-64	-24.2	0	0	0	112.7	L155 Q156 A157	L155-D159 PolarHBondContact O-N 3.11Å; Q156-D159 PolarHBondContact O-N 3.22Å; A157-D159 VanDerWaalsContact C-N 3.31Å; A157-D159 PolarHBondContact O-N 3.26Å
160	Q	95.1	Very high	95.9	Very high	154 Å²	154	55 Å²	55	72%	0.72	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-10.7	179.8	-74.3	-179	-35.3	0	0	114.4	Q156 A157 F158 D162	Q156-Q160 WeakPolarHBondContact O-CG 3.32Å; Q156-Q160 PolarHBondContact O-N 2.92Å; A157-Q160 WeakPolarHBondContact O-CB 3.28Å; A157-Q160 PolarHBondContact O-N 3.18Å; F158-Q160 PolarHBondContact O-N 3.15Å; Q160-D162 PolarHBondContact O-N 2.85Å
161	I	95.9	Very high	96.1	Very high	47 Å²	47	50.8 Å²	50.8	24%	0.241	26%	0.257	C	S	.	.			trans	-83.3	95.5	177.7	-58	167.3	0	0	0	107.6	F158 E164 K166 F196	F158-I161 PolarHBondContact O-N 3.01Å; I161-E164 HydrophobicContact CG2-CB 4.18Å; I161-K166 HydrophobicContact CB-CD 3.93Å; I161-K166 HydrophobicContact CG2-CD 4.04Å; I161-K166 WeakPolarHBondContact O-CD 3.29Å; I161-K166 VanDerWaalsContact O-CE 3.3Å; I161-K166 WeakPolarHBondContact O-CE 3.49Å; I161-K166 PolarHBondContact O-NZ 2.81Å; I161-F196 HydrophobicContact CD1-CE2 4.02Å; I161-F196 HydrophobicContact CD1-CZ 3.53Å
162	D	94.8	Very high	96.4	Very high	59 Å²	59	57.2 Å²	57.2	32%	0.316	28%	0.28	S	S	.	.			trans	-110	-18.5	179	68.4	-30.6	0	0	0	113.6	Q160 P219 F220 K289	Q160-D162 PolarHBondContact O-N 2.85Å; D162-P219 CarbonylContact O-C 3.57Å; D162-P219 VanDerWaalsContact O-CA 3.29Å; D162-P219 WeakPolarHBondContact O-CA 3.24Å; D162-F220 PolarHBondContact O-N 2.9Å; D162-K289 IonicContact OD2-NZ 3.43Å; D162-K289 PolarHBondContact OD2-NZ 2.83Å
163	E	95.3	Very high	96.6	Very high	44 Å²	44	51.2 Å²	51.2	21%	0.206	26%	0.259	C	S	.	.	S	Bend	trans	-83.4	-14.3	-176.3	-47.6	-168.1	138	0	0	114.6	F220 K251 W305	E163-F220 HydrophobicContact CB-CE1 4.19Å; E163-F220 HydrophobicContact CB-CZ 3.97Å; E163-F220 HydrophobicContact CG-CE1 3.92Å; E163-F220 HydrophobicContact CG-CZ 4.11Å; E163-K251 HydrophobicContact CB-CD 4.36Å; E163-K251 HydrophobicContact CG-CD 4.48Å; E163-K251 IonicContact OE1-NZ 3.32Å; E163-K251 PolarHBondContact OE1-NZ 2.99Å; E163-K251 VanDerWaalsContact OE2-CD 3.23Å; E163-K251 WeakPolarHBondContact OE2-CD 3.25Å; E163-K251 IonicContact OE2-NZ 3.52Å; E163-K251 PolarHBondContact OE2-NZ 3.19Å; E163-W305 WeakPolarHBondContact OE1-CH2 3.3Å; E163-W305 WeakPolarHBondContact OE1-CZ3 3.26Å
164	E	95.4	Very high	96.7	Very high	37 Å²	37	50.8 Å²	50.8	17%	0.173	25%	0.253	C	S	.	.	S	Bend	trans	-121.8	150.2	-171.9	-54	-172.8	166.6	0	0	112.1	I161 K166 K194 R253	I161-E164 HydrophobicContact CG2-CB 4.18Å; E164-K166 PolarHBondContact O-N 3.4Å; E164-K194 WeakPolarHBondContact OE2-CE 3.5Å; E164-K194 VanDerWaalsContact OE2-CG 3.29Å; E164-K194 WeakPolarHBondContact OE2-CG 3.41Å; E164-R253 IonicContact OE1-NH1 3.7Å; E164-R253 PolarHBondContact OE1-NH1 2.65Å; E164-R253 IonicContact OE2-NH1 3.56Å
165	I	98.2	Very high	96.7	Very high	18 Å²	18	54 Å²	54	9%	0.092	27%	0.273	C	S	.	.			trans	-63.1	128.6	168.7	-61.5	167.6	0	0	0	108	L167 I193 K194 F216 Y217 P219 K245	I165-L167 HydrophobicContact CG2-CD1 4.2Å; I165-I193 HydrophobicContact CB-CG1 4.3Å; I165-I193 HydrophobicContact CB-CG2 4.04Å; I165-I193 HydrophobicContact CD1-CD1 4.23Å; I165-I193 HydrophobicContact CG2-CD1 4.37Å; I165-I193 HydrophobicContact CG2-CG1 4.49Å; I165-I193 HydrophobicContact CG2-CG2 3.65Å; I165-K194 PolarHBondContact O-N 3.09Å; I165-F216 HydrophobicContact CD1-CZ 4.39Å; I165-F216 HydrophobicContact CG1-CZ 4.35Å; I165-F216 HydrophobicContact CG2-CD2 4.09Å; I165-F216 HydrophobicContact CG2-CE1 4.39Å; I165-F216 HydrophobicContact CG2-CE2 3.28Å; I165-F216 HydrophobicContact CG2-CZ 3.47Å; I165-F216 VanDerWaalsContact CG2-CZ 3.47Å; I165-Y217 WeakPolarHBondContact CA-O 3.48Å; I165-P219 VanDerWaalsContact CG1-CD 3.45Å; I165-P219 HydrophobicContact CG1-CG 3.87Å; I165-K245 WeakPolarHBondContact CD1-O 3.42Å
166	K	98.3	Very high	96.8	Very high	13 Å²	13	54.5 Å²	54.5	6%	0.057	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.2	174.9	66.6	-171.8	-176.3	-170.4	0	112	F158 I161 E164 K194 F196 Y217	F158-K166 HydrophobicContact CD2-CD 4.11Å; F158-K166 HydrophobicContact CE2-CB 4.4Å; F158-K166 HydrophobicContact CE2-CD 3.61Å; F158-K166 HydrophobicContact CE2-CG 3.95Å; F158-K166 HydrophobicContact CZ-CD 3.91Å; F158-K166 HydrophobicContact CZ-CG 4.23Å; F158-K166 PolarHBondContact O-NZ 2.87Å; I161-K166 HydrophobicContact CB-CD 3.93Å; I161-K166 HydrophobicContact CG2-CD 4.04Å; I161-K166 WeakPolarHBondContact O-CD 3.29Å; I161-K166 VanDerWaalsContact O-CE 3.3Å; I161-K166 WeakPolarHBondContact O-CE 3.49Å; I161-K166 PolarHBondContact O-NZ 2.81Å; E164-K166 PolarHBondContact O-N 3.4Å; K166-K194 CarbonylContact C-O 3.58Å; K166-K194 VanDerWaalsContact CA-O 3.27Å; K166-K194 WeakPolarHBondContact CA-O 3.45Å; K166-K194 HydrophobicContact CB-CB 4.4Å; K166-F196 HydrophobicContact CB-CD2 4.38Å; K166-F196 HydrophobicContact CB-CE2 4.11Å; K166-Y217 HydrophobicContact CG-CD2 4.3Å; K166-Y217 HydrophobicContact CG-CG 4.14Å; K166-Y217 PolarHBondContact N-O 3.05Å; K166-Y217 VanDerWaalsContact N-O 3.16Å; K166-Y217 WeakPolarHBondContact O-CB 3.47Å; K166-Y217 PolarHBondContact O-N 3.04Å
167	L	98.7	Very high	96.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.2	175.3	-70.6	90.5	0	0	0	110.5	I165 F182 I193 K194 F195 F196 V214 D215 F216 I227 V241	I165-L167 HydrophobicContact CG2-CD1 4.2Å; L167-F182 HydrophobicContact CB-CE2 4.23Å; L167-F182 HydrophobicContact CB-CZ 4.19Å; L167-I193 HydrophobicContact CD1-CG2 3.5Å; L167-I193 VanDerWaalsContact CD1-CG2 3.5Å; L167-K194 PolarHBondContact N-O 2.94Å; L167-F195 HydrophobicContact CB-CD1 4.23Å; L167-F195 HydrophobicContact CB-CE1 4.37Å; L167-F195 HydrophobicContact CB-CG 4.38Å; L167-F195 HydrophobicContact CD1-CD2 4.21Å; L167-F195 HydrophobicContact CD1-CE1 4.32Å; L167-F195 HydrophobicContact CD1-CE2 3.75Å; L167-F195 HydrophobicContact CD1-CZ 3.81Å; L167-F195 HydrophobicContact CD2-CE1 3.97Å; L167-F195 HydrophobicContact CD2-CZ 4.06Å; L167-F195 HydrophobicContact CG-CE1 4.46Å; L167-F195 HydrophobicContact CG-CZ 4.4Å; L167-F196 WeakPolarHBondContact O-CB 3.19Å; L167-F196 PolarHBondContact O-N 3.38Å; L167-V214 HydrophobicContact CB-CG1 4.41Å; L167-V214 HydrophobicContact CD2-CG1 4.05Å; L167-D215 CarbonylContact C-O 3.49Å; L167-D215 VanDerWaalsContact CA-O 3.28Å; L167-D215 WeakPolarHBondContact CA-O 3.49Å; L167-F216 HydrophobicContact CD1-CD2 3.92Å; L167-F216 HydrophobicContact CD1-CE2 4.31Å; L167-F216 HydrophobicContact CD2-CD2 4.12Å; L167-F216 HydrophobicContact CG-CB 4.48Å; L167-F216 HydrophobicContact CG-CD2 3.89Å; L167-I227 HydrophobicContact CD2-CD1 4.03Å; L167-V241 HydrophobicContact CD1-CG2 4.05Å; L167-V241 HydrophobicContact CD2-CG2 3.66Å; L167-V241 HydrophobicContact CG-CG2 4.48Å
168	I	98.6	Very high	97	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	123.8	172.5	-173.3	158	0	0	0	113	I149 F158 F196 L207 L209 V214 D215 Y217	I149-I168 HydrophobicContact CD1-CD1 3.67Å; F158-I168 HydrophobicContact CD2-CD1 4.27Å; F158-I168 HydrophobicContact CE1-CD1 4.37Å; F158-I168 HydrophobicContact CE1-CG2 4.28Å; F158-I168 HydrophobicContact CE2-CB 3.93Å; F158-I168 HydrophobicContact CE2-CD1 4.09Å; F158-I168 HydrophobicContact CE2-CG2 4.14Å; F158-I168 HydrophobicContact CG-CD1 4.49Å; F158-I168 HydrophobicContact CZ-CB 3.9Å; F158-I168 HydrophobicContact CZ-CD1 4.15Å; F158-I168 HydrophobicContact CZ-CG2 3.58Å; I168-F196 VanDerWaalsContact CA-O 3.28Å; I168-F196 WeakPolarHBondContact CA-O 3.4Å; I168-F196 HydrophobicContact CB-CB 4.08Å; I168-F196 HydrophobicContact CD1-CB 4Å; I168-F196 HydrophobicContact CG1-CB 3.98Å; I168-L207 HydrophobicContact CD1-CD1 3.41Å; I168-L207 VanDerWaalsContact CD1-CD1 3.41Å; I168-L207 HydrophobicContact CG1-CD1 4.1Å; I168-L209 HydrophobicContact CG1-CD1 4.24Å; I168-L209 HydrophobicContact CG2-CD1 4.23Å; I168-V214 WeakPolarHBondContact O-CA 3.27Å; I168-D215 HydrophobicContact CG2-CB 4.09Å; I168-D215 PolarHBondContact N-O 3.08Å; I168-D215 PolarHBondContact O-N 2.9Å; I168-Y217 HydrophobicContact CG2-CD2 4.41Å; I168-Y217 HydrophobicContact CG2-CE2 3.69Å
169	G	98.4	Very high	97.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.6	178.8	0	0	0	0	0	114	F196 A197 T198 E213	G169-F196 PolarHBondContact N-O 3.4Å; G169-A197 CarbonylContact O-C 3.54Å; G169-A197 WeakPolarHBondContact O-CA 3.46Å; G169-T198 PolarHBondContact O-N 3.47Å; G169-E213 WeakPolarHBondContact CA-O 3.4Å
170	Y	98.3	Very high	97.3	Very high	27 Å²	27	57.1 Å²	57.1	11%	0.106	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	113	169.5	173.8	-140.2	0	0	0	111.6	T198 A204 K210 M211 N212 E213	Y170-T198 HydrophobicContact CD2-CG2 3.91Å; Y170-T198 WeakPolarHBondContact CD2-O 3.44Å; Y170-T198 HydrophobicContact CG-CG2 4.39Å; Y170-A204 HydrophobicContact CD1-CB 3.44Å; Y170-A204 VanDerWaalsContact CD1-CB 3.44Å; Y170-A204 HydrophobicContact CD2-CB 3.64Å; Y170-A204 HydrophobicContact CE1-CB 3.83Å; Y170-A204 HydrophobicContact CE2-CB 4.01Å; Y170-A204 HydrophobicContact CG-CB 3.37Å; Y170-K210 VanDerWaalsContact CD1-C 3.48Å; Y170-M211 HydrophobicContact CD1-CB 4.49Å; Y170-M211 HydrophobicContact CE1-CB 4.31Å; Y170-M211 HydrophobicContact CE1-CE 3.75Å; Y170-M211 HydrophobicContact CE1-SD 4.44Å; Y170-M211 HydrophobicContact CE2-CE 4.11Å; Y170-M211 VanDerWaalsContact CZ-CE 3.49Å; Y170-M211 WeakPolarHBondContact OH-CE 3.37Å; Y170-N212 WeakPolarHBondContact O-CA 3.43Å; Y170-N212 PolarHBondContact O-N 3.35Å; Y170-E213 PolarHBondContact N-O 2.76Å
171	F	98.4	Very high	97.4	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	25%	0.247	C	C	.	.			trans	-121.8	170.9	-177.2	-52.2	-76.9	0	0	0	113	G173 H178 Y179 F182 A197 T198 F199 M211 V214	F171-G173 VanDerWaalsContact C-N 3.31Å; F171-H178 HydrophobicContact CD1-CB 3.91Å; F171-H178 HydrophobicContact CE1-CB 4.04Å; F171-Y179 AromaticContact CD2-CD2 3.75Å; F171-Y179 HydrophobicContact CD2-CD2 3.75Å; F171-Y179 HydrophobicContact CD2-CG 4.43Å; F171-Y179 HydrophobicContact CE2-CD2 4.18Å; F171-Y179 HydrophobicContact CG-CD2 4.34Å; F171-F182 HydrophobicContact CE1-CB 4.3Å; F171-F182 HydrophobicContact CE2-CB 4.03Å; F171-F182 AromaticContact CE2-CD1 3.67Å; F171-F182 HydrophobicContact CE2-CD1 3.67Å; F171-F182 HydrophobicContact CE2-CD2 4.38Å; F171-F182 HydrophobicContact CE2-CE1 4.18Å; F171-F182 AromaticContact CE2-CG 3.77Å; F171-F182 HydrophobicContact CE2-CG 3.77Å; F171-F182 HydrophobicContact CZ-CB 3.54Å; F171-F182 AromaticContact CZ-CD1 3.96Å; F171-F182 HydrophobicContact CZ-CD1 3.96Å; F171-F182 AromaticContact CZ-CD2 3.92Å; F171-F182 HydrophobicContact CZ-CD2 3.92Å; F171-F182 AromaticContact CZ-CG 3.54Å; F171-F182 HydrophobicContact CZ-CG 3.54Å; F171-A197 HydrophobicContact CD2-CB 4.03Å; F171-A197 HydrophobicContact CE2-CB 4.14Å; F171-T198 PolarHBondContact N-O 3.19Å; F171-F199 HydrophobicContact CB-CD1 4.07Å; F171-F199 HydrophobicContact CB-CE1 4.01Å; F171-M211 VanDerWaalsContact C-SD 3.55Å; F171-V214 HydrophobicContact CE1-CG2 4.43Å; F171-V214 HydrophobicContact CZ-CG2 3.87Å
172	K	97.4	Very high	97.5	Very high	175 Å²	175	48.2 Å²	48.2	76%	0.761	24%	0.236	S	C	*	.	S	Bend	trans	-73.7	-25.7	179.4	-172.3	179.1	175.1	-170.2	0	112.7	M211	K172-M211 HydrophobicContact CB-CE 4.42Å; K172-M211 HydrophobicContact CB-SD 4.08Å; K172-M211 PolarHBondContact N-SD 2.87Å; K172-M211 VanDerWaalsContact N-SD 3.43Å
173	G	97.3	Very high	97.7	Very high	18 Å²	18	48.5 Å²	48.5	19%	0.186	24%	0.235	C	C	.	.			trans	153.7	170.9	-174.2	0	0	0	0	0	111	F171 D175 S176 F199	F171-G173 VanDerWaalsContact C-N 3.31Å; G173-D175 PolarHBondContact O-N 3.03Å; G173-S176 VanDerWaalsContact O-CB 3.27Å; G173-S176 WeakPolarHBondContact O-CB 3.29Å; G173-S176 PolarHBondContact O-N 3.11Å; G173-S176 PolarHBondContact O-OG 3.39Å; G173-F199 VanDerWaalsContact CA-CD1 3.45Å
174	E	96.6	Very high	97.8	Very high	122 Å²	122	50.8 Å²	50.8	57%	0.57	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.3	-177.7	-63.4	167.6	-161.8	0	0	113.3	S176 Y179 F199	E174-S176 PolarHBondContact O-N 3.33Å; E174-Y179 HydrophobicContact CB-CD1 4.38Å; E174-Y179 HydrophobicContact CB-CE1 4.27Å; E174-Y179 HydrophobicContact CG-CE1 4.34Å; E174-Y179 WeakPolarHBondContact O-CD1 3.35Å; E174-F199 HydrophobicContact CB-CZ 4.48Å; E174-F199 HydrophobicContact CG-CE2 3.56Å; E174-F199 HydrophobicContact CG-CZ 3.64Å
175	D	96.5	Very high	97.9	Very high	150 Å²	150	49 Å²	49	80%	0.802	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-4.3	178.8	-73.2	-42.5	0	0	0	113.9	G173	G173-D175 PolarHBondContact O-N 3.03Å
176	S	97	Very high	97.9	Very high	18 Å²	18	48.1 Å²	48.1	13%	0.126	23%	0.233	C	C	.	.	S	Bend	trans	-77.2	137.6	-177.9	76.8	0	0	0	0	111.9	G173 E174 H178 Y179 K180	G173-S176 VanDerWaalsContact O-CB 3.27Å; G173-S176 WeakPolarHBondContact O-CB 3.29Å; G173-S176 PolarHBondContact O-N 3.11Å; G173-S176 PolarHBondContact O-OG 3.39Å; E174-S176 PolarHBondContact O-N 3.33Å; S176-H178 PolarHBondContact O-N 3.5Å; S176-Y179 PolarHBondContact O-N 3.46Å; S176-Y179 VanDerWaalsContact O-N 3.15Å; S176-Y179 VanDerWaalsContact OG-CB 3.25Å; S176-Y179 WeakPolarHBondContact OG-CB 3.3Å; S176-Y179 PolarHBondContact OG-N 3.16Å; S176-K180 PolarHBondContact O-N 3.47Å; S176-K180 VanDerWaalsContact O-N 3.11Å
177	E	97.6	Very high	97.8	Very high	159 Å²	159	50.3 Å²	50.3	74%	0.743	24%	0.243	S	C	*	.	H	α-helix	trans	-56	-37.7	178.8	-174.5	176.9	171.9	0	0	112.3	K180 A181	E177-K180 PolarHBondContact O-N 3.02Å; E177-A181 PolarHBondContact O-N 3.29Å
178	H	97.9	Very high	97.7	Very high	53 Å²	53	55 Å²	55	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-71.6	-34.4	179.2	-52.2	-53.4	0	0	0	113.5	F171 S176 K180 F182 N212 P231	F171-H178 HydrophobicContact CD1-CB 3.91Å; F171-H178 HydrophobicContact CE1-CB 4.04Å; S176-H178 PolarHBondContact O-N 3.5Å; H178-K180 VanDerWaalsContact C-N 3.35Å; H178-F182 WeakPolarHBondContact O-CB 3.33Å; H178-F182 PolarHBondContact O-N 2.73Å; H178-F182 VanDerWaalsContact O-N 3.13Å; H178-N212 PolarHBondContact CD2-ND2 2.88Å; H178-N212 PolarHBondContact CD2-OD1 2.95Å; H178-N212 PolarHBondContact NE2-ND2 2.74Å; H178-P231 WeakPolarHBondContact CE1-CB 3.4Å; H178-P231 WeakPolarHBondContact ND1-CB 3.43Å
179	Y	98.6	Very high	97.6	Very high	10 Å²	10	55.9 Å²	55.9	4%	0.039	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-40.1	172.7	171.7	-96.1	0	0	0	110.6	V146 I148 F171 E174 S176 F182 E183 A197 F199	V146-Y179 HydrophobicContact CG1-CE2 4.06Å; I148-Y179 HydrophobicContact CD1-CE2 3.93Å; F171-Y179 AromaticContact CD2-CD2 3.75Å; F171-Y179 HydrophobicContact CD2-CD2 3.75Å; F171-Y179 HydrophobicContact CD2-CG 4.43Å; F171-Y179 HydrophobicContact CE2-CD2 4.18Å; F171-Y179 HydrophobicContact CG-CD2 4.34Å; E174-Y179 HydrophobicContact CB-CD1 4.38Å; E174-Y179 HydrophobicContact CB-CE1 4.27Å; E174-Y179 HydrophobicContact CG-CE1 4.34Å; E174-Y179 WeakPolarHBondContact O-CD1 3.35Å; S176-Y179 PolarHBondContact O-N 3.46Å; S176-Y179 VanDerWaalsContact O-N 3.15Å; S176-Y179 VanDerWaalsContact OG-CB 3.25Å; S176-Y179 WeakPolarHBondContact OG-CB 3.3Å; S176-Y179 PolarHBondContact OG-N 3.16Å; Y179-F182 CarbonylContact O-C 3.57Å; Y179-F182 WeakPolarHBondContact O-CB 3.41Å; Y179-F182 PolarHBondContact O-N 2.84Å; Y179-F182 VanDerWaalsContact O-N 3.15Å; Y179-E183 HydrophobicContact CE1-CB 4.26Å; Y179-E183 WeakPolarHBondContact CE1-OE1 3.46Å; Y179-E183 WeakPolarHBondContact O-CB 3.46Å; Y179-E183 PolarHBondContact O-N 2.82Å; Y179-E183 PolarHBondContact OH-OE1 2.92Å; Y179-A197 HydrophobicContact CD2-CB 4.02Å; Y179-A197 HydrophobicContact CE2-CB 3.74Å; Y179-F199 AromaticContact CD2-CE1 3.72Å; Y179-F199 HydrophobicContact CD2-CE1 3.72Å; Y179-F199 AromaticContact CD2-CZ 3.86Å; Y179-F199 HydrophobicContact CD2-CZ 3.86Å; Y179-F199 HydrophobicContact CE2-CE1 4.11Å; Y179-F199 AromaticContact CE2-CZ 3.8Å; Y179-F199 HydrophobicContact CE2-CZ 3.8Å; Y179-F199 HydrophobicContact CG-CE1 4.18Å; Y179-F199 HydrophobicContact CG-CZ 4.32Å
180	K	98.4	Very high	97.4	Very high	94 Å²	94	56.4 Å²	56.4	41%	0.409	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-42.9	178.1	-68.1	-179.1	179.7	-175.7	0	112.6	S176 E177 H178 F182 E183 E184	S176-K180 PolarHBondContact O-N 3.47Å; S176-K180 VanDerWaalsContact O-N 3.11Å; E177-K180 PolarHBondContact O-N 3.02Å; H178-K180 VanDerWaalsContact C-N 3.35Å; K180-F182 VanDerWaalsContact C-N 3.26Å; K180-F182 PolarHBondContact O-N 2.83Å; K180-E183 PolarHBondContact O-N 3.35Å; K180-E184 WeakPolarHBondContact O-CB 3.47Å; K180-E184 VanDerWaalsContact O-CG 3.28Å; K180-E184 WeakPolarHBondContact O-CG 3.3Å; K180-E184 PolarHBondContact O-N 3.28Å
181	A	98.3	Very high	97.3	Very high	13 Å²	13	55.7 Å²	55.7	11%	0.107	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-36.1	173.1	0	0	0	0	0	112.3	E177 A185	E177-A181 PolarHBondContact O-N 3.29Å; A181-A185 WeakPolarHBondContact O-CB 3.37Å; A181-A185 PolarHBondContact O-N 3.15Å
182	F	98.6	Very high	97.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.1	-40	175.5	-178.3	-100.3	0	0	0	112.6	V146 L167 F171 H178 Y179 K180 A185 A186 F195 F196 A197 V214 L237	V146-F182 HydrophobicContact CG1-CD1 4.23Å; V146-F182 HydrophobicContact CG1-CE1 3.85Å; V146-F182 HydrophobicContact CG2-CD1 4.11Å; V146-F182 HydrophobicContact CG2-CE1 4.17Å; L167-F182 HydrophobicContact CB-CE2 4.23Å; L167-F182 HydrophobicContact CB-CZ 4.19Å; F171-F182 HydrophobicContact CE1-CB 4.3Å; F171-F182 HydrophobicContact CE2-CB 4.03Å; F171-F182 AromaticContact CE2-CD1 3.67Å; F171-F182 HydrophobicContact CE2-CD1 3.67Å; F171-F182 HydrophobicContact CE2-CD2 4.38Å; F171-F182 HydrophobicContact CE2-CE1 4.18Å; F171-F182 AromaticContact CE2-CG 3.77Å; F171-F182 HydrophobicContact CE2-CG 3.77Å; F171-F182 HydrophobicContact CZ-CB 3.54Å; F171-F182 AromaticContact CZ-CD1 3.96Å; F171-F182 HydrophobicContact CZ-CD1 3.96Å; F171-F182 AromaticContact CZ-CD2 3.92Å; F171-F182 HydrophobicContact CZ-CD2 3.92Å; F171-F182 AromaticContact CZ-CG 3.54Å; F171-F182 HydrophobicContact CZ-CG 3.54Å; H178-F182 WeakPolarHBondContact O-CB 3.33Å; H178-F182 PolarHBondContact O-N 2.73Å; H178-F182 VanDerWaalsContact O-N 3.13Å; Y179-F182 CarbonylContact O-C 3.57Å; Y179-F182 WeakPolarHBondContact O-CB 3.41Å; Y179-F182 PolarHBondContact O-N 2.84Å; Y179-F182 VanDerWaalsContact O-N 3.15Å; K180-F182 VanDerWaalsContact C-N 3.26Å; K180-F182 PolarHBondContact O-N 2.83Å; F182-A185 PolarHBondContact O-N 3.34Å; F182-A186 WeakPolarHBondContact O-CB 3.27Å; F182-A186 PolarHBondContact O-N 3.29Å; F182-F195 HydrophobicContact CD1-CD1 4.36Å; F182-F195 HydrophobicContact CD2-CD1 4.11Å; F182-F195 HydrophobicContact CD2-CE1 4.33Å; F182-F195 HydrophobicContact CE1-CB 4.08Å; F182-F195 AromaticContact CE1-CD1 3.82Å; F182-F195 HydrophobicContact CE1-CD1 3.82Å; F182-F195 HydrophobicContact CE1-CG 4.45Å; F182-F195 AromaticContact CE2-CD1 3.52Å; F182-F195 HydrophobicContact CE2-CD1 3.52Å; F182-F195 AromaticContact CE2-CE1 3.9Å; F182-F195 HydrophobicContact CE2-CE1 3.9Å; F182-F195 HydrophobicContact CZ-CB 4.07Å; F182-F195 AromaticContact CZ-CD1 3.37Å; F182-F195 HydrophobicContact CZ-CD1 3.37Å; F182-F195 HydrophobicContact CZ-CE1 4.22Å; F182-F195 HydrophobicContact CZ-CG 4.11Å; F182-F196 VanDerWaalsContact CE1-O 3.22Å; F182-F196 WeakPolarHBondContact CE1-O 3.41Å; F182-F196 WeakPolarHBondContact CZ-O 3.36Å; F182-A197 HydrophobicContact CE1-CB 4.39Å; F182-V214 HydrophobicContact CD2-CG1 4.26Å; F182-V214 HydrophobicContact CD2-CG2 3.79Å; F182-V214 HydrophobicContact CE2-CB 4.46Å; F182-V214 HydrophobicContact CE2-CG1 3.62Å; F182-V214 HydrophobicContact CE2-CG2 3.89Å; F182-L237 HydrophobicContact CB-CD1 4.1Å; F182-L237 HydrophobicContact CD2-CD1 3.87Å; F182-L237 HydrophobicContact CG-CD1 4.47Å
183	E	98.4	Very high	97.1	Very high	65 Å²	65	49.2 Å²	49.2	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-45.1	174.6	-174.8	174.3	-108.8	0	0	111.5	P145 V146 Y179 K180 A185 A186 E187	P145-E183 HydrophobicContact CG-CG 3.99Å; V146-E183 HydrophobicContact CG2-CB 4.13Å; V146-E183 HydrophobicContact CG2-CG 4.25Å; Y179-E183 HydrophobicContact CE1-CB 4.26Å; Y179-E183 WeakPolarHBondContact CE1-OE1 3.46Å; Y179-E183 WeakPolarHBondContact O-CB 3.46Å; Y179-E183 PolarHBondContact O-N 2.82Å; Y179-E183 PolarHBondContact OH-OE1 2.92Å; K180-E183 PolarHBondContact O-N 3.35Å; E183-A185 VanDerWaalsContact C-N 3.33Å; E183-A185 PolarHBondContact O-N 2.82Å; E183-A186 WeakPolarHBondContact O-CB 3.48Å; E183-A186 PolarHBondContact O-N 3.3Å; E183-E187 WeakPolarHBondContact O-CG 3.43Å; E183-E187 PolarHBondContact O-N 3.28Å
184	E	97.3	Very high	97.2	Very high	92 Å²	92	50.2 Å²	50.2	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-40.8	173.2	-72.9	168.4	176.9	0	0	111	K180 E187 H188 E234	K180-E184 WeakPolarHBondContact O-CB 3.47Å; K180-E184 VanDerWaalsContact O-CG 3.28Å; K180-E184 WeakPolarHBondContact O-CG 3.3Å; K180-E184 PolarHBondContact O-N 3.28Å; E184-E187 WeakPolarHBondContact O-CB 3.5Å; E184-E187 PolarHBondContact O-N 3.49Å; E184-H188 PolarHBondContact O-CD2 2.98Å; E184-E234 HydrophobicContact CB-CB 4.43Å; E184-E234 HydrophobicContact CB-CG 3.91Å
185	A	98	Very high	97.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-42.2	175.3	0	0	0	0	0	112.5	A181 F182 E183 E187 H188 F189 F195 E234 L237 V238	A181-A185 WeakPolarHBondContact O-CB 3.37Å; A181-A185 PolarHBondContact O-N 3.15Å; F182-A185 PolarHBondContact O-N 3.34Å; E183-A185 VanDerWaalsContact C-N 3.33Å; E183-A185 PolarHBondContact O-N 2.82Å; A185-E187 PolarHBondContact O-N 3.47Å; A185-H188 WeakPolarHBondContact O-CB 3.42Å; A185-H188 PolarHBondContact O-N 2.88Å; A185-H188 VanDerWaalsContact O-N 3.1Å; A185-F189 VanDerWaalsContact O-CD2 3.27Å; A185-F189 WeakPolarHBondContact O-CD2 3.28Å; A185-F195 HydrophobicContact CB-CE1 4.48Å; A185-E234 HydrophobicContact CB-CG 4.39Å; A185-L237 HydrophobicContact CB-CB 3.72Å; A185-L237 HydrophobicContact CB-CD1 3.96Å; A185-V238 HydrophobicContact CB-CG2 3.99Å
186	A	98.1	Very high	97.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-34	178.3	0	0	0	0	0	112.5	P145 V146 F182 E183 H188 F189 Q190 F195	P145-A186 HydrophobicContact CB-CB 3.91Å; P145-A186 WeakPolarHBondContact O-CB 3.49Å; V146-A186 HydrophobicContact CG2-CB 3.68Å; F182-A186 WeakPolarHBondContact O-CB 3.27Å; F182-A186 PolarHBondContact O-N 3.29Å; E183-A186 WeakPolarHBondContact O-CB 3.48Å; E183-A186 PolarHBondContact O-N 3.3Å; A186-H188 PolarHBondContact O-N 3.23Å; A186-H188 VanDerWaalsContact O-N 3.17Å; A186-F189 PolarHBondContact O-N 3.44Å; A186-Q190 PolarHBondContact O-N 2.99Å; A186-F195 HydrophobicContact CB-CB 3.63Å; A186-F195 HydrophobicContact CB-CD1 3.46Å; A186-F195 VanDerWaalsContact CB-CD1 3.46Å; A186-F195 HydrophobicContact CB-CD2 3.86Å; A186-F195 HydrophobicContact CB-CE1 4.03Å; A186-F195 HydrophobicContact CB-CE2 4.37Å; A186-F195 HydrophobicContact CB-CG 3.38Å; A186-F195 HydrophobicContact CB-CZ 4.46Å
187	E	96.4	Very high	97.4	Very high	58 Å²	58	37 Å²	37	27%	0.271	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.6	176.7	-70.1	-160.5	134.5	0	0	114.5	R121 P145 E183 E184 A185 F189	R121-E187 VanDerWaalsContact CZ-CB 3.48Å; R121-E187 IonicContact CZ-OE1 2.71Å; R121-E187 IonicContact NE-OE1 3.05Å; R121-E187 IonicContact NE-OE2 2.75Å; R121-E187 PolarHBondContact NH1-O 2.76Å; R121-E187 VanDerWaalsContact NH2-CD 3.3Å; R121-E187 IonicContact NH2-OE1 3.6Å; R121-E187 PolarHBondContact NH2-OE1 3.32Å; P145-E187 HydrophobicContact CB-CG 3.97Å; P145-E187 HydrophobicContact CG-CG 3.94Å; E183-E187 WeakPolarHBondContact O-CG 3.43Å; E183-E187 PolarHBondContact O-N 3.28Å; E184-E187 WeakPolarHBondContact O-CB 3.5Å; E184-E187 PolarHBondContact O-N 3.49Å; A185-E187 PolarHBondContact O-N 3.47Å; E187-F189 VanDerWaalsContact C-N 3.3Å
188	H	96.3	Very high	97.5	Very high	100 Å²	100	29.4 Å²	29.4	46%	0.463	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.8	176.5	-69.6	-99.2	0	0	0	113.3	E184 A185 A186 E234 V238	E184-H188 PolarHBondContact O-CD2 2.98Å; A185-H188 WeakPolarHBondContact O-CB 3.42Å; A185-H188 PolarHBondContact O-N 2.88Å; A185-H188 VanDerWaalsContact O-N 3.1Å; A186-H188 PolarHBondContact O-N 3.23Å; A186-H188 VanDerWaalsContact O-N 3.17Å; H188-E234 IonicContact CD2-OE1 3.7Å; H188-E234 IonicContact CE1-OE1 3.15Å; H188-E234 IonicContact NE2-OE1 2.83Å; H188-E234 PolarHBondContact NE2-OE1 2.86Å; H188-V238 HydrophobicContact CB-CG2 4.28Å
189	F	96.3	Very high	97.5	Very high	17 Å²	17	29.1 Å²	29.1	8%	0.075	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-0.3	-171.4	-53	-76	0	0	0	113.7	A185 A186 E187 Y192 I193 F195 V238 V241 K242	A185-F189 VanDerWaalsContact O-CD2 3.27Å; A185-F189 WeakPolarHBondContact O-CD2 3.28Å; A186-F189 PolarHBondContact O-N 3.44Å; E187-F189 VanDerWaalsContact C-N 3.3Å; F189-Y192 PolarHBondContact O-N 2.86Å; F189-I193 HydrophobicContact CB-CB 3.78Å; F189-I193 HydrophobicContact CB-CD1 4.13Å; F189-I193 HydrophobicContact CB-CG1 4.13Å; F189-I193 HydrophobicContact CD1-CD1 3.86Å; F189-I193 HydrophobicContact CG-CD1 4.11Å; F189-I193 PolarHBondContact O-N 3.1Å; F189-I193 VanDerWaalsContact O-N 3.1Å; F189-F195 HydrophobicContact CB-CE2 4.11Å; F189-F195 AromaticContact CD2-CE2 3.78Å; F189-F195 HydrophobicContact CD2-CE2 3.78Å; F189-F195 AromaticContact CD2-CZ 3.65Å; F189-F195 HydrophobicContact CD2-CZ 3.65Å; F189-F195 HydrophobicContact CE2-CZ 4.17Å; F189-F195 HydrophobicContact CG-CE2 4.29Å; F189-V238 HydrophobicContact CE2-CB 4.35Å; F189-V238 HydrophobicContact CE2-CG1 4.45Å; F189-V238 HydrophobicContact CE2-CG2 4.01Å; F189-V238 HydrophobicContact CZ-CB 4.26Å; F189-V238 HydrophobicContact CZ-CG1 3.98Å; F189-V238 HydrophobicContact CZ-CG2 4.36Å; F189-V241 HydrophobicContact CD1-CG1 3.9Å; F189-V241 HydrophobicContact CD2-CG1 4.17Å; F189-V241 HydrophobicContact CE1-CB 4.1Å; F189-V241 HydrophobicContact CE1-CG1 3.54Å; F189-V241 HydrophobicContact CE2-CB 3.85Å; F189-V241 HydrophobicContact CE2-CG1 3.83Å; F189-V241 HydrophobicContact CE2-CG2 4.28Å; F189-V241 HydrophobicContact CG-CG1 4.2Å; F189-V241 HydrophobicContact CZ-CB 3.56Å; F189-V241 HydrophobicContact CZ-CG1 3.5Å; F189-V241 HydrophobicContact CZ-CG2 4.47Å; F189-K242 HydrophobicContact CE1-CG 4.06Å; F189-K242 HydrophobicContact CZ-CG 4.24Å
190	Q	94.1	Very high	97.4	Very high	12 Å²	12	32 Å²	32	6%	0.056	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	141.9	173.8	-73.1	-165	-70.5	0	0	111.6	R121 L141 E143 P145 A186	R121-Q190 VanDerWaalsContact NH2-OE1 3.17Å; L141-Q190 HydrophobicContact CD1-CB 3.73Å; E143-Q190 PolarHBondContact O-NE2 2.63Å; P145-Q190 VanDerWaalsContact CA-CD 3.44Å; P145-Q190 VanDerWaalsContact CB-CD 3.47Å; P145-Q190 HydrophobicContact CB-CG 3.83Å; A186-Q190 PolarHBondContact O-N 2.99Å
191	P	95	Very high	97.3	Very high	12 Å²	12	35 Å²	35	8%	0.078	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.2	4.9	-10	36.1	-32.9	0	0	0	114.2	F137 D140 L141 K194	F137-P191 HydrophobicContact CD2-CG 3.49Å; F137-P191 VanDerWaalsContact CD2-CG 3.49Å; F137-P191 HydrophobicContact CE2-CG 3.25Å; F137-P191 HydrophobicContact CG-CG 4.33Å; F137-P191 HydrophobicContact CZ-CG 3.94Å; D140-P191 HydrophobicContact CB-CB 3.75Å; D140-P191 HydrophobicContact CB-CG 4.4Å; L141-P191 HydrophobicContact CB-CB 4.45Å; L141-P191 HydrophobicContact CB-CG 4.24Å; P191-K194 PolarHBondContact O-NZ 3.1Å
192	Y	95.4	Very high	97.2	Very high	31 Å²	31	36.4 Å²	36.4	12%	0.122	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-34.7	-168.7	-54.2	-71.7	0	0	0	114.8	E124 F137 F189 D256	E124-Y192 PolarHBondContact O-OH 3.43Å; F137-Y192 HydrophobicContact CD2-CE1 4.29Å; F137-Y192 HydrophobicContact CE2-CD1 4.44Å; F137-Y192 AromaticContact CE2-CE1 3.63Å; F137-Y192 HydrophobicContact CE2-CE1 3.63Å; F137-Y192 HydrophobicContact CE2-CE2 4.09Å; F137-Y192 AromaticContact CE2-CZ 3.44Å; F137-Y192 VanDerWaalsContact CE2-CZ 3.44Å; F137-Y192 WeakPolarHBondContact CE2-OH 3.33Å; F137-Y192 HydrophobicContact CZ-CE2 4.41Å; F137-Y192 AromaticContact CZ-CZ 3.99Å; F189-Y192 PolarHBondContact O-N 2.86Å; Y192-D256 HydrophobicContact CD1-CB 4.01Å; Y192-D256 HydrophobicContact CE1-CB 3.91Å
193	I	97.7	Very high	97.1	Very high	10 Å²	10	36.7 Å²	36.7	5%	0.051	18%	0.181	C	C	.	.	S	Bend	trans	-115	126.2	177.8	-57.4	-178.9	0	0	0	109.1	I165 L167 F189 F195 V241	I165-I193 HydrophobicContact CB-CG1 4.3Å; I165-I193 HydrophobicContact CB-CG2 4.04Å; I165-I193 HydrophobicContact CD1-CD1 4.23Å; I165-I193 HydrophobicContact CG2-CD1 4.37Å; I165-I193 HydrophobicContact CG2-CG1 4.49Å; I165-I193 HydrophobicContact CG2-CG2 3.65Å; L167-I193 HydrophobicContact CD1-CG2 3.5Å; L167-I193 VanDerWaalsContact CD1-CG2 3.5Å; F189-I193 HydrophobicContact CB-CB 3.78Å; F189-I193 HydrophobicContact CB-CD1 4.13Å; F189-I193 HydrophobicContact CB-CG1 4.13Å; F189-I193 HydrophobicContact CD1-CD1 3.86Å; F189-I193 HydrophobicContact CG-CD1 4.11Å; F189-I193 PolarHBondContact O-N 3.1Å; F189-I193 VanDerWaalsContact O-N 3.1Å; I193-F195 HydrophobicContact CB-CE2 4.16Å; I193-F195 HydrophobicContact CG2-CD2 4.09Å; I193-F195 HydrophobicContact CG2-CE2 3.67Å; I193-V241 HydrophobicContact CD1-CG1 3.4Å
194	K	97.9	Very high	97	Very high	39 Å²	39	33.6 Å²	33.6	17%	0.17	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.3	-175.3	-53.7	-59.8	-174.9	-171	0	111	D140 E164 I165 K166 L167 P191 F196	D140-K194 IonicContact OD2-NZ 3.24Å; D140-K194 PolarHBondContact OD2-NZ 3.21Å; D140-K194 VanDerWaalsContact OD2-NZ 3.13Å; E164-K194 WeakPolarHBondContact OE2-CE 3.5Å; E164-K194 VanDerWaalsContact OE2-CG 3.29Å; E164-K194 WeakPolarHBondContact OE2-CG 3.41Å; I165-K194 PolarHBondContact O-N 3.09Å; K166-K194 CarbonylContact C-O 3.58Å; K166-K194 VanDerWaalsContact CA-O 3.27Å; K166-K194 WeakPolarHBondContact CA-O 3.45Å; K166-K194 HydrophobicContact CB-CB 4.4Å; L167-K194 PolarHBondContact N-O 2.94Å; P191-K194 PolarHBondContact O-NZ 3.1Å; K194-F196 HydrophobicContact CB-CD2 4.42Å; K194-F196 HydrophobicContact CB-CE2 3.57Å; K194-F196 HydrophobicContact CB-CZ 4.09Å
195	F	98.7	Very high	97	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.2	176.4	-79.1	-121.1	0	0	0	110.1	V146 E147 L167 F182 A185 A186 F189 I193 V241	V146-F195 CarbonylContact C-O 3.59Å; V146-F195 WeakPolarHBondContact CA-O 3.35Å; V146-F195 HydrophobicContact CG2-CB 4.11Å; E147-F195 PolarHBondContact N-O 2.71Å; L167-F195 HydrophobicContact CB-CD1 4.23Å; L167-F195 HydrophobicContact CB-CE1 4.37Å; L167-F195 HydrophobicContact CB-CG 4.38Å; L167-F195 HydrophobicContact CD1-CD2 4.21Å; L167-F195 HydrophobicContact CD1-CE1 4.32Å; L167-F195 HydrophobicContact CD1-CE2 3.75Å; L167-F195 HydrophobicContact CD1-CZ 3.81Å; L167-F195 HydrophobicContact CD2-CE1 3.97Å; L167-F195 HydrophobicContact CD2-CZ 4.06Å; L167-F195 HydrophobicContact CG-CE1 4.46Å; L167-F195 HydrophobicContact CG-CZ 4.4Å; F182-F195 HydrophobicContact CD1-CD1 4.36Å; F182-F195 HydrophobicContact CD2-CD1 4.11Å; F182-F195 HydrophobicContact CD2-CE1 4.33Å; F182-F195 HydrophobicContact CE1-CB 4.08Å; F182-F195 AromaticContact CE1-CD1 3.82Å; F182-F195 HydrophobicContact CE1-CD1 3.82Å; F182-F195 HydrophobicContact CE1-CG 4.45Å; F182-F195 AromaticContact CE2-CD1 3.52Å; F182-F195 HydrophobicContact CE2-CD1 3.52Å; F182-F195 AromaticContact CE2-CE1 3.9Å; F182-F195 HydrophobicContact CE2-CE1 3.9Å; F182-F195 HydrophobicContact CZ-CB 4.07Å; F182-F195 AromaticContact CZ-CD1 3.37Å; F182-F195 HydrophobicContact CZ-CD1 3.37Å; F182-F195 HydrophobicContact CZ-CE1 4.22Å; F182-F195 HydrophobicContact CZ-CG 4.11Å; A185-F195 HydrophobicContact CB-CE1 4.48Å; A186-F195 HydrophobicContact CB-CB 3.63Å; A186-F195 HydrophobicContact CB-CD1 3.46Å; A186-F195 VanDerWaalsContact CB-CD1 3.46Å; A186-F195 HydrophobicContact CB-CD2 3.86Å; A186-F195 HydrophobicContact CB-CE1 4.03Å; A186-F195 HydrophobicContact CB-CE2 4.37Å; A186-F195 HydrophobicContact CB-CG 3.38Å; A186-F195 HydrophobicContact CB-CZ 4.46Å; F189-F195 HydrophobicContact CB-CE2 4.11Å; F189-F195 AromaticContact CD2-CE2 3.78Å; F189-F195 HydrophobicContact CD2-CE2 3.78Å; F189-F195 AromaticContact CD2-CZ 3.65Å; F189-F195 HydrophobicContact CD2-CZ 3.65Å; F189-F195 HydrophobicContact CE2-CZ 4.17Å; F189-F195 HydrophobicContact CG-CE2 4.29Å; I193-F195 HydrophobicContact CB-CE2 4.16Å; I193-F195 HydrophobicContact CG2-CD2 4.09Å; I193-F195 HydrophobicContact CG2-CE2 3.67Å; F195-V241 HydrophobicContact CZ-CG2 4.26Å
196	F	98.7	Very high	96.9	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.6	177.4	-62.2	-90	0	0	0	110.6	E147 I149 F158 I161 K166 L167 I168 G169 F182 K194	E147-F196 HydrophobicContact CB-CD1 3.58Å; E147-F196 HydrophobicContact CB-CE1 3.72Å; E147-F196 HydrophobicContact CG-CE1 4.27Å; E147-F196 CarbonylContact O-C 3.54Å; E147-F196 VanDerWaalsContact O-CA 3.26Å; E147-F196 WeakPolarHBondContact O-CA 3.46Å; I149-F196 HydrophobicContact CD1-CB 4.14Å; I149-F196 HydrophobicContact CD1-CD1 3.85Å; I149-F196 HydrophobicContact CD1-CG 4.2Å; I149-F196 HydrophobicContact CG1-CB 4.42Å; I149-F196 HydrophobicContact CG1-CD1 3.98Å; F158-F196 HydrophobicContact CD2-CB 4.29Å; F158-F196 HydrophobicContact CD2-CD1 4.16Å; F158-F196 AromaticContact CD2-CD2 3.52Å; F158-F196 HydrophobicContact CD2-CD2 3.52Å; F158-F196 HydrophobicContact CD2-CE1 4.42Å; F158-F196 AromaticContact CD2-CE2 3.8Å; F158-F196 HydrophobicContact CD2-CE2 3.8Å; F158-F196 AromaticContact CD2-CG 3.71Å; F158-F196 HydrophobicContact CD2-CG 3.71Å; F158-F196 HydrophobicContact CD2-CZ 4.26Å; F158-F196 HydrophobicContact CE2-CB 4.36Å; F158-F196 AromaticContact CE2-CD2 3.6Å; F158-F196 HydrophobicContact CE2-CD2 3.6Å; F158-F196 HydrophobicContact CE2-CE2 4.12Å; F158-F196 HydrophobicContact CE2-CG 4.05Å; I161-F196 HydrophobicContact CD1-CE2 4.02Å; I161-F196 HydrophobicContact CD1-CZ 3.53Å; K166-F196 HydrophobicContact CB-CD2 4.38Å; K166-F196 HydrophobicContact CB-CE2 4.11Å; L167-F196 WeakPolarHBondContact O-CB 3.19Å; L167-F196 PolarHBondContact O-N 3.38Å; I168-F196 VanDerWaalsContact CA-O 3.28Å; I168-F196 WeakPolarHBondContact CA-O 3.4Å; I168-F196 HydrophobicContact CB-CB 4.08Å; I168-F196 HydrophobicContact CD1-CB 4Å; I168-F196 HydrophobicContact CG1-CB 3.98Å; G169-F196 PolarHBondContact N-O 3.4Å; F182-F196 VanDerWaalsContact CE1-O 3.22Å; F182-F196 WeakPolarHBondContact CE1-O 3.41Å; F182-F196 WeakPolarHBondContact CZ-O 3.36Å; K194-F196 HydrophobicContact CB-CD2 4.42Å; K194-F196 HydrophobicContact CB-CE2 3.57Å; K194-F196 HydrophobicContact CB-CZ 4.09Å
197	A	98.6	Very high	96.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.9	170.5	0	0	0	0	0	111.3	V146 E147 I148 I149 G169 F171 Y179 F182	V146-A197 HydrophobicContact CG1-CB 3.6Å; E147-A197 PolarHBondContact O-N 3.24Å; I148-A197 CarbonylContact C-O 3.59Å; I148-A197 WeakPolarHBondContact CA-O 3.36Å; I148-A197 HydrophobicContact CD1-CB 3.91Å; I149-A197 PolarHBondContact N-O 2.95Å; G169-A197 CarbonylContact O-C 3.54Å; G169-A197 WeakPolarHBondContact O-CA 3.46Å; F171-A197 HydrophobicContact CD2-CB 4.03Å; F171-A197 HydrophobicContact CE2-CB 4.14Å; Y179-A197 HydrophobicContact CD2-CB 4.02Å; Y179-A197 HydrophobicContact CE2-CB 3.74Å; F182-A197 HydrophobicContact CE1-CB 4.39Å
198	T	98.5	Very high	96.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	146.8	167	-168.6	0	0	0	0	110.7	I149 G169 Y170 F171 D200 V203 A204	I149-T198 VanDerWaalsContact O-CB 3.3Å; I149-T198 WeakPolarHBondContact O-CB 3.42Å; I149-T198 PolarHBondContact O-OG1 3.1Å; G169-T198 PolarHBondContact O-N 3.47Å; Y170-T198 HydrophobicContact CD2-CG2 3.91Å; Y170-T198 WeakPolarHBondContact CD2-O 3.44Å; Y170-T198 HydrophobicContact CG-CG2 4.39Å; F171-T198 PolarHBondContact N-O 3.19Å; T198-D200 PolarHBondContact OG1-N 3.19Å; T198-D200 VanDerWaalsContact OG1-N 3.16Å; T198-V203 HydrophobicContact CG2-CB 4.3Å; T198-V203 HydrophobicContact CG2-CG1 3.96Å; T198-V203 WeakPolarHBondContact OG1-CB 3.35Å; T198-A204 HydrophobicContact CG2-CB 4.18Å
199	F	97.8	Very high	96.8	Very high	47 Å²	47	39.7 Å²	39.7	21%	0.206	21%	0.205	C	C	.	.			trans	-111.2	-4.4	167.8	-45.2	-47.7	0	0	0	111.3	I148 F171 G173 E174 Y179	I148-F199 HydrophobicContact CD1-CE2 4.04Å; I148-F199 HydrophobicContact CD1-CZ 3.88Å; I148-F199 HydrophobicContact CG1-CE2 4.37Å; I148-F199 HydrophobicContact CG2-CD2 4.06Å; I148-F199 HydrophobicContact CG2-CE2 3.86Å; F171-F199 HydrophobicContact CB-CD1 4.07Å; F171-F199 HydrophobicContact CB-CE1 4.01Å; G173-F199 VanDerWaalsContact CA-CD1 3.45Å; E174-F199 HydrophobicContact CB-CZ 4.48Å; E174-F199 HydrophobicContact CG-CE2 3.56Å; E174-F199 HydrophobicContact CG-CZ 3.64Å; Y179-F199 AromaticContact CD2-CE1 3.72Å; Y179-F199 HydrophobicContact CD2-CE1 3.72Å; Y179-F199 AromaticContact CD2-CZ 3.86Å; Y179-F199 HydrophobicContact CD2-CZ 3.86Å; Y179-F199 HydrophobicContact CE2-CE1 4.11Å; Y179-F199 AromaticContact CE2-CZ 3.8Å; Y179-F199 HydrophobicContact CE2-CZ 3.8Å; Y179-F199 HydrophobicContact CG-CE1 4.18Å; Y179-F199 HydrophobicContact CG-CZ 4.32Å
200	D	97.3	Very high	96.8	Very high	72 Å²	72	45.1 Å²	45.1	39%	0.385	23%	0.229	S	C	.	.			trans	-87	121.3	-178.4	-175	-92.4	0	0	0	111.2	T198 G202 V203 A204	T198-D200 PolarHBondContact OG1-N 3.19Å; T198-D200 VanDerWaalsContact OG1-N 3.16Å; D200-G202 PolarHBondContact O-N 2.74Å; D200-G202 WeakPolarHBondContact OD1-CA 3.48Å; D200-G202 PolarHBondContact OD1-N 2.9Å; D200-V203 HydrophobicContact CB-CB 4.19Å; D200-V203 HydrophobicContact CB-CG2 3.93Å; D200-V203 PolarHBondContact O-N 2.85Å; D200-V203 PolarHBondContact OD1-N 3.25Å; D200-A204 PolarHBondContact O-N 3.17Å
201	K	96.1	Very high	97	Very high	157 Å²	157	48.2 Å²	48.2	68%	0.683	24%	0.244	S	C	*	.	H	α-helix	trans	-63.3	-26.7	179.3	-174.7	175.3	-179.7	176.4	0	113	K205	K201-K205 VanDerWaalsContact O-CB 3.26Å; K201-K205 WeakPolarHBondContact O-CB 3.47Å; K201-K205 PolarHBondContact O-N 3.42Å; K201-K205 VanDerWaalsContact O-N 3.08Å
202	G	96.1	Very high	97.1	Very high	41 Å²	41	49.2 Å²	49.2	42%	0.423	25%	0.249	S	C	.	.	H	α-helix	trans	-73.4	-41.5	177.8	0	0	0	0	0	112.5	D200 K206	D200-G202 PolarHBondContact O-N 2.74Å; D200-G202 WeakPolarHBondContact OD1-CA 3.48Å; D200-G202 PolarHBondContact OD1-N 2.9Å; G202-K206 PolarHBondContact O-N 2.97Å
203	V	96.6	Very high	97.3	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-54.3	171.6	176.3	0	0	0	0	109.7	I149 L155 T198 D200 K205 K206 L207	I149-V203 HydrophobicContact CG2-CG1 3.86Å; I149-V203 HydrophobicContact CG2-CG2 4.46Å; L155-V203 HydrophobicContact CD1-CG1 4.39Å; L155-V203 HydrophobicContact CD2-CG1 4.45Å; T198-V203 HydrophobicContact CG2-CB 4.3Å; T198-V203 HydrophobicContact CG2-CG1 3.96Å; T198-V203 WeakPolarHBondContact OG1-CB 3.35Å; D200-V203 HydrophobicContact CB-CB 4.19Å; D200-V203 HydrophobicContact CB-CG2 3.93Å; D200-V203 PolarHBondContact O-N 2.85Å; D200-V203 PolarHBondContact OD1-N 3.25Å; V203-K205 VanDerWaalsContact C-N 3.26Å; V203-K205 PolarHBondContact O-N 2.93Å; V203-K206 WeakPolarHBondContact O-CB 3.43Å; V203-K206 PolarHBondContact O-N 2.76Å; V203-L207 HydrophobicContact CG1-CD1 3.92Å; V203-L207 PolarHBondContact O-N 2.92Å
204	A	96.8	Very high	97.3	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-55.1	-40.2	178.5	0	0	0	0	0	113	Y170 T198 D200 K206 L207 G208 L209	Y170-A204 HydrophobicContact CD1-CB 3.44Å; Y170-A204 VanDerWaalsContact CD1-CB 3.44Å; Y170-A204 HydrophobicContact CD2-CB 3.64Å; Y170-A204 HydrophobicContact CE1-CB 3.83Å; Y170-A204 HydrophobicContact CE2-CB 4.01Å; Y170-A204 HydrophobicContact CG-CB 3.37Å; T198-A204 HydrophobicContact CG2-CB 4.18Å; D200-A204 PolarHBondContact O-N 3.17Å; A204-K206 VanDerWaalsContact C-N 3.29Å; A204-K206 PolarHBondContact O-N 2.76Å; A204-L207 CarbonylContact O-C 3.52Å; A204-L207 PolarHBondContact O-N 3.48Å; A204-G208 PolarHBondContact O-N 2.85Å; A204-L209 HydrophobicContact CB-CB 4.28Å; A204-L209 PolarHBondContact O-N 3.39Å
205	K	96.5	Very high	97.3	Very high	176 Å²	176	46 Å²	46	77%	0.765	24%	0.235	S	C	*	.	H	α-helix	trans	-63.7	-33	177.1	-177.6	179.4	176.7	-170.1	0	113	K201 V203	K201-K205 VanDerWaalsContact O-CB 3.26Å; K201-K205 WeakPolarHBondContact O-CB 3.47Å; K201-K205 PolarHBondContact O-N 3.42Å; K201-K205 VanDerWaalsContact O-N 3.08Å; V203-K205 VanDerWaalsContact C-N 3.26Å; V203-K205 PolarHBondContact O-N 2.93Å
206	K	95.6	Very high	97.3	Very high	120 Å²	120	46 Å²	46	52%	0.522	24%	0.235	S	C	.	.	H	α-helix	trans	-71.6	-39.5	177.2	-77	-179.7	157.5	-155.4	0	111.6	L155 G202 V203 A204 G208	L155-K206 HydrophobicContact CD2-CB 3.96Å; L155-K206 HydrophobicContact CD2-CD 3.46Å; L155-K206 VanDerWaalsContact CD2-CD 3.46Å; L155-K206 HydrophobicContact CD2-CG 4.42Å; G202-K206 PolarHBondContact O-N 2.97Å; V203-K206 WeakPolarHBondContact O-CB 3.43Å; V203-K206 PolarHBondContact O-N 2.76Å; A204-K206 VanDerWaalsContact C-N 3.29Å; A204-K206 PolarHBondContact O-N 2.76Å; K206-G208 PolarHBondContact O-N 2.83Å
207	L	95.5	Very high	97.3	Very high	22 Å²	22	47 Å²	47	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-75.3	-9.2	176.3	-69.4	164.1	0	0	0	113.3	L155 F158 I168 V203 A204 L209	L155-L207 HydrophobicContact CD1-CD1 3.97Å; L155-L207 HydrophobicContact CD1-CD2 3.71Å; L155-L207 HydrophobicContact CD1-CG 3.86Å; F158-L207 HydrophobicContact CD1-CD2 4.4Å; F158-L207 HydrophobicContact CE1-CD2 3.97Å; I168-L207 HydrophobicContact CD1-CD1 3.41Å; I168-L207 VanDerWaalsContact CD1-CD1 3.41Å; I168-L207 HydrophobicContact CG1-CD1 4.1Å; V203-L207 HydrophobicContact CG1-CD1 3.92Å; V203-L207 PolarHBondContact O-N 2.92Å; A204-L207 CarbonylContact O-C 3.52Å; A204-L207 PolarHBondContact O-N 3.48Å; L207-L209 HydrophobicContact CB-CD1 3.91Å; L207-L209 HydrophobicContact CB-CG 3.96Å; L207-L209 HydrophobicContact CD1-CD1 3.84Å; L207-L209 PolarHBondContact O-N 3.02Å
208	G	96.3	Very high	97.3	Very high	50 Å²	50	48.6 Å²	48.6	52%	0.515	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-2.3	-175.6	0	0	0	0	0	114.9	A204 K206	A204-G208 PolarHBondContact O-N 2.85Å; K206-G208 PolarHBondContact O-N 2.83Å
209	L	97	Very high	97.3	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-66	135.6	-178.7	-69.7	169.7	0	0	0	114	I168 A204 L207 E213 D215	I168-L209 HydrophobicContact CG1-CD1 4.24Å; I168-L209 HydrophobicContact CG2-CD1 4.23Å; A204-L209 HydrophobicContact CB-CB 4.28Å; A204-L209 PolarHBondContact O-N 3.39Å; L207-L209 HydrophobicContact CB-CD1 3.91Å; L207-L209 HydrophobicContact CB-CG 3.96Å; L207-L209 HydrophobicContact CD1-CD1 3.84Å; L207-L209 PolarHBondContact O-N 3.02Å; L209-E213 HydrophobicContact CD2-CB 3.98Å; L209-E213 HydrophobicContact CD2-CG 4.08Å; L209-D215 HydrophobicContact CD2-CB 4.1Å; L209-D215 WeakPolarHBondContact CD2-OD1 3.43Å; L209-D215 WeakPolarHBondContact CD2-OD2 3.11Å
210	K	97.2	Very high	97.3	Very high	131 Å²	131	46.8 Å²	46.8	57%	0.57	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-95	165.3	165.8	-57.5	163.3	-164.2	128.2	0	110	Y170 N212 E213	Y170-K210 VanDerWaalsContact CD1-C 3.48Å; K210-N212 PolarHBondContact O-N 3.33Å; K210-E213 WeakPolarHBondContact CA-OE2 3.38Å; K210-E213 HydrophobicContact CB-CB 4.47Å; K210-E213 WeakPolarHBondContact CB-OE2 3.2Å; K210-E213 VanDerWaalsContact CG-OE2 3.32Å; K210-E213 WeakPolarHBondContact CG-OE2 3.13Å; K210-E213 PolarHBondContact N-OE2 3.45Å; K210-E213 IonicContact NZ-OE1 3.1Å; K210-E213 WeakPolarHBondContact O-CB 3.37Å; K210-E213 PolarHBondContact O-N 2.84Å
211	M	97.7	Very high	97.3	Very high	77 Å²	77	44.6 Å²	44.6	38%	0.379	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	132.4	178.5	-175.8	62.9	64.5	0	0	111.2	Y170 F171 K172 E213	Y170-M211 HydrophobicContact CD1-CB 4.49Å; Y170-M211 HydrophobicContact CE1-CB 4.31Å; Y170-M211 HydrophobicContact CE1-CE 3.75Å; Y170-M211 HydrophobicContact CE1-SD 4.44Å; Y170-M211 HydrophobicContact CE2-CE 4.11Å; Y170-M211 VanDerWaalsContact CZ-CE 3.49Å; Y170-M211 WeakPolarHBondContact OH-CE 3.37Å; F171-M211 VanDerWaalsContact C-SD 3.55Å; K172-M211 HydrophobicContact CB-CE 4.42Å; K172-M211 HydrophobicContact CB-SD 4.08Å; K172-M211 PolarHBondContact N-SD 2.87Å; K172-M211 VanDerWaalsContact N-SD 3.43Å; M211-E213 PolarHBondContact O-N 3.33Å
212	N	97.8	Very high	97	Very high	32 Å²	32	42.8 Å²	42.8	17%	0.171	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	21.3	-175.1	-46.6	-32.8	0	0	0	114.5	Y170 H178 K210 P231 Y232	Y170-N212 WeakPolarHBondContact O-CA 3.43Å; Y170-N212 PolarHBondContact O-N 3.35Å; H178-N212 PolarHBondContact CD2-ND2 2.88Å; H178-N212 PolarHBondContact CD2-OD1 2.95Å; H178-N212 PolarHBondContact NE2-ND2 2.74Å; K210-N212 PolarHBondContact O-N 3.33Å; N212-P231 HydrophobicContact CB-CB 4.49Å; N212-Y232 WeakPolarHBondContact O-CE2 3.18Å
213	E	98.3	Very high	96.9	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.065	24%	0.24	C	C	.	.			trans	-88	142.5	170.1	-158.9	153.1	-115.9	0	0	108.8	G169 Y170 L209 K210 M211 K230	G169-E213 WeakPolarHBondContact CA-O 3.4Å; Y170-E213 PolarHBondContact N-O 2.76Å; L209-E213 HydrophobicContact CD2-CB 3.98Å; L209-E213 HydrophobicContact CD2-CG 4.08Å; K210-E213 WeakPolarHBondContact CA-OE2 3.38Å; K210-E213 HydrophobicContact CB-CB 4.47Å; K210-E213 WeakPolarHBondContact CB-OE2 3.2Å; K210-E213 VanDerWaalsContact CG-OE2 3.32Å; K210-E213 WeakPolarHBondContact CG-OE2 3.13Å; K210-E213 PolarHBondContact N-OE2 3.45Å; K210-E213 IonicContact NZ-OE1 3.1Å; K210-E213 WeakPolarHBondContact O-CB 3.37Å; K210-E213 PolarHBondContact O-N 2.84Å; M211-E213 PolarHBondContact O-N 3.33Å; E213-K230 HydrophobicContact CB-CD 4.14Å; E213-K230 HydrophobicContact CG-CD 4.36Å; E213-K230 IonicContact OE1-NZ 3.35Å; E213-K230 PolarHBondContact OE1-NZ 2.96Å; E213-K230 IonicContact OE2-NZ 3.65Å; E213-K230 PolarHBondContact OE2-NZ 3.38Å
214	V	98.6	Very high	96.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.4	173.9	175.8	0	0	0	0	107.4	L167 I168 F171 F182 I227 Y232 L237	L167-V214 HydrophobicContact CB-CG1 4.41Å; L167-V214 HydrophobicContact CD2-CG1 4.05Å; I168-V214 WeakPolarHBondContact O-CA 3.27Å; F171-V214 HydrophobicContact CE1-CG2 4.43Å; F171-V214 HydrophobicContact CZ-CG2 3.87Å; F182-V214 HydrophobicContact CD2-CG1 4.26Å; F182-V214 HydrophobicContact CD2-CG2 3.79Å; F182-V214 HydrophobicContact CE2-CB 4.46Å; F182-V214 HydrophobicContact CE2-CG1 3.62Å; F182-V214 HydrophobicContact CE2-CG2 3.89Å; V214-I227 HydrophobicContact CB-CD1 4.12Å; V214-I227 HydrophobicContact CG1-CD1 3.66Å; V214-I227 HydrophobicContact CG1-CG1 4.36Å; V214-I227 PolarHBondContact O-N 2.9Å; V214-I227 VanDerWaalsContact O-N 3.08Å; V214-Y232 HydrophobicContact CB-CD2 4.44Å; V214-Y232 HydrophobicContact CB-CE2 3.78Å; V214-Y232 HydrophobicContact CG2-CD2 3.94Å; V214-Y232 HydrophobicContact CG2-CE2 3.59Å; V214-Y232 PolarHBondContact N-OH 3.32Å; V214-L237 HydrophobicContact CB-CD2 4.49Å; V214-L237 HydrophobicContact CG1-CD2 4.42Å; V214-L237 HydrophobicContact CG2-CD2 4.4Å
215	D	98.5	Very high	96.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136	173.7	-73.7	3.3	0	0	0	108.8	L167 I168 L209 Y217 P224 H226	L167-D215 CarbonylContact C-O 3.49Å; L167-D215 VanDerWaalsContact CA-O 3.28Å; L167-D215 WeakPolarHBondContact CA-O 3.49Å; I168-D215 HydrophobicContact CG2-CB 4.09Å; I168-D215 PolarHBondContact N-O 3.08Å; I168-D215 PolarHBondContact O-N 2.9Å; L209-D215 HydrophobicContact CD2-CB 4.1Å; L209-D215 WeakPolarHBondContact CD2-OD1 3.43Å; L209-D215 WeakPolarHBondContact CD2-OD2 3.11Å; D215-Y217 HydrophobicContact CB-CD2 4.38Å; D215-Y217 HydrophobicContact CB-CE2 3.72Å; D215-P224 HydrophobicContact CB-CB 3.79Å; D215-P224 HydrophobicContact CB-CG 4.21Å; D215-H226 IonicContact OD1-CE1 3.34Å; D215-H226 PolarHBondContact OD1-CE1 3.04Å; D215-H226 IonicContact OD1-CG 3.89Å; D215-H226 IonicContact OD1-ND1 2.97Å; D215-H226 PolarHBondContact OD1-ND1 3.16Å; D215-H226 IonicContact OD2-CE1 2.71Å; D215-H226 IonicContact OD2-ND1 2.78Å
216	F	98.6	Very high	96.9	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.1	171.8	176.4	-85	0	0	0	108.5	I165 L167 E218 P224 V225 I227 F240 V241 H244	I165-F216 HydrophobicContact CD1-CZ 4.39Å; I165-F216 HydrophobicContact CG1-CZ 4.35Å; I165-F216 HydrophobicContact CG2-CD2 4.09Å; I165-F216 HydrophobicContact CG2-CE1 4.39Å; I165-F216 HydrophobicContact CG2-CE2 3.28Å; I165-F216 HydrophobicContact CG2-CZ 3.47Å; I165-F216 VanDerWaalsContact CG2-CZ 3.47Å; L167-F216 HydrophobicContact CD1-CD2 3.92Å; L167-F216 HydrophobicContact CD1-CE2 4.31Å; L167-F216 HydrophobicContact CD2-CD2 4.12Å; L167-F216 HydrophobicContact CG-CB 4.48Å; L167-F216 HydrophobicContact CG-CD2 3.89Å; F216-E218 HydrophobicContact CE1-CB 4.05Å; F216-P224 CarbonylContact O-C 3.59Å; F216-P224 VanDerWaalsContact O-CA 3.28Å; F216-P224 WeakPolarHBondContact O-CA 3.38Å; F216-P224 WeakPolarHBondContact O-CB 3.35Å; F216-V225 PolarHBondContact N-O 3.38Å; F216-V225 PolarHBondContact O-N 3.06Å; F216-I227 HydrophobicContact CB-CG1 4.39Å; F216-F240 HydrophobicContact CB-CE1 3.76Å; F216-F240 HydrophobicContact CD1-CE1 4.38Å; F216-F240 HydrophobicContact CD2-CD1 4.41Å; F216-F240 HydrophobicContact CD2-CE1 4.11Å; F216-F240 AromaticContact CG-CE1 3.85Å; F216-F240 HydrophobicContact CG-CE1 3.85Å; F216-V241 HydrophobicContact CD2-CG2 4.33Å; F216-V241 HydrophobicContact CE2-CG2 4.38Å; F216-H244 HydrophobicContact CE1-CB 3.96Å; F216-H244 HydrophobicContact CE2-CB 4.37Å; F216-H244 HydrophobicContact CZ-CB 3.8Å; F216-H244 WeakPolarHBondContact CZ-O 3.48Å
217	Y	98.4	Very high	97	Very high	29 Å²	29	43.6 Å²	43.6	11%	0.114	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.3	174.5	-67.9	-105	0	0	0	107.5	F158 I165 K166 I168 D215 P224	F158-Y217 HydrophobicContact CE1-CE2 4.24Å; F158-Y217 AromaticContact CZ-CD2 3.99Å; F158-Y217 HydrophobicContact CZ-CD2 3.99Å; F158-Y217 AromaticContact CZ-CE2 3.76Å; F158-Y217 HydrophobicContact CZ-CE2 3.76Å; I165-Y217 WeakPolarHBondContact CA-O 3.48Å; K166-Y217 HydrophobicContact CG-CD2 4.3Å; K166-Y217 HydrophobicContact CG-CG 4.14Å; K166-Y217 PolarHBondContact N-O 3.05Å; K166-Y217 VanDerWaalsContact N-O 3.16Å; K166-Y217 WeakPolarHBondContact O-CB 3.47Å; K166-Y217 PolarHBondContact O-N 3.04Å; I168-Y217 HydrophobicContact CG2-CD2 4.41Å; I168-Y217 HydrophobicContact CG2-CE2 3.69Å; D215-Y217 HydrophobicContact CB-CD2 4.38Å; D215-Y217 HydrophobicContact CB-CE2 3.72Å; Y217-P224 HydrophobicContact CD1-CB 3.98Å; Y217-P224 HydrophobicContact CD2-CB 3.89Å; Y217-P224 HydrophobicContact CE1-CB 3.74Å; Y217-P224 HydrophobicContact CE1-CG 3.92Å; Y217-P224 HydrophobicContact CE2-CB 3.58Å; Y217-P224 HydrophobicContact CE2-CG 4.12Å; Y217-P224 HydrophobicContact CG-CB 4.05Å
218	E	98.3	Very high	96.9	Very high	33 Å²	33	46.1 Å²	46.1	15%	0.154	25%	0.246	C	C	.	.			trans	-71.3	144.4	165.7	-174.3	-179.3	155.5	0	0	109.4	F216 F220 M221 A247 T248 T296	F216-E218 HydrophobicContact CE1-CB 4.05Å; E218-F220 PolarHBondContact O-N 2.78Å; E218-M221 HydrophobicContact CB-CB 4.33Å; E218-M221 HydrophobicContact CB-CG 3.75Å; E218-M221 HydrophobicContact CG-CG 4.04Å; E218-M221 PolarHBondContact O-N 2.79Å; E218-M221 WeakPolarHBondContact OE1-CE 3.44Å; E218-A247 HydrophobicContact CG-CB 3.67Å; E218-A247 WeakPolarHBondContact OE1-CA 3.22Å; E218-T248 PolarHBondContact OE1-N 2.97Å; E218-T248 PolarHBondContact OE1-OG1 3.37Å; E218-T296 PolarHBondContact OE2-OG1 2.88Å
219	P	98.1	Very high	96.6	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.039	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	138.6	173.2	-28.9	31.2	0	0	0	112.4	D162 I165 M221 A247	D162-P219 CarbonylContact O-C 3.57Å; D162-P219 VanDerWaalsContact O-CA 3.29Å; D162-P219 WeakPolarHBondContact O-CA 3.24Å; I165-P219 VanDerWaalsContact CG1-CD 3.45Å; I165-P219 HydrophobicContact CG1-CG 3.87Å; P219-M221 PolarHBondContact O-N 3.04Å; P219-A247 HydrophobicContact CB-CB 4.45Å; P219-A247 HydrophobicContact CG-CB 3.98Å
220	F	97.7	Very high	96.1	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.018	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	2.5	175.2	-48.2	-69.3	0	0	0	116	D162 E163 E218 L249 K251 K289 R293 W305	D162-F220 PolarHBondContact O-N 2.9Å; E163-F220 HydrophobicContact CB-CE1 4.19Å; E163-F220 HydrophobicContact CB-CZ 3.97Å; E163-F220 HydrophobicContact CG-CE1 3.92Å; E163-F220 HydrophobicContact CG-CZ 4.11Å; E218-F220 PolarHBondContact O-N 2.78Å; F220-L249 HydrophobicContact CB-CD2 4.26Å; F220-L249 HydrophobicContact CD2-CB 3.86Å; F220-L249 HydrophobicContact CD2-CD2 3.64Å; F220-L249 HydrophobicContact CD2-CG 3.6Å; F220-L249 WeakPolarHBondContact CD2-O 3.28Å; F220-L249 HydrophobicContact CE2-CB 4.44Å; F220-L249 HydrophobicContact CE2-CD2 4.09Å; F220-L249 HydrophobicContact CE2-CG 3.83Å; F220-L249 HydrophobicContact CG-CD2 3.9Å; F220-L249 HydrophobicContact CG-CG 4.36Å; F220-K251 HydrophobicContact CZ-CB 4.49Å; F220-K289 HydrophobicContact CB-CD 4.41Å; F220-K289 HydrophobicContact CB-CG 4.05Å; F220-K289 HydrophobicContact CD1-CD 3.88Å; F220-K289 HydrophobicContact CD1-CG 4.01Å; F220-K289 HydrophobicContact CG-CD 4.48Å; F220-K289 HydrophobicContact CG-CG 4.19Å; F220-R293 PolarHBondContact O-NE 2.8Å; F220-R293 PolarHBondContact O-NH2 2.83Å; F220-R293 VanDerWaalsContact O-NH2 3.09Å; F220-W305 HydrophobicContact CE1-CE3 4.3Å; F220-W305 HydrophobicContact CE1-CZ3 4.02Å; F220-W305 HydrophobicContact CE2-CE3 4.48Å; F220-W305 AromaticContact CZ-CE3 3.69Å; F220-W305 HydrophobicContact CZ-CE3 3.69Å; F220-W305 AromaticContact CZ-CZ3 3.75Å; F220-W305 HydrophobicContact CZ-CZ3 3.75Å
221	M	96.9	Very high	95.7	Very high	25 Å²	25	50.9 Å²	50.9	12%	0.123	27%	0.266	C	S	.	.			trans	-89.7	135	176.7	-56.1	-52.4	165.3	0	0	112	E218 P219 A292 R293	E218-M221 HydrophobicContact CB-CB 4.33Å; E218-M221 HydrophobicContact CB-CG 3.75Å; E218-M221 HydrophobicContact CG-CG 4.04Å; E218-M221 PolarHBondContact O-N 2.79Å; E218-M221 WeakPolarHBondContact OE1-CE 3.44Å; P219-M221 PolarHBondContact O-N 3.04Å; M221-A292 HydrophobicContact CE-CB 4.24Å; M221-R293 HydrophobicContact SD-CB 4.31Å; M221-R293 HydrophobicContact SD-CG 3.65Å
222	D	90.9	Very high	95.6	Very high	120 Å²	120	48 Å²	48	64%	0.642	25%	0.251	S	S	*	.	S	Bend	trans	-74.7	-33.6	-178.7	-71.2	-31.3	0	0	0	112.9	R293	D222-R293 IonicContact OD1-CZ 2.89Å; D222-R293 IonicContact OD1-NH2 3.13Å; D222-R293 IonicContact OD2-NE 2.78Å
223	E	93.8	Very high	95.5	Very high	159 Å²	159	49.2 Å²	49.2	74%	0.743	26%	0.26	S	S	*	.	S	Bend	trans	-114	136.5	-173.8	-66.7	-71.8	159.4	0	0	110.5
224	P	96.9	Very high	95.5	Very high	26 Å²	26	50.9 Å²	50.9	17%	0.169	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-78.5	161	177.7	31.6	-35	0	0	0	113	D215 F216 Y217	D215-P224 HydrophobicContact CB-CB 3.79Å; D215-P224 HydrophobicContact CB-CG 4.21Å; F216-P224 CarbonylContact O-C 3.59Å; F216-P224 VanDerWaalsContact O-CA 3.28Å; F216-P224 WeakPolarHBondContact O-CA 3.38Å; F216-P224 WeakPolarHBondContact O-CB 3.35Å; Y217-P224 HydrophobicContact CD1-CB 3.98Å; Y217-P224 HydrophobicContact CD2-CB 3.89Å; Y217-P224 HydrophobicContact CE1-CB 3.74Å; Y217-P224 HydrophobicContact CE1-CG 3.92Å; Y217-P224 HydrophobicContact CE2-CB 3.58Å; Y217-P224 HydrophobicContact CE2-CG 4.12Å; Y217-P224 HydrophobicContact CG-CB 4.05Å
225	V	96.9	Very high	95.4	Very high	66 Å²	66	56.7 Å²	56.7	40%	0.4	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	120	162.5	-175.5	0	0	0	0	109.3	F216 I227 F240	F216-V225 PolarHBondContact N-O 3.38Å; F216-V225 PolarHBondContact O-N 3.06Å; V225-I227 PolarHBondContact O-N 3.25Å; V225-F240 HydrophobicContact CG1-CZ 3.9Å
226	H	96.6	Very high	95.4	Very high	100 Å²	100	61 Å²	61	46%	0.463	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	119.8	170.5	-63.3	-50.3	0	0	0	109.8	D215	D215-H226 IonicContact OD1-CE1 3.34Å; D215-H226 PolarHBondContact OD1-CE1 3.04Å; D215-H226 IonicContact OD1-CG 3.89Å; D215-H226 IonicContact OD1-ND1 2.97Å; D215-H226 PolarHBondContact OD1-ND1 3.16Å; D215-H226 IonicContact OD2-CE1 2.71Å; D215-H226 IonicContact OD2-ND1 2.78Å
227	I	96.9	Very high	95.4	Very high	9 Å²	9	61 Å²	61	5%	0.046	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-63.8	125	177.8	-56.4	-174	0	0	0	109.1	L167 V214 F216 V225 Y232 L237 F240	L167-I227 HydrophobicContact CD2-CD1 4.03Å; V214-I227 HydrophobicContact CB-CD1 4.12Å; V214-I227 HydrophobicContact CG1-CD1 3.66Å; V214-I227 HydrophobicContact CG1-CG1 4.36Å; V214-I227 PolarHBondContact O-N 2.9Å; V214-I227 VanDerWaalsContact O-N 3.08Å; F216-I227 HydrophobicContact CB-CG1 4.39Å; V225-I227 PolarHBondContact O-N 3.25Å; I227-Y232 HydrophobicContact CB-CE1 3.78Å; I227-Y232 HydrophobicContact CG2-CD1 3.87Å; I227-Y232 HydrophobicContact CG2-CE1 3.5Å; I227-Y232 VanDerWaalsContact CG2-CE1 3.5Å; I227-Y232 WeakPolarHBondContact O-CE1 3.41Å; I227-Y232 PolarHBondContact O-OH 3.18Å; I227-L237 HydrophobicContact CD1-CD2 3.74Å; I227-F240 HydrophobicContact CD1-CD1 3.7Å; I227-F240 HydrophobicContact CD1-CE1 4.1Å; I227-F240 HydrophobicContact CD1-CG 4.17Å; I227-F240 HydrophobicContact CG1-CD1 3.78Å; I227-F240 HydrophobicContact CG1-CD2 4.47Å; I227-F240 HydrophobicContact CG1-CE1 3.73Å; I227-F240 HydrophobicContact CG1-CE2 4.41Å; I227-F240 HydrophobicContact CG1-CG 4.17Å; I227-F240 HydrophobicContact CG1-CZ 4.05Å; I227-F240 HydrophobicContact CG2-CB 4.36Å; I227-F240 HydrophobicContact CG2-CD1 4.43Å; I227-F240 HydrophobicContact CG2-CD2 3.91Å; I227-F240 HydrophobicContact CG2-CE2 4.34Å; I227-F240 HydrophobicContact CG2-CG 3.96Å
228	P	92.8	Very high	95.4	Very high	75 Å²	75	60.2 Å²	60.2	49%	0.487	31%	0.313	S	S	.	.	S	Bend	trans	-71.7	164.3	-173.9	29.4	-35.3	0	0	0	113	K230 Y232	P228-K230 PolarHBondContact O-N 3.29Å; P228-Y232 VanDerWaalsContact O-CE1 3.25Å; P228-Y232 WeakPolarHBondContact O-CE1 3.43Å
229	D	91.4	Very high	95.4	Very high	149 Å²	149	65.2 Å²	65.2	80%	0.797	34%	0.337	S	S	*	.	S	Bend	trans	64.6	29.8	167.3	-60.5	-39.9	0	0	0	118.3
230	K	86.7	Confident	95.4	Very high	73 Å²	73	65.8 Å²	65.8	32%	0.317	34%	0.338	S	S	.	.	S	Bend	trans	-54.4	150.4	174.8	79.2	-174.3	175	-166.3	0	115.3	E213 P228 Y232	E213-K230 HydrophobicContact CB-CD 4.14Å; E213-K230 HydrophobicContact CG-CD 4.36Å; E213-K230 IonicContact OE1-NZ 3.35Å; E213-K230 PolarHBondContact OE1-NZ 2.96Å; E213-K230 IonicContact OE2-NZ 3.65Å; E213-K230 PolarHBondContact OE2-NZ 3.38Å; P228-K230 PolarHBondContact O-N 3.29Å; K230-Y232 HydrophobicContact CB-CD1 4.3Å; K230-Y232 HydrophobicContact CB-CE1 3.65Å; K230-Y232 HydrophobicContact CB-CE2 3.87Å; K230-Y232 VanDerWaalsContact CB-CZ 3.42Å
231	P	88	Confident	95.4	Very high	70 Å²	70	65.6 Å²	65.6	46%	0.455	34%	0.338	S	S	.	.	S	Bend	cis	-80.6	151.3	0.4	33.1	-34.1	0	0	0	113.1	H178 N212	H178-P231 WeakPolarHBondContact CE1-CB 3.4Å; H178-P231 WeakPolarHBondContact ND1-CB 3.43Å; N212-P231 HydrophobicContact CB-CB 4.49Å
232	Y	94.8	Very high	95.4	Very high	15 Å²	15	70.5 Å²	70.5	6%	0.059	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-93.3	150.9	-171.6	-33.7	-78.1	0	0	0	113.1	N212 V214 I227 P228 K230 E236 L237	N212-Y232 WeakPolarHBondContact O-CE2 3.18Å; V214-Y232 HydrophobicContact CB-CD2 4.44Å; V214-Y232 HydrophobicContact CB-CE2 3.78Å; V214-Y232 HydrophobicContact CG2-CD2 3.94Å; V214-Y232 HydrophobicContact CG2-CE2 3.59Å; V214-Y232 PolarHBondContact N-OH 3.32Å; I227-Y232 HydrophobicContact CB-CE1 3.78Å; I227-Y232 HydrophobicContact CG2-CD1 3.87Å; I227-Y232 HydrophobicContact CG2-CE1 3.5Å; I227-Y232 VanDerWaalsContact CG2-CE1 3.5Å; I227-Y232 WeakPolarHBondContact O-CE1 3.41Å; I227-Y232 PolarHBondContact O-OH 3.18Å; P228-Y232 VanDerWaalsContact O-CE1 3.25Å; P228-Y232 WeakPolarHBondContact O-CE1 3.43Å; K230-Y232 HydrophobicContact CB-CD1 4.3Å; K230-Y232 HydrophobicContact CB-CE1 3.65Å; K230-Y232 HydrophobicContact CB-CE2 3.87Å; K230-Y232 VanDerWaalsContact CB-CZ 3.42Å; Y232-E236 VanDerWaalsContact CA-OE2 3.27Å; Y232-E236 WeakPolarHBondContact CA-OE2 3.41Å; Y232-L237 HydrophobicContact CD1-CD2 4.47Å; Y232-L237 HydrophobicContact CD2-CD2 3.96Å; Y232-L237 HydrophobicContact CG-CD2 3.86Å; Y232-L237 HydrophobicContact CG-CG 4.24Å
233	T	97.2	Very high	95.7	Very high	59 Å²	59	71.9 Å²	71.9	36%	0.362	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-87	170.2	159.3	79.8	0	0	0	0	111.2	E235 E236 L237	T233-E235 VanDerWaalsContact C-N 3.29Å; T233-E235 WeakPolarHBondContact CB-OE2 3.38Å; T233-E235 PolarHBondContact O-N 3.18Å; T233-E235 PolarHBondContact OG1-N 3.47Å; T233-E235 PolarHBondContact OG1-OE2 3.08Å; T233-E236 PolarHBondContact N-OE2 3.32Å; T233-E236 PolarHBondContact O-N 2.92Å; T233-E236 PolarHBondContact OG1-N 2.83Å; T233-L237 PolarHBondContact O-N 3.39Å
234	E	97.5	Very high	95.8	Very high	48 Å²	48	67.2 Å²	67.2	22%	0.224	34%	0.339	C	S	.	.	H	α-helix	trans	-54.3	-49.1	171.9	178.2	-165.1	158.5	0	0	110.2	E184 A185 H188 E236 L237 V238	E184-E234 HydrophobicContact CB-CB 4.43Å; E184-E234 HydrophobicContact CB-CG 3.91Å; A185-E234 HydrophobicContact CB-CG 4.39Å; H188-E234 IonicContact CD2-OE1 3.7Å; H188-E234 IonicContact CE1-OE1 3.15Å; H188-E234 IonicContact NE2-OE1 2.83Å; H188-E234 PolarHBondContact NE2-OE1 2.86Å; E234-E236 PolarHBondContact O-N 3.15Å; E234-L237 PolarHBondContact O-N 3.45Å; E234-V238 HydrophobicContact CG-CG2 4.47Å; E234-V238 VanDerWaalsContact O-CG2 3.3Å; E234-V238 WeakPolarHBondContact O-CG2 3.07Å; E234-V238 PolarHBondContact O-N 2.87Å
235	E	97.4	Very high	95.7	Very high	122 Å²	122	69.8 Å²	69.8	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-66.4	-37.6	-175.4	-57.8	86.8	167.1	0	0	113	T233 L237 V238 E239	T233-E235 VanDerWaalsContact C-N 3.29Å; T233-E235 WeakPolarHBondContact CB-OE2 3.38Å; T233-E235 PolarHBondContact O-N 3.18Å; T233-E235 PolarHBondContact OG1-N 3.47Å; T233-E235 PolarHBondContact OG1-OE2 3.08Å; E235-L237 VanDerWaalsContact C-N 3.32Å; E235-L237 PolarHBondContact O-N 2.91Å; E235-V238 PolarHBondContact O-N 2.9Å; E235-E239 VanDerWaalsContact O-CB 3.31Å; E235-E239 WeakPolarHBondContact O-CB 3.11Å; E235-E239 PolarHBondContact O-N 3.43Å
236	E	97.7	Very high	95.7	Very high	91 Å²	91	71.3 Å²	71.3	43%	0.425	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-38.6	177.3	-71.2	171.5	156.2	0	0	111.5	Y232 T233 E234 F240	Y232-E236 VanDerWaalsContact CA-OE2 3.27Å; Y232-E236 WeakPolarHBondContact CA-OE2 3.41Å; T233-E236 PolarHBondContact N-OE2 3.32Å; T233-E236 PolarHBondContact O-N 2.92Å; T233-E236 PolarHBondContact OG1-N 2.83Å; E234-E236 PolarHBondContact O-N 3.15Å; E236-F240 WeakPolarHBondContact O-CB 3.49Å; E236-F240 PolarHBondContact O-N 3.15Å; E236-F240 VanDerWaalsContact O-N 3.08Å
237	L	98.3	Very high	95.7	Very high	2 Å²	2	66.7 Å²	66.7	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-69.2	-43.7	175.1	-69.3	169.7	0	0	0	111.5	F182 A185 V214 I227 Y232 T233 E234 E235 F240 V241	F182-L237 HydrophobicContact CB-CD1 4.1Å; F182-L237 HydrophobicContact CD2-CD1 3.87Å; F182-L237 HydrophobicContact CG-CD1 4.47Å; A185-L237 HydrophobicContact CB-CB 3.72Å; A185-L237 HydrophobicContact CB-CD1 3.96Å; V214-L237 HydrophobicContact CB-CD2 4.49Å; V214-L237 HydrophobicContact CG1-CD2 4.42Å; V214-L237 HydrophobicContact CG2-CD2 4.4Å; I227-L237 HydrophobicContact CD1-CD2 3.74Å; Y232-L237 HydrophobicContact CD1-CD2 4.47Å; Y232-L237 HydrophobicContact CD2-CD2 3.96Å; Y232-L237 HydrophobicContact CG-CD2 3.86Å; Y232-L237 HydrophobicContact CG-CG 4.24Å; T233-L237 PolarHBondContact O-N 3.39Å; E234-L237 PolarHBondContact O-N 3.45Å; E235-L237 VanDerWaalsContact C-N 3.32Å; E235-L237 PolarHBondContact O-N 2.91Å; L237-F240 PolarHBondContact O-N 3.45Å; L237-V241 WeakPolarHBondContact O-CG2 3.34Å; L237-V241 PolarHBondContact O-N 3.05Å
238	V	98.3	Very high	95.8	Very high	13 Å²	13	66.5 Å²	66.5	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-41.9	178.6	170.9	0	0	0	0	111.4	A185 H188 F189 E234 E235 K242	A185-V238 HydrophobicContact CB-CG2 3.99Å; H188-V238 HydrophobicContact CB-CG2 4.28Å; F189-V238 HydrophobicContact CE2-CB 4.35Å; F189-V238 HydrophobicContact CE2-CG1 4.45Å; F189-V238 HydrophobicContact CE2-CG2 4.01Å; F189-V238 HydrophobicContact CZ-CB 4.26Å; F189-V238 HydrophobicContact CZ-CG1 3.98Å; F189-V238 HydrophobicContact CZ-CG2 4.36Å; E234-V238 HydrophobicContact CG-CG2 4.47Å; E234-V238 VanDerWaalsContact O-CG2 3.3Å; E234-V238 WeakPolarHBondContact O-CG2 3.07Å; E234-V238 PolarHBondContact O-N 2.87Å; E235-V238 PolarHBondContact O-N 2.9Å; V238-K242 HydrophobicContact CG1-CD 4.02Å; V238-K242 WeakPolarHBondContact O-CB 3.42Å; V238-K242 VanDerWaalsContact O-CG 3.28Å; V238-K242 WeakPolarHBondContact O-CG 3.39Å; V238-K242 PolarHBondContact O-N 3Å
239	E	97.9	Very high	96	Very high	137 Å²	137	63 Å²	63	64%	0.64	30%	0.302	S	S	*	.	H	α-helix	trans	-65.2	-45.2	177.3	-172	169.4	-165.5	0	0	111.1	E235 V241 K242 E243	E235-E239 VanDerWaalsContact O-CB 3.31Å; E235-E239 WeakPolarHBondContact O-CB 3.11Å; E235-E239 PolarHBondContact O-N 3.43Å; E239-V241 PolarHBondContact O-N 3.39Å; E239-K242 PolarHBondContact O-N 3.11Å; E239-E243 WeakPolarHBondContact O-CB 3.45Å; E239-E243 PolarHBondContact O-N 3.4Å
240	F	98.2	Very high	96.4	Very high	18 Å²	18	57 Å²	57	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-48.7	177.2	-173.9	-84.7	0	0	0	112.1	F216 V225 I227 E236 L237 K242 E243 H244	F216-F240 HydrophobicContact CB-CE1 3.76Å; F216-F240 HydrophobicContact CD1-CE1 4.38Å; F216-F240 HydrophobicContact CD2-CD1 4.41Å; F216-F240 HydrophobicContact CD2-CE1 4.11Å; F216-F240 AromaticContact CG-CE1 3.85Å; F216-F240 HydrophobicContact CG-CE1 3.85Å; V225-F240 HydrophobicContact CG1-CZ 3.9Å; I227-F240 HydrophobicContact CD1-CD1 3.7Å; I227-F240 HydrophobicContact CD1-CE1 4.1Å; I227-F240 HydrophobicContact CD1-CG 4.17Å; I227-F240 HydrophobicContact CG1-CD1 3.78Å; I227-F240 HydrophobicContact CG1-CD2 4.47Å; I227-F240 HydrophobicContact CG1-CE1 3.73Å; I227-F240 HydrophobicContact CG1-CE2 4.41Å; I227-F240 HydrophobicContact CG1-CG 4.17Å; I227-F240 HydrophobicContact CG1-CZ 4.05Å; I227-F240 HydrophobicContact CG2-CB 4.36Å; I227-F240 HydrophobicContact CG2-CD1 4.43Å; I227-F240 HydrophobicContact CG2-CD2 3.91Å; I227-F240 HydrophobicContact CG2-CE2 4.34Å; I227-F240 HydrophobicContact CG2-CG 3.96Å; E236-F240 WeakPolarHBondContact O-CB 3.49Å; E236-F240 PolarHBondContact O-N 3.15Å; E236-F240 VanDerWaalsContact O-N 3.08Å; L237-F240 PolarHBondContact O-N 3.45Å; F240-K242 VanDerWaalsContact C-N 3.32Å; F240-K242 PolarHBondContact O-N 3.26Å; F240-E243 PolarHBondContact O-N 3.42Å; F240-H244 AromaticContact CD1-ND1 3.93Å; F240-H244 AromaticContact CD2-CE1 3.79Å; F240-H244 AromaticContact CE1-ND1 3.76Å; F240-H244 AromaticContact CE2-CE1 3.43Å; F240-H244 VanDerWaalsContact CE2-CE1 3.43Å; F240-H244 WeakPolarHBondContact CE2-CE1 3.38Å; F240-H244 AromaticContact CE2-ND1 3.87Å; F240-H244 AromaticContact CE2-NE2 3.97Å; F240-H244 AromaticContact CZ-CE1 3.59Å; F240-H244 AromaticContact CZ-ND1 3.74Å; F240-H244 AromaticContact CZ-NE2 3.86Å; F240-H244 PolarHBondContact O-N 3.28Å; F240-H244 VanDerWaalsContact O-N 3.11Å; F240-H244 PolarHBondContact O-ND1 3.48Å
241	V	98	Very high	96.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-37.5	-180	173.4	0	0	0	0	111.4	L167 F189 I193 F195 F216 L237 E239 H244 K245	L167-V241 HydrophobicContact CD1-CG2 4.05Å; L167-V241 HydrophobicContact CD2-CG2 3.66Å; L167-V241 HydrophobicContact CG-CG2 4.48Å; F189-V241 HydrophobicContact CD1-CG1 3.9Å; F189-V241 HydrophobicContact CD2-CG1 4.17Å; F189-V241 HydrophobicContact CE1-CB 4.1Å; F189-V241 HydrophobicContact CE1-CG1 3.54Å; F189-V241 HydrophobicContact CE2-CB 3.85Å; F189-V241 HydrophobicContact CE2-CG1 3.83Å; F189-V241 HydrophobicContact CE2-CG2 4.28Å; F189-V241 HydrophobicContact CG-CG1 4.2Å; F189-V241 HydrophobicContact CZ-CB 3.56Å; F189-V241 HydrophobicContact CZ-CG1 3.5Å; F189-V241 HydrophobicContact CZ-CG2 4.47Å; I193-V241 HydrophobicContact CD1-CG1 3.4Å; F195-V241 HydrophobicContact CZ-CG2 4.26Å; F216-V241 HydrophobicContact CD2-CG2 4.33Å; F216-V241 HydrophobicContact CE2-CG2 4.38Å; L237-V241 WeakPolarHBondContact O-CG2 3.34Å; L237-V241 PolarHBondContact O-N 3.05Å; E239-V241 PolarHBondContact O-N 3.39Å; V241-H244 CarbonylContact O-C 3.49Å; V241-H244 PolarHBondContact O-N 2.96Å; V241-K245 WeakPolarHBondContact O-CA 3.28Å; V241-K245 WeakPolarHBondContact O-CB 3.41Å; V241-K245 PolarHBondContact O-N 3.47Å
242	K	97	Very high	97.4	Very high	129 Å²	129	51.4 Å²	51.4	56%	0.561	24%	0.237	S	C	*	.	H	α-helix	trans	-66.8	-38.6	175.7	-76.6	175.8	178.8	175.2	0	112.8	F189 V238 E239 F240 H244	F189-K242 HydrophobicContact CE1-CG 4.06Å; F189-K242 HydrophobicContact CZ-CG 4.24Å; V238-K242 HydrophobicContact CG1-CD 4.02Å; V238-K242 WeakPolarHBondContact O-CB 3.42Å; V238-K242 VanDerWaalsContact O-CG 3.28Å; V238-K242 WeakPolarHBondContact O-CG 3.39Å; V238-K242 PolarHBondContact O-N 3Å; E239-K242 PolarHBondContact O-N 3.11Å; F240-K242 VanDerWaalsContact C-N 3.32Å; F240-K242 PolarHBondContact O-N 3.26Å; K242-H244 VanDerWaalsContact C-N 3.28Å; K242-H244 PolarHBondContact O-N 2.84Å
243	E	96.4	Very high	97.6	Very high	148 Å²	148	52.1 Å²	52.1	69%	0.692	24%	0.239	S	C	*	.	H	α-helix	trans	-65.1	-33.4	176.8	-175.6	175.3	-170.4	0	0	111.9	E239 F240	E239-E243 WeakPolarHBondContact O-CB 3.45Å; E239-E243 PolarHBondContact O-N 3.4Å; F240-E243 PolarHBondContact O-N 3.42Å
244	H	96.3	Very high	97.6	Very high	61 Å²	61	50.4 Å²	50.4	28%	0.282	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	18.7	-177.7	-56.6	75.8	0	0	0	112.7	F216 F240 V241 K242 R246	F216-H244 HydrophobicContact CE1-CB 3.96Å; F216-H244 HydrophobicContact CE2-CB 4.37Å; F216-H244 HydrophobicContact CZ-CB 3.8Å; F216-H244 WeakPolarHBondContact CZ-O 3.48Å; F240-H244 AromaticContact CD1-ND1 3.93Å; F240-H244 AromaticContact CD2-CE1 3.79Å; F240-H244 AromaticContact CE1-ND1 3.76Å; F240-H244 AromaticContact CE2-CE1 3.43Å; F240-H244 VanDerWaalsContact CE2-CE1 3.43Å; F240-H244 WeakPolarHBondContact CE2-CE1 3.38Å; F240-H244 AromaticContact CE2-ND1 3.87Å; F240-H244 AromaticContact CE2-NE2 3.97Å; F240-H244 AromaticContact CZ-CE1 3.59Å; F240-H244 AromaticContact CZ-ND1 3.74Å; F240-H244 AromaticContact CZ-NE2 3.86Å; F240-H244 PolarHBondContact O-N 3.28Å; F240-H244 VanDerWaalsContact O-N 3.11Å; F240-H244 PolarHBondContact O-ND1 3.48Å; V241-H244 CarbonylContact O-C 3.49Å; V241-H244 PolarHBondContact O-N 2.96Å; K242-H244 VanDerWaalsContact C-N 3.28Å; K242-H244 PolarHBondContact O-N 2.84Å; H244-R246 VanDerWaalsContact C-N 3.32Å; H244-R246 PolarHBondContact O-N 3.34Å
245	K	94.6	Very high	97.6	Very high	80 Å²	80	50.4 Å²	50.4	35%	0.348	23%	0.229	S	C	.	.			trans	-67.6	-33.1	-175.8	-174.1	178.5	175.6	176.7	0	112.1	I165 V241 A247 E259	I165-K245 WeakPolarHBondContact CD1-O 3.42Å; V241-K245 WeakPolarHBondContact O-CA 3.28Å; V241-K245 WeakPolarHBondContact O-CB 3.41Å; V241-K245 PolarHBondContact O-N 3.47Å; K245-A247 PolarHBondContact O-N 3.33Å; K245-E259 IonicContact NZ-OE1 2.76Å; K245-E259 PolarHBondContact NZ-OE1 3.27Å; K245-E259 IonicContact NZ-OE2 3.99Å; K245-E259 PolarHBondContact NZ-OE2 3.36Å
246	R	96.9	Very high	97.5	Very high	98 Å²	98	45 Å²	45	37%	0.37	20%	0.204	S	C	.	.	S	Bend	trans	-87.2	106.5	179.9	-172.7	-177.7	-67.6	177.2	-10.4	109.5	H244 D263 D264	H244-R246 VanDerWaalsContact C-N 3.32Å; H244-R246 PolarHBondContact O-N 3.34Å; R246-D263 IonicContact CZ-OD1 3.7Å; R246-D263 IonicContact CZ-OD2 3.52Å; R246-D263 IonicContact NE-OD1 3.47Å; R246-D263 IonicContact NE-OD2 3.6Å; R246-D263 PolarHBondContact NE-OD2 2.98Å; R246-D263 IonicContact NH2-OD1 2.63Å; R246-D263 PolarHBondContact NH2-OD1 2.66Å; R246-D263 IonicContact NH2-OD2 2.67Å; R246-D263 PolarHBondContact NH2-OD2 3.3Å; R246-D264 PolarHBondContact NH2-O 2.77Å; R246-D264 VanDerWaalsContact NH2-O 3.1Å
247	A	97.5	Very high	97.5	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.033	19%	0.189	C	C	.	.			trans	-78.4	155.3	175.4	0	0	0	0	0	112	E218 P219 K245 L249 S302	E218-A247 HydrophobicContact CG-CB 3.67Å; E218-A247 WeakPolarHBondContact OE1-CA 3.22Å; P219-A247 HydrophobicContact CB-CB 4.45Å; P219-A247 HydrophobicContact CG-CB 3.98Å; K245-A247 PolarHBondContact O-N 3.33Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 WeakPolarHBondContact CB-O 3.49Å; A247-S302 PolarHBondContact O-OG 3.36Å
248	T	98.3	Very high	97.4	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.031	21%	0.208	C	C	.	.	S	Bend	trans	-65.1	-37.4	174.7	-53.3	0	0	0	0	111.7	E218 A292 T296 L301 S302 I303	E218-T248 PolarHBondContact OE1-N 2.97Å; E218-T248 PolarHBondContact OE1-OG1 3.37Å; T248-A292 HydrophobicContact CG2-CB 4Å; T248-T296 WeakPolarHBondContact OG1-CA 3.44Å; T248-L301 HydrophobicContact CG2-CB 4.49Å; T248-L301 HydrophobicContact CG2-CD2 3.74Å; T248-L301 HydrophobicContact CG2-CG 3.89Å; T248-S302 CarbonylContact O-C 3.44Å; T248-S302 WeakPolarHBondContact O-CA 3.31Å; T248-I303 PolarHBondContact O-N 3.43Å
249	L	98.6	Very high	97.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125	170	179.7	64.3	0	0	0	108.2	F220 A247 L288 K289 A292 I303 W305	F220-L249 HydrophobicContact CB-CD2 4.26Å; F220-L249 HydrophobicContact CD2-CB 3.86Å; F220-L249 HydrophobicContact CD2-CD2 3.64Å; F220-L249 HydrophobicContact CD2-CG 3.6Å; F220-L249 WeakPolarHBondContact CD2-O 3.28Å; F220-L249 HydrophobicContact CE2-CB 4.44Å; F220-L249 HydrophobicContact CE2-CD2 4.09Å; F220-L249 HydrophobicContact CE2-CG 3.83Å; F220-L249 HydrophobicContact CG-CD2 3.9Å; F220-L249 HydrophobicContact CG-CG 4.36Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 WeakPolarHBondContact CB-O 3.49Å; L249-L288 HydrophobicContact CD2-CB 4.24Å; L249-K289 HydrophobicContact CD2-CG 3.99Å; L249-A292 HydrophobicContact CB-CB 3.65Å; L249-A292 HydrophobicContact CD2-CB 4.34Å; L249-I303 HydrophobicContact CD1-CB 3.85Å; L249-I303 HydrophobicContact CD1-CG2 3.84Å; L249-W305 HydrophobicContact CD1-CB 3.95Å
250	R	98.2	Very high	97.2	Very high	25 Å²	25	42.6 Å²	42.6	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.3	-178.6	54.5	-176.2	177.9	-179.4	-1.4	110.2	T260 D263 H269 S302 I303 V304 W305	R250-T260 HydrophobicContact CG-CG2 4.49Å; R250-D263 IonicContact CZ-OD2 3.48Å; R250-D263 IonicContact NH1-OD2 3.36Å; R250-D263 PolarHBondContact NH1-OD2 2.99Å; R250-D263 PolarHBondContact NH2-O 3.38Å; R250-D263 IonicContact NH2-OD2 2.82Å; R250-H269 PolarHBondContact NH2-CE1 3.47Å; R250-H269 VanDerWaalsContact NH2-CE1 3.34Å; R250-H269 PolarHBondContact NH2-ND1 3.3Å; R250-S302 PolarHBondContact NE-OG 2.85Å; R250-I303 WeakPolarHBondContact CG-O 3.39Å; R250-I303 PolarHBondContact N-O 2.87Å; R250-V304 HydrophobicContact CG-CG2 4.21Å; R250-V304 CarbonylContact O-C 3.57Å; R250-V304 WeakPolarHBondContact O-CA 3.37Å; R250-W305 PolarHBondContact O-N 3.1Å
251	K	98.6	Very high	97.2	Very high	21 Å²	21	45.1 Å²	45.1	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.2	173.6	-169.7	174.2	-173.8	169.7	0	109.2	E163 F220 R253 W305 D310	E163-K251 HydrophobicContact CB-CD 4.36Å; E163-K251 HydrophobicContact CG-CD 4.48Å; E163-K251 IonicContact OE1-NZ 3.32Å; E163-K251 PolarHBondContact OE1-NZ 2.99Å; E163-K251 VanDerWaalsContact OE2-CD 3.23Å; E163-K251 WeakPolarHBondContact OE2-CD 3.25Å; E163-K251 IonicContact OE2-NZ 3.52Å; E163-K251 PolarHBondContact OE2-NZ 3.19Å; F220-K251 HydrophobicContact CZ-CB 4.49Å; K251-R253 HydrophobicContact CB-CG 4.4Å; K251-R253 HydrophobicContact CG-CG 4.27Å; K251-W305 CarbonylContact C-O 3.47Å; K251-W305 WeakPolarHBondContact CA-O 3.42Å; K251-W305 HydrophobicContact CB-CE3 3.99Å; K251-W305 HydrophobicContact CB-CZ3 4.36Å; K251-W305 HydrophobicContact CD-CE3 4.04Å; K251-W305 HydrophobicContact CD-CH2 4.15Å; K251-W305 HydrophobicContact CD-CZ3 3.66Å; K251-W305 HydrophobicContact CG-CD2 4.45Å; K251-W305 HydrophobicContact CG-CE3 3.88Å; K251-W305 HydrophobicContact CG-CZ3 4.05Å; K251-D310 VanDerWaalsContact CE-OD2 3.3Å; K251-D310 WeakPolarHBondContact CE-OD2 3.4Å; K251-D310 IonicContact NZ-OD2 2.82Å
252	L	98.6	Very high	97.1	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	23%	0.228	C	C	.	.			trans	-75	120.3	167.4	-169.2	72.2	0	0	0	108.1	M257 T260 V304 W305 I306 F311	L252-M257 HydrophobicContact CD1-CB 4.02Å; L252-M257 HydrophobicContact CG-CB 4.16Å; L252-T260 HydrophobicContact CD1-CG2 3.75Å; L252-V304 HydrophobicContact CB-CG1 3.88Å; L252-V304 HydrophobicContact CD1-CG1 4.24Å; L252-W305 PolarHBondContact N-O 3.08Å; L252-I306 HydrophobicContact CB-CG1 3.86Å; L252-I306 HydrophobicContact CD2-CD1 3.69Å; L252-I306 HydrophobicContact CD2-CG1 3.81Å; L252-I306 HydrophobicContact CD2-CG2 4.33Å; L252-I306 HydrophobicContact CG-CG1 4.48Å; L252-F311 HydrophobicContact CB-CE2 4.31Å; L252-F311 HydrophobicContact CB-CZ 4.41Å; L252-F311 HydrophobicContact CD2-CE2 4.09Å; L252-F311 HydrophobicContact CD2-CZ 4.01Å; L252-F311 HydrophobicContact CG-CE2 4.17Å; L252-F311 HydrophobicContact CG-CZ 3.9Å; L252-F311 WeakPolarHBondContact O-CE2 3.37Å
253	R	98	Very high	97	Very high	30 Å²	30	47.5 Å²	47.5	11%	0.113	22%	0.216	C	C	.	.			trans	-119.2	148.7	-178.5	-55.1	173.3	-67.5	176.7	-5.6	111.1	E164 K251 E255 D256 M257	E164-R253 IonicContact OE1-NH1 3.7Å; E164-R253 PolarHBondContact OE1-NH1 2.65Å; E164-R253 IonicContact OE2-NH1 3.56Å; K251-R253 HydrophobicContact CB-CG 4.4Å; K251-R253 HydrophobicContact CG-CG 4.27Å; R253-E255 HydrophobicContact CB-CG 4.44Å; R253-E255 WeakPolarHBondContact CB-OE2 3.4Å; R253-E255 WeakPolarHBondContact CD-OE1 3.43Å; R253-E255 IonicContact CZ-OE1 3.7Å; R253-E255 IonicContact NE-OE1 2.65Å; R253-E255 IonicContact NH1-OE1 3.9Å; R253-E255 PolarHBondContact O-N 3.2Å; R253-D256 WeakPolarHBondContact CB-OD1 3.35Å; R253-D256 IonicContact CZ-OD2 3.73Å; R253-D256 IonicContact NE-OD1 3.68Å; R253-D256 IonicContact NE-OD2 3.4Å; R253-D256 PolarHBondContact NE-OD2 2.81Å; R253-D256 IonicContact NH2-OD2 3.73Å; R253-D256 PolarHBondContact NH2-OD2 2.81Å; R253-D256 PolarHBondContact O-N 2.94Å; R253-M257 WeakPolarHBondContact O-CA 3.41Å; R253-M257 VanDerWaalsContact O-CB 3.28Å; R253-M257 WeakPolarHBondContact O-CB 3.33Å; R253-M257 PolarHBondContact O-N 2.8Å
254	P	98.1	Very high	97	Very high	22 Å²	22	43 Å²	43	14%	0.143	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-34.3	-179.4	-27.3	36	0	0	0	113.8	G127 E128 V133 D256 F311	G127-P254 CarbonylContact C-O 3.56Å; G127-P254 WeakPolarHBondContact CA-O 3.33Å; E128-P254 HydrophobicContact CB-CB 4.42Å; E128-P254 PolarHBondContact N-O 3.13Å; V133-P254 HydrophobicContact CG1-CB 4.05Å; V133-P254 HydrophobicContact CG2-CB 3.68Å; P254-D256 VanDerWaalsContact C-N 3.34Å; P254-D256 PolarHBondContact O-N 3.41Å; P254-F311 HydrophobicContact CB-CE1 4.45Å; P254-F311 HydrophobicContact CG-CE1 4.08Å; P254-F311 HydrophobicContact CG-CZ 4.16Å
255	E	96.7	Very high	96.9	Very high	49 Å²	49	41.6 Å²	41.6	23%	0.229	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.8	-176.8	64.7	-89.8	-155.4	0	0	115.3	F125 G127 V133 F137 R253	F125-E255 HydrophobicContact CE2-CB 4.37Å; F125-E255 WeakPolarHBondContact CE2-O 3.39Å; G127-E255 WeakPolarHBondContact CA-O 3.27Å; V133-E255 HydrophobicContact CG1-CB 4.31Å; F137-E255 HydrophobicContact CD2-CB 4.43Å; R253-E255 HydrophobicContact CB-CG 4.44Å; R253-E255 WeakPolarHBondContact CB-OE2 3.4Å; R253-E255 WeakPolarHBondContact CD-OE1 3.43Å; R253-E255 IonicContact CZ-OE1 3.7Å; R253-E255 IonicContact NE-OE1 2.65Å; R253-E255 IonicContact NH1-OE1 3.9Å; R253-E255 PolarHBondContact O-N 3.2Å
256	D	96.1	Very high	96.7	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.048	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.4	21.9	-177.4	67.2	-1.6	0	0	0	113.7	D126 Y192 R253 P254 F258 E259 T260	D126-D256 CarbonylContact O-C 3.56Å; Y192-D256 HydrophobicContact CD1-CB 4.01Å; Y192-D256 HydrophobicContact CE1-CB 3.91Å; R253-D256 WeakPolarHBondContact CB-OD1 3.35Å; R253-D256 IonicContact CZ-OD2 3.73Å; R253-D256 IonicContact NE-OD1 3.68Å; R253-D256 IonicContact NE-OD2 3.4Å; R253-D256 PolarHBondContact NE-OD2 2.81Å; R253-D256 IonicContact NH2-OD2 3.73Å; R253-D256 PolarHBondContact NH2-OD2 2.81Å; R253-D256 PolarHBondContact O-N 2.94Å; P254-D256 VanDerWaalsContact C-N 3.34Å; P254-D256 PolarHBondContact O-N 3.41Å; D256-F258 VanDerWaalsContact C-N 3.27Å; D256-F258 PolarHBondContact O-N 3.14Å; D256-E259 PolarHBondContact O-N 2.96Å; D256-T260 PolarHBondContact O-N 3.25Å; D256-T260 PolarHBondContact O-OG1 2.88Å; D256-T260 VanDerWaalsContact O-OG1 3.14Å
257	M	96.9	Very high	96.5	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-59	-35.8	-174.7	63.3	179.5	-55.5	0	0	113.3	E128 L252 R253 W261 F311 L314	E128-M257 HydrophobicContact CB-SD 3.81Å; E128-M257 HydrophobicContact CG-SD 4.44Å; L252-M257 HydrophobicContact CD1-CB 4.02Å; L252-M257 HydrophobicContact CG-CB 4.16Å; R253-M257 WeakPolarHBondContact O-CA 3.41Å; R253-M257 VanDerWaalsContact O-CB 3.28Å; R253-M257 WeakPolarHBondContact O-CB 3.33Å; R253-M257 PolarHBondContact O-N 2.8Å; M257-W261 VanDerWaalsContact O-CB 3.26Å; M257-W261 WeakPolarHBondContact O-CB 3.38Å; M257-W261 PolarHBondContact O-N 3.01Å; M257-W261 VanDerWaalsContact O-N 3.08Å; M257-F311 HydrophobicContact CB-CE1 4.28Å; M257-F311 HydrophobicContact CB-CZ 4.46Å; M257-F311 HydrophobicContact CE-CD1 4.2Å; M257-F311 HydrophobicContact CE-CE1 3.85Å; M257-F311 HydrophobicContact SD-CE1 3.93Å; M257-L314 HydrophobicContact CE-CD1 3.92Å
258	F	96.1	Very high	96.4	Very high	94 Å²	94	45.5 Å²	45.5	41%	0.412	22%	0.219	S	C	.	.	H	α-helix	trans	-77.3	-42.3	-179.7	-62.2	-62.8	0	0	0	110.4	D126 G127 D256 T260 W261 E262	D126-F258 WeakPolarHBondContact O-CB 3.47Å; D126-F258 PolarHBondContact O-N 3.24Å; D126-F258 VanDerWaalsContact O-N 3.16Å; D126-F258 VanDerWaalsContact OD1-CB 3.27Å; D126-F258 WeakPolarHBondContact OD1-CB 3.36Å; G127-F258 WeakPolarHBondContact O-CD2 3.45Å; G127-F258 VanDerWaalsContact O-CE2 3.3Å; G127-F258 WeakPolarHBondContact O-CE2 3.23Å; D256-F258 VanDerWaalsContact C-N 3.27Å; D256-F258 PolarHBondContact O-N 3.14Å; F258-T260 VanDerWaalsContact C-N 3.27Å; F258-T260 PolarHBondContact O-N 2.9Å; F258-W261 PolarHBondContact O-N 3.16Å; F258-W261 VanDerWaalsContact O-N 3.1Å; F258-E262 WeakPolarHBondContact O-CB 3.3Å; F258-E262 WeakPolarHBondContact O-CG 3.48Å; F258-E262 PolarHBondContact O-N 3.43Å
259	E	94.8	Very high	96.4	Very high	65 Å²	65	45.3 Å²	45.3	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-57	-44.7	174.7	177.5	171	-135.1	0	0	110.9	D126 K245 D256 D263	D126-E259 HydrophobicContact CB-CB 4.25Å; D126-E259 PolarHBondContact O-N 3.27Å; D126-E259 WeakPolarHBondContact OD2-CA 3.36Å; D126-E259 PolarHBondContact OD2-N 2.85Å; K245-E259 IonicContact NZ-OE1 2.76Å; K245-E259 PolarHBondContact NZ-OE1 3.27Å; K245-E259 IonicContact NZ-OE2 3.99Å; K245-E259 PolarHBondContact NZ-OE2 3.36Å; D256-E259 PolarHBondContact O-N 2.96Å; E259-D263 WeakPolarHBondContact O-CB 3.39Å; E259-D263 PolarHBondContact O-N 2.57Å
260	T	97	Very high	96.4	Very high	12 Å²	12	45.7 Å²	45.7	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-40.6	178.3	-62.1	0	0	0	0	112.1	R250 L252 D256 F258 H269 V304	R250-T260 HydrophobicContact CG-CG2 4.49Å; L252-T260 HydrophobicContact CD1-CG2 3.75Å; D256-T260 PolarHBondContact O-N 3.25Å; D256-T260 PolarHBondContact O-OG1 2.88Å; D256-T260 VanDerWaalsContact O-OG1 3.14Å; F258-T260 VanDerWaalsContact C-N 3.27Å; F258-T260 PolarHBondContact O-N 2.9Å; T260-H269 PolarHBondContact O-CE1 2.91Å; T260-V304 HydrophobicContact CG2-CG1 4.31Å; T260-V304 HydrophobicContact CG2-CG2 4.3Å
261	W	97.8	Very high	96.4	Very high	71 Å²	71	44.6 Å²	44.6	27%	0.269	22%	0.216	S	C	.	.	H	α-helix	trans	-77.1	-30.3	-177.7	-166	-95	0	0	0	113.3	M257 F258 D263 H269 V271 V334	M257-W261 VanDerWaalsContact O-CB 3.26Å; M257-W261 WeakPolarHBondContact O-CB 3.38Å; M257-W261 PolarHBondContact O-N 3.01Å; M257-W261 VanDerWaalsContact O-N 3.08Å; F258-W261 PolarHBondContact O-N 3.16Å; F258-W261 VanDerWaalsContact O-N 3.1Å; W261-D263 VanDerWaalsContact C-N 3.33Å; W261-H269 PolarHBondContact O-NE2 3.09Å; W261-V271 HydrophobicContact CH2-CG2 4.05Å; W261-V271 HydrophobicContact CZ3-CG2 3.92Å; W261-V334 HydrophobicContact CH2-CB 4.24Å; W261-V334 HydrophobicContact CH2-CG1 4.03Å; W261-V334 HydrophobicContact CZ2-CG1 3.98Å
262	E	96	Very high	96.4	Very high	120 Å²	120	43.6 Å²	43.6	56%	0.561	21%	0.211	S	C	*	.	H	α-helix	trans	-76.6	-21.7	174.9	-69.2	-172.7	177	0	0	112.7	F258 D264	F258-E262 WeakPolarHBondContact O-CB 3.3Å; F258-E262 WeakPolarHBondContact O-CG 3.48Å; F258-E262 PolarHBondContact O-N 3.43Å; E262-D264 PolarHBondContact O-N 3.24Å
263	D	96.5	Very high	96.4	Very high	59 Å²	59	43.4 Å²	43.4	32%	0.316	21%	0.211	S	C	.	.	S	Bend	trans	-79.6	58.3	175.2	-170.9	51.1	0	0	0	112.3	R246 R250 E259 W261 H269	R246-D263 IonicContact CZ-OD1 3.7Å; R246-D263 IonicContact CZ-OD2 3.52Å; R246-D263 IonicContact NE-OD1 3.47Å; R246-D263 IonicContact NE-OD2 3.6Å; R246-D263 PolarHBondContact NE-OD2 2.98Å; R246-D263 IonicContact NH2-OD1 2.63Å; R246-D263 PolarHBondContact NH2-OD1 2.66Å; R246-D263 IonicContact NH2-OD2 2.67Å; R246-D263 PolarHBondContact NH2-OD2 3.3Å; R250-D263 IonicContact CZ-OD2 3.48Å; R250-D263 IonicContact NH1-OD2 3.36Å; R250-D263 PolarHBondContact NH1-OD2 2.99Å; R250-D263 PolarHBondContact NH2-O 3.38Å; R250-D263 IonicContact NH2-OD2 2.82Å; E259-D263 WeakPolarHBondContact O-CB 3.39Å; E259-D263 PolarHBondContact O-N 2.57Å; W261-D263 VanDerWaalsContact C-N 3.33Å; D263-H269 PolarHBondContact O-CE1 3.48Å
264	D	95.9	Very high	96.4	Very high	54 Å²	54	42 Å²	42	29%	0.289	21%	0.206	S	C	.	.			trans	-69.5	166.4	-179.7	78.4	-137.6	0	0	0	114.2	R246 E262 E266 G267 H269 V336	R246-D264 PolarHBondContact NH2-O 2.77Å; R246-D264 VanDerWaalsContact NH2-O 3.1Å; E262-D264 PolarHBondContact O-N 3.24Å; D264-E266 PolarHBondContact OD2-N 3.09Å; D264-G267 PolarHBondContact OD2-N 3.17Å; D264-H269 VanDerWaalsContact CA-CE1 3.5Å; D264-H269 WeakPolarHBondContact CA-CE1 3.49Å; D264-V336 HydrophobicContact CB-CG1 3.98Å; D264-V336 HydrophobicContact CB-CG2 4.32Å; D264-V336 WeakPolarHBondContact OD1-CG2 3.33Å
265	M	93.1	Very high	96.4	Very high	30 Å²	30	43.7 Å²	43.7	15%	0.148	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-115.1	98.7	172.2	-63.8	-158.1	58.3	0	0	109.8	G267 I268 D300 S302	M265-G267 PolarHBondContact O-N 3.06Å; M265-I268 PolarHBondContact N-O 2.87Å; M265-I268 WeakPolarHBondContact O-CG1 3.5Å; M265-I268 PolarHBondContact O-N 2.9Å; M265-I268 VanDerWaalsContact O-N 3.14Å; M265-D300 VanDerWaalsContact CE-CA 3.44Å; M265-D300 HydrophobicContact CE-CB 4.47Å; M265-D300 WeakPolarHBondContact CE-O 3.47Å; M265-S302 VanDerWaalsContact SD-CB 3.53Å
266	E	91.1	Very high	96.4	Very high	198 Å²	198	44.6 Å²	44.6	93%	0.925	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	33	-179.1	-52.6	-165.4	158.7	0	0	113.4	D264	D264-E266 PolarHBondContact OD2-N 3.09Å
267	G	93.4	Very high	96.3	Very high	17 Å²	17	51.1 Å²	51.1	18%	0.175	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	7.1	179.8	0	0	0	0	0	115.3	D264 M265 V336	D264-G267 PolarHBondContact OD2-N 3.17Å; M265-G267 PolarHBondContact O-N 3.06Å; G267-V336 WeakPolarHBondContact O-CG2 3.25Å; G267-V336 PolarHBondContact O-N 3.23Å
268	I	95.5	Very high	96.3	Very high	49 Å²	49	52.3 Å²	52.3	25%	0.251	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	159.4	176.5	62.7	163.6	0	0	0	112.5	M265 V333 V334	M265-I268 PolarHBondContact N-O 2.87Å; M265-I268 WeakPolarHBondContact O-CG1 3.5Å; M265-I268 PolarHBondContact O-N 2.9Å; M265-I268 VanDerWaalsContact O-N 3.14Å; I268-V333 HydrophobicContact CB-CG1 3.85Å; I268-V333 HydrophobicContact CD1-CG1 3.78Å; I268-V333 HydrophobicContact CG1-CG1 4.38Å; I268-V333 HydrophobicContact CG2-CG1 4.09Å; I268-V334 CarbonylContact C-O 3.59Å; I268-V334 VanDerWaalsContact CA-O 3.31Å; I268-V334 WeakPolarHBondContact CA-O 3.44Å
269	H	98.2	Very high	96.2	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.3	162.1	-74.2	-70.7	0	0	0	110.3	R250 T260 W261 D263 D264 V271 V333 V334 V336	R250-H269 PolarHBondContact NH2-CE1 3.47Å; R250-H269 VanDerWaalsContact NH2-CE1 3.34Å; R250-H269 PolarHBondContact NH2-ND1 3.3Å; T260-H269 PolarHBondContact O-CE1 2.91Å; W261-H269 PolarHBondContact O-NE2 3.09Å; D263-H269 PolarHBondContact O-CE1 3.48Å; D264-H269 VanDerWaalsContact CA-CE1 3.5Å; D264-H269 WeakPolarHBondContact CA-CE1 3.49Å; H269-V271 HydrophobicContact CB-CG2 3.82Å; H269-V333 CarbonylContact O-C 3.46Å; H269-V333 WeakPolarHBondContact O-CA 3.42Å; H269-V334 PolarHBondContact N-O 2.93Å; H269-V334 PolarHBondContact O-N 3.24Å; H269-V336 VanDerWaalsContact CD2-CG1 3.44Å; H269-V336 WeakPolarHBondContact CD2-CG1 3.21Å
270	I	98.4	Very high	96.2	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	117.5	159.3	-58.7	172.7	0	0	0	106.5	L301 I303 V304 I331 G332 W361 I362 V365 L366	I270-L301 HydrophobicContact CD1-CD1 3.83Å; I270-I303 HydrophobicContact CB-CG1 4.42Å; I270-I303 HydrophobicContact CG2-CG1 4.12Å; I270-I303 HydrophobicContact CG2-CG2 4.25Å; I270-I303 WeakPolarHBondContact O-CA 3.24Å; I270-V304 PolarHBondContact O-N 3.34Å; I270-I331 HydrophobicContact CG2-CD1 3.97Å; I270-I331 HydrophobicContact CG2-CG1 4.09Å; I270-G332 CarbonylContact C-O 3.58Å; I270-G332 WeakPolarHBondContact CA-O 3.44Å; I270-W361 HydrophobicContact CG2-CZ3 4.44Å; I270-I362 HydrophobicContact CD1-CG2 4.16Å; I270-V365 HydrophobicContact CD1-CG1 4.21Å; I270-V365 HydrophobicContact CG1-CG1 4.25Å; I270-L366 HydrophobicContact CD1-CD2 4.25Å
271	V	98.7	Very high	96.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.3	-174.8	179.9	0	0	0	0	109.3	W261 H269 F273 V304 I306 I331 G332 V334 W343	W261-V271 HydrophobicContact CH2-CG2 4.05Å; W261-V271 HydrophobicContact CZ3-CG2 3.92Å; H269-V271 HydrophobicContact CB-CG2 3.82Å; V271-F273 HydrophobicContact CG1-CD2 4.28Å; V271-F273 HydrophobicContact CG1-CE2 3.94Å; V271-F273 HydrophobicContact CG1-CZ 4.27Å; V271-V304 CarbonylContact C-O 3.56Å; V271-V304 WeakPolarHBondContact CA-O 3.38Å; V271-I306 HydrophobicContact CG1-CD1 3.62Å; V271-I306 HydrophobicContact CG1-CG1 4.15Å; V271-I331 CarbonylContact O-C 3.56Å; V271-I331 VanDerWaalsContact O-CA 3.3Å; V271-I331 WeakPolarHBondContact O-CA 3.39Å; V271-I331 WeakPolarHBondContact O-CG1 3.34Å; V271-G332 PolarHBondContact N-O 3.48Å; V271-G332 PolarHBondContact O-N 3.36Å; V271-V334 HydrophobicContact CB-CG2 4.3Å; V271-V334 HydrophobicContact CG2-CB 4.29Å; V271-V334 HydrophobicContact CG2-CG2 3.87Å; V271-W343 HydrophobicContact CB-CH2 4.23Å; V271-W343 HydrophobicContact CG1-CH2 4.21Å
272	A	98.7	Very high	96.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.7	173.3	0	0	0	0	0	110.5	F284 L288 I303 V304 W305 I306 Q330 I331	A272-F284 HydrophobicContact CB-CE1 4.35Å; A272-L288 HydrophobicContact CB-CD1 3.61Å; A272-L288 HydrophobicContact CB-CD2 3.96Å; A272-L288 HydrophobicContact CB-CG 4.48Å; A272-I303 HydrophobicContact CB-CG2 4.09Å; A272-V304 PolarHBondContact N-O 2.82Å; A272-W305 CarbonylContact O-C 3.46Å; A272-W305 WeakPolarHBondContact O-CA 3.32Å; A272-I306 PolarHBondContact O-N 3.46Å; A272-Q330 CarbonylContact C-O 3.6Å; A272-Q330 VanDerWaalsContact CA-O 3.24Å; A272-Q330 WeakPolarHBondContact CA-O 3.03Å; A272-I331 HydrophobicContact CB-CB 4.38Å; A272-I331 HydrophobicContact CB-CD1 4.43Å; A272-I331 HydrophobicContact CB-CG1 4.13Å
273	F	98.6	Very high	96.2	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.1	170.5	-69.9	-80.1	0	0	0	109.8	V271 I306 P308 W318 F322 I324 L326 P329 Q330 W343	V271-F273 HydrophobicContact CG1-CD2 4.28Å; V271-F273 HydrophobicContact CG1-CE2 3.94Å; V271-F273 HydrophobicContact CG1-CZ 4.27Å; F273-I306 WeakPolarHBondContact CA-O 3.34Å; F273-I306 HydrophobicContact CD1-CB 3.69Å; F273-I306 HydrophobicContact CD1-CD1 4.49Å; F273-I306 HydrophobicContact CD1-CG2 3.91Å; F273-I306 HydrophobicContact CE1-CB 3.72Å; F273-I306 HydrophobicContact CE1-CD1 3.77Å; F273-I306 HydrophobicContact CE1-CG1 4.29Å; F273-I306 HydrophobicContact CE1-CG2 3.66Å; F273-I306 HydrophobicContact CZ-CD1 3.92Å; F273-P308 HydrophobicContact CD1-CG 4.16Å; F273-W318 AromaticContact CE1-CD2 3.92Å; F273-W318 HydrophobicContact CE1-CD2 3.92Å; F273-W318 AromaticContact CE1-CE3 3.64Å; F273-W318 HydrophobicContact CE1-CE3 3.64Å; F273-W318 HydrophobicContact CE1-CG 4.47Å; F273-W318 HydrophobicContact CE1-CH2 4.36Å; F273-W318 AromaticContact CE1-CZ3 3.88Å; F273-W318 HydrophobicContact CE1-CZ3 3.88Å; F273-W318 HydrophobicContact CZ-CB 4.24Å; F273-W318 AromaticContact CZ-CD2 3.84Å; F273-W318 HydrophobicContact CZ-CD2 3.84Å; F273-W318 HydrophobicContact CZ-CE3 4.04Å; F273-W318 AromaticContact CZ-CG 3.96Å; F273-W318 HydrophobicContact CZ-CG 3.96Å; F273-F322 HydrophobicContact CE2-CD2 4.33Å; F273-F322 HydrophobicContact CE2-CE2 4.43Å; F273-F322 HydrophobicContact CZ-CE2 4.42Å; F273-I324 HydrophobicContact CD2-CD1 3.82Å; F273-I324 HydrophobicContact CE2-CD1 3.74Å; F273-L326 HydrophobicContact CB-CD2 3.74Å; F273-L326 HydrophobicContact CD1-CD1 4.44Å; F273-L326 HydrophobicContact CD1-CD2 3.67Å; F273-L326 HydrophobicContact CD2-CD2 3.5Å; F273-L326 HydrophobicContact CE1-CD1 4.28Å; F273-L326 HydrophobicContact CE1-CD2 4.07Å; F273-L326 HydrophobicContact CE2-CD2 3.91Å; F273-L326 HydrophobicContact CG-CD2 3.36Å; F273-L326 HydrophobicContact CZ-CD2 4.18Å; F273-P329 CarbonylContact O-C 3.54Å; F273-P329 VanDerWaalsContact O-CA 3.28Å; F273-P329 WeakPolarHBondContact O-CA 3.3Å; F273-Q330 HydrophobicContact CB-CB 4.17Å; F273-Q330 HydrophobicContact CD2-CB 4.3Å; F273-Q330 PolarHBondContact N-O 3.47Å; F273-Q330 PolarHBondContact O-N 3.44Å; F273-W343 AromaticContact CD2-CH2 3.72Å; F273-W343 HydrophobicContact CD2-CH2 3.72Å; F273-W343 AromaticContact CD2-CZ3 3.82Å; F273-W343 HydrophobicContact CD2-CZ3 3.82Å; F273-W343 AromaticContact CE2-CH2 3.47Å; F273-W343 HydrophobicContact CE2-CH2 3.47Å; F273-W343 VanDerWaalsContact CE2-CH2 3.47Å; F273-W343 HydrophobicContact CE2-CZ2 4.27Å; F273-W343 HydrophobicContact CE2-CZ3 4.08Å
274	A	97.6	Very high	96.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	25%	0.254	C	S	.	.			trans	-157.6	127.9	172.1	0	0	0	0	0	109.9	F284 W305 I306 D307	A274-F284 HydrophobicContact CB-CD1 4.07Å; A274-W305 PolarHBondContact O-NE1 2.91Å; A274-I306 PolarHBondContact N-O 3.3Å; A274-D307 WeakPolarHBondContact O-CA 3.21Å
275	E	97.3	Very high	96.4	Very high	57 Å²	57	46.9 Å²	46.9	27%	0.266	24%	0.24	S	C	.	.			trans	-79.6	118	172.3	-177.9	-175.5	157.2	0	0	108.8	D277 D278 G281	E275-D277 VanDerWaalsContact C-N 3.26Å; E275-D277 PolarHBondContact O-N 3.01Å; E275-D278 HydrophobicContact CB-CB 3.96Å; E275-D278 HydrophobicContact CG-CB 4.03Å; E275-D278 PolarHBondContact O-N 3.03Å; E275-G281 CarbonylContact O-C 3.46Å; E275-G281 VanDerWaalsContact O-CA 3.29Å; E275-G281 WeakPolarHBondContact O-CA 3.29Å
276	E	95.8	Very high	96.6	Very high	67 Å²	67	49 Å²	49	31%	0.313	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-33.8	-176.3	-171.4	-174.3	-172.8	0	0	112.3	D278 L285 W305 D307	E276-D278 VanDerWaalsContact C-N 3.34Å; E276-L285 HydrophobicContact CG-CD2 4.17Å; E276-W305 HydrophobicContact CB-CH2 4.27Å; E276-W305 HydrophobicContact CB-CZ2 4.1Å; E276-D307 PolarHBondContact N-OD2 3.2Å
277	D	95.3	Very high	96.9	Very high	146 Å²	146	40.8 Å²	40.8	78%	0.781	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-13.3	-177.7	-86.1	-27.5	0	0	0	113.4	E275	E275-D277 VanDerWaalsContact C-N 3.26Å; E275-D277 PolarHBondContact O-N 3.01Å
278	D	95.9	Very high	97.2	Very high	47 Å²	47	40 Å²	40	25%	0.251	20%	0.204	S	C	.	.	S	Bend	trans	-85.9	137.1	173.6	-179.6	73.5	0	0	0	111.1	E275 E276 D280 G281 F282	E275-D278 HydrophobicContact CB-CB 3.96Å; E275-D278 HydrophobicContact CG-CB 4.03Å; E275-D278 PolarHBondContact O-N 3.03Å; E276-D278 VanDerWaalsContact C-N 3.34Å; D278-D280 VanDerWaalsContact C-N 3.31Å; D278-D280 PolarHBondContact O-N 2.8Å; D278-D280 WeakPolarHBondContact OD2-CB 3.41Å; D278-D280 PolarHBondContact OD2-N 3.37Å; D278-G281 PolarHBondContact O-N 3Å; D278-G281 PolarHBondContact OD2-N 3.02Å; D278-G281 VanDerWaalsContact OD2-N 3.15Å; D278-F282 WeakPolarHBondContact O-CB 3.38Å; D278-F282 PolarHBondContact O-N 3.41Å
279	P	95.5	Very high	97.3	Very high	93 Å²	93	38 Å²	38	60%	0.604	19%	0.193	S	C	*	.	H	α-helix	trans	-57	-38.4	-178.8	-27.1	36.5	0	0	0	115	E283	P279-E283 PolarHBondContact O-N 3.27Å; P279-E283 VanDerWaalsContact O-N 3.11Å
280	D	94.9	Very high	97.3	Very high	52 Å²	52	41.5 Å²	41.5	28%	0.278	21%	0.21	S	C	.	.	H	α-helix	trans	-80.4	-38.1	-176.3	-54.6	-34.7	0	0	0	109.4	D278 E283 F284 P329	D278-D280 VanDerWaalsContact C-N 3.31Å; D278-D280 PolarHBondContact O-N 2.8Å; D278-D280 WeakPolarHBondContact OD2-CB 3.41Å; D278-D280 PolarHBondContact OD2-N 3.37Å; D280-E283 PolarHBondContact O-N 3.31Å; D280-F284 WeakPolarHBondContact O-CB 3.34Å; D280-F284 PolarHBondContact O-N 3.22Å; D280-P329 HydrophobicContact CB-CG 4.38Å
281	G	96.4	Very high	97.3	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-44.8	169.4	0	0	0	0	0	113.2	E275 D278 F284 L285	E275-G281 CarbonylContact O-C 3.46Å; E275-G281 VanDerWaalsContact O-CA 3.29Å; E275-G281 WeakPolarHBondContact O-CA 3.29Å; D278-G281 PolarHBondContact O-N 3Å; D278-G281 PolarHBondContact OD2-N 3.02Å; D278-G281 VanDerWaalsContact OD2-N 3.15Å; G281-F284 PolarHBondContact O-N 3.26Å; G281-L285 WeakPolarHBondContact O-CB 3.46Å; G281-L285 PolarHBondContact O-N 3.15Å
282	F	96.9	Very high	97.2	Very high	98 Å²	98	41.1 Å²	41.1	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-62.2	-45.4	175	-178.4	-92.9	0	0	0	112.4	D278 F284 L285 E286	D278-F282 WeakPolarHBondContact O-CB 3.38Å; D278-F282 PolarHBondContact O-N 3.41Å; F282-F284 VanDerWaalsContact C-N 3.35Å; F282-F284 PolarHBondContact O-N 2.95Å; F282-L285 PolarHBondContact O-N 3.38Å; F282-E286 HydrophobicContact CD1-CG 4.34Å; F282-E286 HydrophobicContact CE1-CG 3.81Å; F282-E286 HydrophobicContact CZ-CG 3.9Å; F282-E286 WeakPolarHBondContact O-CG 3.34Å; F282-E286 PolarHBondContact O-N 3.01Å
283	E	96.9	Very high	97.2	Very high	116 Å²	116	44 Å²	44	54%	0.542	22%	0.218	S	C	.	.	H	α-helix	trans	-61.8	-44	177.6	-178.3	165	-177.2	0	0	111.3	P279 D280 E286 I287 L352	P279-E283 PolarHBondContact O-N 3.27Å; P279-E283 VanDerWaalsContact O-N 3.11Å; D280-E283 PolarHBondContact O-N 3.31Å; E283-E286 PolarHBondContact O-N 3.25Å; E283-I287 HydrophobicContact CG-CD1 4.38Å; E283-I287 WeakPolarHBondContact O-CG1 3.33Å; E283-I287 PolarHBondContact O-N 2.93Å; E283-L352 HydrophobicContact CB-CD1 3.9Å; E283-L352 HydrophobicContact CG-CD1 3.85Å
284	F	97.6	Very high	97.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-40.3	176.1	-171.2	-113.1	0	0	0	112.7	A272 A274 D280 G281 F282 E286 I287 L288 P329 I331 I346 L352 P353	A272-F284 HydrophobicContact CB-CE1 4.35Å; A274-F284 HydrophobicContact CB-CD1 4.07Å; D280-F284 WeakPolarHBondContact O-CB 3.34Å; D280-F284 PolarHBondContact O-N 3.22Å; G281-F284 PolarHBondContact O-N 3.26Å; F282-F284 VanDerWaalsContact C-N 3.35Å; F282-F284 PolarHBondContact O-N 2.95Å; F284-E286 VanDerWaalsContact C-N 3.34Å; F284-E286 PolarHBondContact O-N 2.97Å; F284-I287 WeakPolarHBondContact O-CB 3.31Å; F284-I287 PolarHBondContact O-N 3.15Å; F284-I287 VanDerWaalsContact O-N 3.15Å; F284-L288 HydrophobicContact CD1-CD1 3.75Å; F284-L288 HydrophobicContact CD1-CG 4.24Å; F284-L288 HydrophobicContact CE1-CD1 3.69Å; F284-L288 HydrophobicContact CE1-CD2 4.32Å; F284-L288 HydrophobicContact CE1-CG 4.06Å; F284-L288 HydrophobicContact CZ-CD2 4.42Å; F284-L288 HydrophobicContact CZ-CG 4.43Å; F284-L288 PolarHBondContact O-N 3.33Å; F284-P329 HydrophobicContact CB-CB 3.67Å; F284-P329 HydrophobicContact CB-CG 3.9Å; F284-P329 HydrophobicContact CD1-CB 3.56Å; F284-P329 HydrophobicContact CD2-CB 4.19Å; F284-P329 HydrophobicContact CE1-CB 4.17Å; F284-P329 HydrophobicContact CG-CB 3.54Å; F284-P329 HydrophobicContact CG-CG 4.32Å; F284-I331 HydrophobicContact CE1-CB 4.43Å; F284-I331 HydrophobicContact CZ-CB 3.95Å; F284-I331 HydrophobicContact CZ-CG2 4Å; F284-I346 HydrophobicContact CE2-CD1 4.3Å; F284-I346 HydrophobicContact CZ-CD1 4.46Å; F284-L352 HydrophobicContact CB-CD1 4.23Å; F284-L352 HydrophobicContact CB-CD2 4.34Å; F284-L352 HydrophobicContact CD2-CD2 4.2Å; F284-P353 HydrophobicContact CD2-CG 4.32Å; F284-P353 HydrophobicContact CE2-CG 3.74Å
285	L	97.9	Very high	97.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-41.5	175.4	179.4	61.8	0	0	0	111.8	E276 G281 F282 I287 L288 K289 W305	E276-L285 HydrophobicContact CG-CD2 4.17Å; G281-L285 WeakPolarHBondContact O-CB 3.46Å; G281-L285 PolarHBondContact O-N 3.15Å; F282-L285 PolarHBondContact O-N 3.38Å; L285-I287 VanDerWaalsContact C-N 3.27Å; L285-I287 PolarHBondContact O-N 3.08Å; L285-L288 HydrophobicContact CD1-CD1 4.46Å; L285-L288 WeakPolarHBondContact O-CB 3.48Å; L285-L288 PolarHBondContact O-N 3.5Å; L285-K289 HydrophobicContact CD1-CG 4.47Å; L285-K289 WeakPolarHBondContact O-CG 3.42Å; L285-K289 PolarHBondContact O-N 3.24Å; L285-W305 HydrophobicContact CD1-CD2 3.59Å; L285-W305 HydrophobicContact CD1-CE3 3.73Å; L285-W305 HydrophobicContact CD1-CG 4.1Å; L285-W305 HydrophobicContact CD1-CH2 4.2Å; L285-W305 HydrophobicContact CD1-CZ2 4.09Å; L285-W305 HydrophobicContact CD1-CZ3 4.02Å; L285-W305 HydrophobicContact CD2-CE3 4.47Å; L285-W305 HydrophobicContact CD2-CH2 3.46Å; L285-W305 VanDerWaalsContact CD2-CH2 3.46Å; L285-W305 HydrophobicContact CD2-CZ2 3.57Å; L285-W305 HydrophobicContact CD2-CZ3 3.93Å; L285-W305 HydrophobicContact CG-CH2 4.48Å; L285-W305 HydrophobicContact CG-CZ2 4.4Å
286	E	98	Very high	97	Very high	75 Å²	75	49.5 Å²	49.5	35%	0.35	25%	0.252	S	S	.	.	H	α-helix	trans	-64.6	-32.8	175.7	-70.7	-65	118.8	0	0	112.3	F282 E283 F284 K289 Q290	F282-E286 HydrophobicContact CD1-CG 4.34Å; F282-E286 HydrophobicContact CE1-CG 3.81Å; F282-E286 HydrophobicContact CZ-CG 3.9Å; F282-E286 WeakPolarHBondContact O-CG 3.34Å; F282-E286 PolarHBondContact O-N 3.01Å; E283-E286 PolarHBondContact O-N 3.25Å; F284-E286 VanDerWaalsContact C-N 3.34Å; F284-E286 PolarHBondContact O-N 2.97Å; E286-K289 IonicContact OE1-NZ 3.49Å; E286-K289 PolarHBondContact OE1-NZ 3.42Å; E286-Q290 PolarHBondContact O-N 2.83Å
287	I	98.1	Very high	97	Very high	26 Å²	26	53.9 Å²	53.9	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-45.9	171.3	-65	155.7	0	0	0	110.5	E283 F284 L285 K289 Q290 V291 L352 P353 A355 L358	E283-I287 HydrophobicContact CG-CD1 4.38Å; E283-I287 WeakPolarHBondContact O-CG1 3.33Å; E283-I287 PolarHBondContact O-N 2.93Å; F284-I287 WeakPolarHBondContact O-CB 3.31Å; F284-I287 PolarHBondContact O-N 3.15Å; F284-I287 VanDerWaalsContact O-N 3.15Å; L285-I287 VanDerWaalsContact C-N 3.27Å; L285-I287 PolarHBondContact O-N 3.08Å; I287-K289 PolarHBondContact O-N 3.3Å; I287-Q290 WeakPolarHBondContact O-CB 3.48Å; I287-Q290 PolarHBondContact O-N 2.99Å; I287-Q290 VanDerWaalsContact O-N 3.16Å; I287-V291 PolarHBondContact O-N 3.34Å; I287-L352 HydrophobicContact CD1-CB 4.37Å; I287-P353 VanDerWaalsContact CD1-O 3.24Å; I287-P353 WeakPolarHBondContact CD1-O 3.36Å; I287-A355 HydrophobicContact CG2-CB 4.28Å; I287-L358 HydrophobicContact CG2-CD2 3.86Å
288	L	98.1	Very high	97	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-46.1	175.6	-72.2	166.5	0	0	0	111.8	L249 A272 F284 L285 Q290 V291 A292 I303 I331 L358	L249-L288 HydrophobicContact CD2-CB 4.24Å; A272-L288 HydrophobicContact CB-CD1 3.61Å; A272-L288 HydrophobicContact CB-CD2 3.96Å; A272-L288 HydrophobicContact CB-CG 4.48Å; F284-L288 HydrophobicContact CD1-CD1 3.75Å; F284-L288 HydrophobicContact CD1-CG 4.24Å; F284-L288 HydrophobicContact CE1-CD1 3.69Å; F284-L288 HydrophobicContact CE1-CD2 4.32Å; F284-L288 HydrophobicContact CE1-CG 4.06Å; F284-L288 HydrophobicContact CZ-CD2 4.42Å; F284-L288 HydrophobicContact CZ-CG 4.43Å; F284-L288 PolarHBondContact O-N 3.33Å; L285-L288 HydrophobicContact CD1-CD1 4.46Å; L285-L288 WeakPolarHBondContact O-CB 3.48Å; L285-L288 PolarHBondContact O-N 3.5Å; L288-Q290 VanDerWaalsContact C-N 3.28Å; L288-Q290 PolarHBondContact O-N 3.22Å; L288-V291 PolarHBondContact O-N 3.11Å; L288-A292 WeakPolarHBondContact O-CB 3.47Å; L288-A292 PolarHBondContact O-N 2.84Å; L288-I303 HydrophobicContact CD2-CG2 4.43Å; L288-I331 HydrophobicContact CD2-CD1 4.02Å; L288-L358 HydrophobicContact CD2-CD2 3.84Å; L288-L358 HydrophobicContact CG-CD2 4.44Å
289	K	98.3	Very high	97	Very high	8 Å²	8	51.9 Å²	51.9	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-40	176.3	-68.2	-176.8	-170.4	-177.7	0	111.1	D162 F220 L249 L285 E286 I287 R293	D162-K289 IonicContact OD2-NZ 3.43Å; D162-K289 PolarHBondContact OD2-NZ 2.83Å; F220-K289 HydrophobicContact CB-CD 4.41Å; F220-K289 HydrophobicContact CB-CG 4.05Å; F220-K289 HydrophobicContact CD1-CD 3.88Å; F220-K289 HydrophobicContact CD1-CG 4.01Å; F220-K289 HydrophobicContact CG-CD 4.48Å; F220-K289 HydrophobicContact CG-CG 4.19Å; L249-K289 HydrophobicContact CD2-CG 3.99Å; L285-K289 HydrophobicContact CD1-CG 4.47Å; L285-K289 WeakPolarHBondContact O-CG 3.42Å; L285-K289 PolarHBondContact O-N 3.24Å; E286-K289 IonicContact OE1-NZ 3.49Å; E286-K289 PolarHBondContact OE1-NZ 3.42Å; I287-K289 PolarHBondContact O-N 3.3Å; K289-R293 WeakPolarHBondContact O-CD 3.42Å; K289-R293 WeakPolarHBondContact O-CG 3.4Å; K289-R293 PolarHBondContact O-N 2.96Å
290	Q	98.1	Very high	97	Very high	75 Å²	75	52.4 Å²	52.4	35%	0.35	27%	0.27	S	S	.	.	H	α-helix	trans	-65	-48.7	176.5	-177.2	58.7	43.3	0	0	112	E286 I287 L288 A292 R293 D294 A355	E286-Q290 PolarHBondContact O-N 2.83Å; I287-Q290 WeakPolarHBondContact O-CB 3.48Å; I287-Q290 PolarHBondContact O-N 2.99Å; I287-Q290 VanDerWaalsContact O-N 3.16Å; L288-Q290 VanDerWaalsContact C-N 3.28Å; L288-Q290 PolarHBondContact O-N 3.22Å; Q290-A292 VanDerWaalsContact C-N 3.31Å; Q290-A292 PolarHBondContact O-N 2.91Å; Q290-R293 PolarHBondContact O-N 3.36Å; Q290-D294 PolarHBondContact NE2-OD1 3.13Å; Q290-D294 PolarHBondContact NE2-OD2 3.42Å; Q290-D294 PolarHBondContact O-N 3.29Å; Q290-A355 HydrophobicContact CG-CB 4.22Å
291	V	98.1	Very high	97.1	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-41.8	178.5	172.1	0	0	0	0	111.4	I287 L288 R293 D294 N295 A355 L358 E359 I362	I287-V291 PolarHBondContact O-N 3.34Å; L288-V291 PolarHBondContact O-N 3.11Å; V291-R293 PolarHBondContact O-N 3.15Å; V291-D294 PolarHBondContact O-N 2.89Å; V291-N295 WeakPolarHBondContact O-CB 3.43Å; V291-N295 PolarHBondContact O-N 3.23Å; V291-N295 VanDerWaalsContact O-N 3.08Å; V291-N295 PolarHBondContact O-ND2 2.77Å; V291-N295 VanDerWaalsContact O-ND2 3.15Å; V291-A355 HydrophobicContact CG2-CB 3.86Å; V291-A355 WeakPolarHBondContact CG2-O 3.39Å; V291-L358 HydrophobicContact CB-CD2 4.49Å; V291-L358 HydrophobicContact CG2-CB 4.15Å; V291-L358 HydrophobicContact CG2-CD2 3.94Å; V291-L358 HydrophobicContact CG2-CG 4.16Å; V291-E359 HydrophobicContact CG1-CB 4.47Å; V291-I362 HydrophobicContact CG1-CD1 3.91Å
292	A	98	Very high	97.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-43.1	176.3	0	0	0	0	0	112.1	M221 T248 L249 L288 Q290 N295 T296	M221-A292 HydrophobicContact CE-CB 4.24Å; T248-A292 HydrophobicContact CG2-CB 4Å; L249-A292 HydrophobicContact CB-CB 3.65Å; L249-A292 HydrophobicContact CD2-CB 4.34Å; L288-A292 WeakPolarHBondContact O-CB 3.47Å; L288-A292 PolarHBondContact O-N 2.84Å; Q290-A292 VanDerWaalsContact C-N 3.31Å; Q290-A292 PolarHBondContact O-N 2.91Å; A292-N295 CarbonylContact O-C 3.55Å; A292-N295 PolarHBondContact O-N 3.23Å; A292-T296 WeakPolarHBondContact O-CA 3.39Å; A292-T296 PolarHBondContact O-N 2.87Å
293	R	97.7	Very high	97.2	Very high	59 Å²	59	45.7 Å²	45.7	22%	0.223	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-41.4	176.1	-72.9	167.5	-168.1	147.2	0.5	112.5	F220 M221 D222 K289 Q290 V291 N295 T296	F220-R293 PolarHBondContact O-NE 2.8Å; F220-R293 PolarHBondContact O-NH2 2.83Å; F220-R293 VanDerWaalsContact O-NH2 3.09Å; M221-R293 HydrophobicContact SD-CB 4.31Å; M221-R293 HydrophobicContact SD-CG 3.65Å; D222-R293 IonicContact OD1-CZ 2.89Å; D222-R293 IonicContact OD1-NH2 3.13Å; D222-R293 IonicContact OD2-NE 2.78Å; K289-R293 WeakPolarHBondContact O-CD 3.42Å; K289-R293 WeakPolarHBondContact O-CG 3.4Å; K289-R293 PolarHBondContact O-N 2.96Å; Q290-R293 PolarHBondContact O-N 3.36Å; V291-R293 PolarHBondContact O-N 3.15Å; R293-N295 PolarHBondContact O-N 3.48Å; R293-T296 WeakPolarHBondContact O-CG2 3.33Å
294	D	97.2	Very high	97.3	Very high	95 Å²	95	40.1 Å²	40.1	51%	0.508	21%	0.213	S	C	.	.	H	α-helix	trans	-68.7	-23.8	-179.9	-70.2	-25.3	0	0	0	112	Q290 V291	Q290-D294 PolarHBondContact NE2-OD1 3.13Å; Q290-D294 PolarHBondContact NE2-OD2 3.42Å; Q290-D294 PolarHBondContact O-N 3.29Å; V291-D294 PolarHBondContact O-N 2.89Å
295	N	96.8	Very high	97.4	Very high	31 Å²	31	40.1 Å²	40.1	17%	0.166	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	14.8	-176.8	-72.1	-83.9	0	0	0	114.9	V291 A292 R293 D297 N298 L301 E359	V291-N295 WeakPolarHBondContact O-CB 3.43Å; V291-N295 PolarHBondContact O-N 3.23Å; V291-N295 VanDerWaalsContact O-N 3.08Å; V291-N295 PolarHBondContact O-ND2 2.77Å; V291-N295 VanDerWaalsContact O-ND2 3.15Å; A292-N295 CarbonylContact O-C 3.55Å; A292-N295 PolarHBondContact O-N 3.23Å; R293-N295 PolarHBondContact O-N 3.48Å; N295-D297 PolarHBondContact O-N 2.87Å; N295-D297 VanDerWaalsContact O-N 3.13Å; N295-N298 VanDerWaalsContact O-CB 3.27Å; N295-N298 WeakPolarHBondContact O-CB 3.38Å; N295-N298 PolarHBondContact O-N 2.94Å; N295-L301 HydrophobicContact CB-CD2 3.5Å; N295-E359 PolarHBondContact ND2-OE1 3.22Å; N295-E359 PolarHBondContact OD1-OE1 3.43Å
296	T	96.3	Very high	97.4	Very high	49 Å²	49	40.2 Å²	40.2	30%	0.301	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.5	-174.9	-174.5	0	0	0	0	114.2	E218 T248 A292 R293 N298	E218-T296 PolarHBondContact OE2-OG1 2.88Å; T248-T296 WeakPolarHBondContact OG1-CA 3.44Å; A292-T296 WeakPolarHBondContact O-CA 3.39Å; A292-T296 PolarHBondContact O-N 2.87Å; R293-T296 WeakPolarHBondContact O-CG2 3.33Å; T296-N298 PolarHBondContact O-N 2.81Å
297	D	94.8	Very high	97.4	Very high	160 Å²	160	37.1 Å²	37.1	86%	0.856	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-2.9	177.2	-72.4	-39.5	0	0	0	113.3	N295 P299	N295-D297 PolarHBondContact O-N 2.87Å; N295-D297 VanDerWaalsContact O-N 3.13Å; D297-P299 VanDerWaalsContact O-CD 3.29Å; D297-P299 WeakPolarHBondContact O-CD 3.46Å
298	N	96.2	Very high	97.4	Very high	47 Å²	47	36.1 Å²	36.1	25%	0.251	19%	0.194	S	C	.	.			trans	-90	105.2	179.1	-173.8	-0.2	0	0	0	110.8	N295 T296 D300 L301	N295-N298 VanDerWaalsContact O-CB 3.27Å; N295-N298 WeakPolarHBondContact O-CB 3.38Å; N295-N298 PolarHBondContact O-N 2.94Å; T296-N298 PolarHBondContact O-N 2.81Å; N298-D300 PolarHBondContact O-N 2.83Å; N298-D300 WeakPolarHBondContact OD1-CB 3.41Å; N298-D300 PolarHBondContact OD1-N 2.76Å; N298-L301 HydrophobicContact CB-CB 4.2Å; N298-L301 PolarHBondContact O-N 2.82Å
299	P	94.6	Very high	97.4	Very high	103 Å²	103	40.5 Å²	40.5	67%	0.669	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-14.1	-178.3	32.8	-37.7	0	0	0	113.2	D297 L301	D297-P299 VanDerWaalsContact O-CD 3.29Å; D297-P299 WeakPolarHBondContact O-CD 3.46Å; P299-L301 VanDerWaalsContact C-N 3.3Å
300	D	95.1	Very high	97.4	Very high	104 Å²	104	43.1 Å²	43.1	56%	0.556	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.7	-179.8	-58	-35.4	0	0	0	111.7	M265 N298 L366	M265-D300 VanDerWaalsContact CE-CA 3.44Å; M265-D300 HydrophobicContact CE-CB 4.47Å; M265-D300 WeakPolarHBondContact CE-O 3.47Å; N298-D300 PolarHBondContact O-N 2.83Å; N298-D300 WeakPolarHBondContact OD1-CB 3.41Å; N298-D300 PolarHBondContact OD1-N 2.76Å; D300-L366 VanDerWaalsContact O-CD2 3.26Å; D300-L366 WeakPolarHBondContact O-CD2 3.47Å
301	L	97.3	Very high	97.4	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.031	22%	0.216	C	C	.	.			trans	-112.9	122.3	178	179.2	60.4	0	0	0	111.7	T248 I270 N295 N298 P299 I303 I362 L366	T248-L301 HydrophobicContact CG2-CB 4.49Å; T248-L301 HydrophobicContact CG2-CD2 3.74Å; T248-L301 HydrophobicContact CG2-CG 3.89Å; I270-L301 HydrophobicContact CD1-CD1 3.83Å; N295-L301 HydrophobicContact CB-CD2 3.5Å; N298-L301 HydrophobicContact CB-CB 4.2Å; N298-L301 PolarHBondContact O-N 2.82Å; P299-L301 VanDerWaalsContact C-N 3.3Å; L301-I303 HydrophobicContact CD1-CD1 4.31Å; L301-I303 HydrophobicContact CD1-CG1 3.9Å; L301-I362 HydrophobicContact CD1-CG2 3.59Å; L301-I362 HydrophobicContact CD2-CG2 4.49Å; L301-L366 HydrophobicContact CB-CD1 4.32Å; L301-L366 HydrophobicContact CD1-CD1 4.4Å
302	S	98.4	Very high	97.3	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.028	24%	0.242	C	C	.	.			trans	-145	124.8	164.4	-168.3	0	0	0	0	109.7	A247 T248 R250 M265	A247-S302 PolarHBondContact O-OG 3.36Å; T248-S302 CarbonylContact O-C 3.44Å; T248-S302 WeakPolarHBondContact O-CA 3.31Å; R250-S302 PolarHBondContact NE-OG 2.85Å; M265-S302 VanDerWaalsContact SD-CB 3.53Å
303	I	98.8	Very high	97.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.6	-179.9	-54.7	171.5	0	0	0	108.2	T248 L249 R250 I270 A272 L288 L301 I362	T248-I303 PolarHBondContact O-N 3.43Å; L249-I303 HydrophobicContact CD1-CB 3.85Å; L249-I303 HydrophobicContact CD1-CG2 3.84Å; R250-I303 WeakPolarHBondContact CG-O 3.39Å; R250-I303 PolarHBondContact N-O 2.87Å; I270-I303 HydrophobicContact CB-CG1 4.42Å; I270-I303 HydrophobicContact CG2-CG1 4.12Å; I270-I303 HydrophobicContact CG2-CG2 4.25Å; I270-I303 WeakPolarHBondContact O-CA 3.24Å; A272-I303 HydrophobicContact CB-CG2 4.09Å; L288-I303 HydrophobicContact CD2-CG2 4.43Å; L301-I303 HydrophobicContact CD1-CD1 4.31Å; L301-I303 HydrophobicContact CD1-CG1 3.9Å; I303-I362 HydrophobicContact CD1-CD1 3.76Å
304	V	98.8	Very high	97.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	105.3	172.1	-177.7	0	0	0	0	108.3	R250 L252 T260 I270 V271 A272 I306	R250-V304 HydrophobicContact CG-CG2 4.21Å; R250-V304 CarbonylContact O-C 3.57Å; R250-V304 WeakPolarHBondContact O-CA 3.37Å; L252-V304 HydrophobicContact CB-CG1 3.88Å; L252-V304 HydrophobicContact CD1-CG1 4.24Å; T260-V304 HydrophobicContact CG2-CG1 4.31Å; T260-V304 HydrophobicContact CG2-CG2 4.3Å; I270-V304 PolarHBondContact O-N 3.34Å; V271-V304 CarbonylContact C-O 3.56Å; V271-V304 WeakPolarHBondContact CA-O 3.38Å; A272-V304 PolarHBondContact N-O 2.82Å; V304-I306 HydrophobicContact CG1-CG1 4.08Å
305	W	98.8	Very high	97.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	130.1	169	169.2	42.8	0	0	0	109.9	E163 F220 L249 R250 K251 L252 A272 A274 E276 L285 D307	E163-W305 WeakPolarHBondContact OE1-CH2 3.3Å; E163-W305 WeakPolarHBondContact OE1-CZ3 3.26Å; F220-W305 HydrophobicContact CE1-CE3 4.3Å; F220-W305 HydrophobicContact CE1-CZ3 4.02Å; F220-W305 HydrophobicContact CE2-CE3 4.48Å; F220-W305 AromaticContact CZ-CE3 3.69Å; F220-W305 HydrophobicContact CZ-CE3 3.69Å; F220-W305 AromaticContact CZ-CZ3 3.75Å; F220-W305 HydrophobicContact CZ-CZ3 3.75Å; L249-W305 HydrophobicContact CD1-CB 3.95Å; R250-W305 PolarHBondContact O-N 3.1Å; K251-W305 CarbonylContact C-O 3.47Å; K251-W305 WeakPolarHBondContact CA-O 3.42Å; K251-W305 HydrophobicContact CB-CE3 3.99Å; K251-W305 HydrophobicContact CB-CZ3 4.36Å; K251-W305 HydrophobicContact CD-CE3 4.04Å; K251-W305 HydrophobicContact CD-CH2 4.15Å; K251-W305 HydrophobicContact CD-CZ3 3.66Å; K251-W305 HydrophobicContact CG-CD2 4.45Å; K251-W305 HydrophobicContact CG-CE3 3.88Å; K251-W305 HydrophobicContact CG-CZ3 4.05Å; L252-W305 PolarHBondContact N-O 3.08Å; A272-W305 CarbonylContact O-C 3.46Å; A272-W305 WeakPolarHBondContact O-CA 3.32Å; A274-W305 PolarHBondContact O-NE1 2.91Å; E276-W305 HydrophobicContact CB-CH2 4.27Å; E276-W305 HydrophobicContact CB-CZ2 4.1Å; L285-W305 HydrophobicContact CD1-CD2 3.59Å; L285-W305 HydrophobicContact CD1-CE3 3.73Å; L285-W305 HydrophobicContact CD1-CG 4.1Å; L285-W305 HydrophobicContact CD1-CH2 4.2Å; L285-W305 HydrophobicContact CD1-CZ2 4.09Å; L285-W305 HydrophobicContact CD1-CZ3 4.02Å; L285-W305 HydrophobicContact CD2-CE3 4.47Å; L285-W305 HydrophobicContact CD2-CH2 3.46Å; L285-W305 VanDerWaalsContact CD2-CH2 3.46Å; L285-W305 HydrophobicContact CD2-CZ2 3.57Å; L285-W305 HydrophobicContact CD2-CZ3 3.93Å; L285-W305 HydrophobicContact CG-CH2 4.48Å; L285-W305 HydrophobicContact CG-CZ2 4.4Å; W305-D307 HydrophobicContact CZ2-CB 4.19Å
306	I	98.8	Very high	97.3	Very high	1 Å²	1	51 Å²	51	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.8	175.3	-52.1	179.3	0	0	0	107.5	L252 V271 A272 F273 A274 V304 P308 F311 W318	L252-I306 HydrophobicContact CB-CG1 3.86Å; L252-I306 HydrophobicContact CD2-CD1 3.69Å; L252-I306 HydrophobicContact CD2-CG1 3.81Å; L252-I306 HydrophobicContact CD2-CG2 4.33Å; L252-I306 HydrophobicContact CG-CG1 4.48Å; V271-I306 HydrophobicContact CG1-CD1 3.62Å; V271-I306 HydrophobicContact CG1-CG1 4.15Å; A272-I306 PolarHBondContact O-N 3.46Å; F273-I306 WeakPolarHBondContact CA-O 3.34Å; F273-I306 HydrophobicContact CD1-CB 3.69Å; F273-I306 HydrophobicContact CD1-CD1 4.49Å; F273-I306 HydrophobicContact CD1-CG2 3.91Å; F273-I306 HydrophobicContact CE1-CB 3.72Å; F273-I306 HydrophobicContact CE1-CD1 3.77Å; F273-I306 HydrophobicContact CE1-CG1 4.29Å; F273-I306 HydrophobicContact CE1-CG2 3.66Å; F273-I306 HydrophobicContact CZ-CD1 3.92Å; A274-I306 PolarHBondContact N-O 3.3Å; V304-I306 HydrophobicContact CG1-CG1 4.08Å; I306-P308 WeakPolarHBondContact O-CD 3.42Å; I306-F311 HydrophobicContact CG2-CD2 3.88Å; I306-F311 HydrophobicContact CG2-CE2 4.15Å; I306-W318 HydrophobicContact CD1-CZ2 4.44Å; I306-W318 HydrophobicContact CG2-CH2 3.75Å; I306-W318 HydrophobicContact CG2-CZ2 4.5Å; I306-W318 HydrophobicContact CG2-CZ3 4.05Å
307	D	98.5	Very high	97.3	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.059	30%	0.296	C	S	.	.			trans	-81	116.8	162.3	-165.2	-39.1	0	0	0	108.4	A274 E276 W305 D309 D310	A274-D307 WeakPolarHBondContact O-CA 3.21Å; E276-D307 PolarHBondContact N-OD2 3.2Å; W305-D307 HydrophobicContact CZ2-CB 4.19Å; D307-D309 PolarHBondContact O-N 3.38Å; D307-D309 WeakPolarHBondContact OD1-CB 3.18Å; D307-D309 PolarHBondContact OD1-N 3.21Å; D307-D310 PolarHBondContact O-N 2.81Å
308	P	97.9	Very high	97.5	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.032	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-57.6	-28.6	179.6	-23.7	34.4	0	0	0	113.9	F273 I306 D310 F311 I315	F273-P308 HydrophobicContact CD1-CG 4.16Å; I306-P308 WeakPolarHBondContact O-CD 3.42Å; P308-D310 VanDerWaalsContact C-N 3.27Å; P308-D310 PolarHBondContact O-N 3.11Å; P308-F311 CarbonylContact O-C 3.58Å; P308-F311 PolarHBondContact O-N 3.33Å; P308-F311 VanDerWaalsContact O-N 3.1Å; P308-I315 HydrophobicContact CB-CD1 4.16Å; P308-I315 HydrophobicContact CB-CG1 4.12Å; P308-I315 WeakPolarHBondContact O-CD1 3.38Å
309	D	97.3	Very high	97.5	Very high	92 Å²	92	47.9 Å²	47.9	49%	0.492	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-70.3	-23.4	-177.4	-96.5	5.2	0	0	0	113.1	D307 F311 P312	D307-D309 PolarHBondContact O-N 3.38Å; D307-D309 WeakPolarHBondContact OD1-CB 3.18Å; D307-D309 PolarHBondContact OD1-N 3.21Å; D309-F311 VanDerWaalsContact C-N 3.26Å; D309-F311 PolarHBondContact O-N 2.94Å; D309-P312 WeakPolarHBondContact O-CD 2.97Å
310	D	97.6	Very high	97.7	Very high	62 Å²	62	50.2 Å²	50.2	33%	0.332	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-72.5	-21.8	173	-71.2	-24.4	0	0	0	111.9	K251 D307 P308 P312	K251-D310 VanDerWaalsContact CE-OD2 3.3Å; K251-D310 WeakPolarHBondContact CE-OD2 3.4Å; K251-D310 IonicContact NZ-OD2 2.82Å; D307-D310 PolarHBondContact O-N 2.81Å; P308-D310 VanDerWaalsContact C-N 3.27Å; P308-D310 PolarHBondContact O-N 3.11Å; D310-P312 VanDerWaalsContact C-CD 3.44Å; D310-P312 WeakPolarHBondContact O-CD 3.22Å
311	F	97.9	Very high	97.8	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.022	25%	0.245	C	C	.	.			trans	-129.3	58	-174.8	-57.4	-85	0	0	0	113.3	L252 P254 M257 I306 P308 D309 L313 L314 I315 W318	L252-F311 HydrophobicContact CB-CE2 4.31Å; L252-F311 HydrophobicContact CB-CZ 4.41Å; L252-F311 HydrophobicContact CD2-CE2 4.09Å; L252-F311 HydrophobicContact CD2-CZ 4.01Å; L252-F311 HydrophobicContact CG-CE2 4.17Å; L252-F311 HydrophobicContact CG-CZ 3.9Å; L252-F311 WeakPolarHBondContact O-CE2 3.37Å; P254-F311 HydrophobicContact CB-CE1 4.45Å; P254-F311 HydrophobicContact CG-CE1 4.08Å; P254-F311 HydrophobicContact CG-CZ 4.16Å; M257-F311 HydrophobicContact CB-CE1 4.28Å; M257-F311 HydrophobicContact CB-CZ 4.46Å; M257-F311 HydrophobicContact CE-CD1 4.2Å; M257-F311 HydrophobicContact CE-CE1 3.85Å; M257-F311 HydrophobicContact SD-CE1 3.93Å; I306-F311 HydrophobicContact CG2-CD2 3.88Å; I306-F311 HydrophobicContact CG2-CE2 4.15Å; P308-F311 CarbonylContact O-C 3.58Å; P308-F311 PolarHBondContact O-N 3.33Å; P308-F311 VanDerWaalsContact O-N 3.1Å; D309-F311 VanDerWaalsContact C-N 3.26Å; D309-F311 PolarHBondContact O-N 2.94Å; F311-L313 PolarHBondContact O-N 3.21Å; F311-L314 HydrophobicContact CB-CB 4.12Å; F311-L314 HydrophobicContact CB-CD1 4.21Å; F311-L314 HydrophobicContact CB-CG 4.38Å; F311-L314 HydrophobicContact CD1-CD1 4.08Å; F311-L314 HydrophobicContact CG-CD1 4.42Å; F311-L314 PolarHBondContact O-N 3.15Å; F311-I315 PolarHBondContact O-N 3.05Å; F311-W318 HydrophobicContact CB-CH2 3.41Å; F311-W318 VanDerWaalsContact CB-CH2 3.41Å; F311-W318 HydrophobicContact CB-CZ3 3.66Å; F311-W318 HydrophobicContact CD1-CH2 4.49Å; F311-W318 AromaticContact CD2-CH2 3.93Å; F311-W318 HydrophobicContact CD2-CH2 3.93Å; F311-W318 AromaticContact CG-CH2 3.71Å; F311-W318 HydrophobicContact CG-CH2 3.71Å; F311-W318 HydrophobicContact CG-CZ3 4.37Å
312	P	96.8	Very high	97.7	Very high	85 Å²	85	47.9 Å²	47.9	55%	0.552	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.7	-172.3	25.7	-35.6	0	0	0	113.7	D309 D310 L314	D309-P312 WeakPolarHBondContact O-CD 2.97Å; D310-P312 VanDerWaalsContact C-CD 3.44Å; D310-P312 WeakPolarHBondContact O-CD 3.22Å; P312-L314 VanDerWaalsContact C-N 3.34Å
313	L	96.9	Very high	97.6	Very high	145 Å²	145	55.6 Å²	55.6	76%	0.759	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-18.2	176.8	-61.1	-176.8	0	0	0	113.3	F311	F311-L313 PolarHBondContact O-N 3.21Å
314	L	97.8	Very high	97.5	Very high	52 Å²	52	56.6 Å²	56.6	27%	0.272	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-19.5	-177.5	-64.2	-177	0	0	0	113.6	M257 F311 P312 T316 Y317 W318	M257-L314 HydrophobicContact CE-CD1 3.92Å; F311-L314 HydrophobicContact CB-CB 4.12Å; F311-L314 HydrophobicContact CB-CD1 4.21Å; F311-L314 HydrophobicContact CB-CG 4.38Å; F311-L314 HydrophobicContact CD1-CD1 4.08Å; F311-L314 HydrophobicContact CG-CD1 4.42Å; F311-L314 PolarHBondContact O-N 3.15Å; P312-L314 VanDerWaalsContact C-N 3.34Å; L314-T316 PolarHBondContact O-N 3.04Å; L314-Y317 CarbonylContact O-C 3.46Å; L314-Y317 WeakPolarHBondContact O-CA 3.41Å; L314-Y317 WeakPolarHBondContact O-CB 3.44Å; L314-Y317 PolarHBondContact O-N 2.79Å; L314-W318 HydrophobicContact CB-CD2 3.85Å; L314-W318 HydrophobicContact CB-CE3 3.77Å; L314-W318 HydrophobicContact CB-CH2 3.56Å; L314-W318 HydrophobicContact CB-CZ2 3.62Å; L314-W318 HydrophobicContact CB-CZ3 3.62Å; L314-W318 HydrophobicContact CD1-CH2 3.77Å; L314-W318 HydrophobicContact CD1-CZ2 3.47Å; L314-W318 VanDerWaalsContact CD1-CZ2 3.47Å; L314-W318 HydrophobicContact CG-CH2 4.3Å; L314-W318 HydrophobicContact CG-CZ2 4.18Å; L314-W318 PolarHBondContact O-N 2.88Å
315	I	97	Very high	97.2	Very high	37 Å²	37	59.9 Å²	59.9	19%	0.19	30%	0.302	C	S	.	.	H	α-helix	trans	-46.8	-57	178.8	-62.5	176.1	0	0	0	111.8	P308 F311 Y317 W318 E319 L326	P308-I315 HydrophobicContact CB-CD1 4.16Å; P308-I315 HydrophobicContact CB-CG1 4.12Å; P308-I315 WeakPolarHBondContact O-CD1 3.38Å; F311-I315 PolarHBondContact O-N 3.05Å; I315-Y317 PolarHBondContact O-N 3.37Å; I315-W318 PolarHBondContact O-N 2.54Å; I315-W318 VanDerWaalsContact O-N 3.15Å; I315-E319 HydrophobicContact CG2-CG 4.34Å; I315-E319 WeakPolarHBondContact O-CG 3.46Å; I315-E319 PolarHBondContact O-N 3.28Å; I315-L326 HydrophobicContact CB-CD1 4.39Å; I315-L326 HydrophobicContact CG2-CB 4.33Å; I315-L326 HydrophobicContact CG2-CD1 4.02Å
316	T	97.1	Very high	97.1	Very high	103 Å²	103	60.3 Å²	60.3	63%	0.632	30%	0.304	S	S	*	.	H	α-helix	trans	-64.2	-27.9	-178.6	-53.1	0	0	0	0	112.9	L314 K320	L314-T316 PolarHBondContact O-N 3.04Å; T316-K320 WeakPolarHBondContact O-CB 3.27Å; T316-K320 PolarHBondContact O-N 2.79Å
317	Y	97.6	Very high	96.7	Very high	122 Å²	122	68 Å²	68	48%	0.478	34%	0.338	S	S	.	.	H	α-helix	trans	-71.2	-46.7	174.8	165.9	-102.6	0	0	0	110.8	L314 I315 K320 T321	L314-Y317 CarbonylContact O-C 3.46Å; L314-Y317 WeakPolarHBondContact O-CA 3.41Å; L314-Y317 WeakPolarHBondContact O-CB 3.44Å; L314-Y317 PolarHBondContact O-N 2.79Å; I315-Y317 PolarHBondContact O-N 3.37Å; Y317-K320 PolarHBondContact O-N 2.85Å; Y317-T321 VanDerWaalsContact CE2-OG1 3.25Å; Y317-T321 WeakPolarHBondContact CE2-OG1 3.36Å; Y317-T321 VanDerWaalsContact O-CB 3.3Å; Y317-T321 WeakPolarHBondContact O-CB 3.4Å; Y317-T321 PolarHBondContact O-N 2.61Å; Y317-T321 PolarHBondContact O-OG1 3.28Å
318	W	98.3	Very high	96.4	Very high	16 Å²	16	71.7 Å²	71.7	6%	0.061	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-49.2	179	-67.5	-42.1	0	0	0	112.5	F273 I306 F311 L314 I315 K320 T321 F322 L326	F273-W318 AromaticContact CE1-CD2 3.92Å; F273-W318 HydrophobicContact CE1-CD2 3.92Å; F273-W318 AromaticContact CE1-CE3 3.64Å; F273-W318 HydrophobicContact CE1-CE3 3.64Å; F273-W318 HydrophobicContact CE1-CG 4.47Å; F273-W318 HydrophobicContact CE1-CH2 4.36Å; F273-W318 AromaticContact CE1-CZ3 3.88Å; F273-W318 HydrophobicContact CE1-CZ3 3.88Å; F273-W318 HydrophobicContact CZ-CB 4.24Å; F273-W318 AromaticContact CZ-CD2 3.84Å; F273-W318 HydrophobicContact CZ-CD2 3.84Å; F273-W318 HydrophobicContact CZ-CE3 4.04Å; F273-W318 AromaticContact CZ-CG 3.96Å; F273-W318 HydrophobicContact CZ-CG 3.96Å; I306-W318 HydrophobicContact CD1-CZ2 4.44Å; I306-W318 HydrophobicContact CG2-CH2 3.75Å; I306-W318 HydrophobicContact CG2-CZ2 4.5Å; I306-W318 HydrophobicContact CG2-CZ3 4.05Å; F311-W318 HydrophobicContact CB-CH2 3.41Å; F311-W318 VanDerWaalsContact CB-CH2 3.41Å; F311-W318 HydrophobicContact CB-CZ3 3.66Å; F311-W318 HydrophobicContact CD1-CH2 4.49Å; F311-W318 AromaticContact CD2-CH2 3.93Å; F311-W318 HydrophobicContact CD2-CH2 3.93Å; F311-W318 AromaticContact CG-CH2 3.71Å; F311-W318 HydrophobicContact CG-CH2 3.71Å; F311-W318 HydrophobicContact CG-CZ3 4.37Å; L314-W318 HydrophobicContact CB-CD2 3.85Å; L314-W318 HydrophobicContact CB-CE3 3.77Å; L314-W318 HydrophobicContact CB-CH2 3.56Å; L314-W318 HydrophobicContact CB-CZ2 3.62Å; L314-W318 HydrophobicContact CB-CZ3 3.62Å; L314-W318 HydrophobicContact CD1-CH2 3.77Å; L314-W318 HydrophobicContact CD1-CZ2 3.47Å; L314-W318 VanDerWaalsContact CD1-CZ2 3.47Å; L314-W318 HydrophobicContact CG-CH2 4.3Å; L314-W318 HydrophobicContact CG-CZ2 4.18Å; L314-W318 PolarHBondContact O-N 2.88Å; I315-W318 PolarHBondContact O-N 2.54Å; I315-W318 VanDerWaalsContact O-N 3.15Å; W318-K320 PolarHBondContact O-N 2.93Å; W318-T321 PolarHBondContact O-N 2.94Å; W318-T321 VanDerWaalsContact O-N 3.11Å; W318-F322 HydrophobicContact CB-CD2 3.95Å; W318-F322 HydrophobicContact CB-CE2 4.13Å; W318-F322 AromaticContact CD1-CE2 3.39Å; W318-F322 HydrophobicContact CG-CD2 4.33Å; W318-F322 HydrophobicContact CG-CE2 4Å; W318-F322 WeakPolarHBondContact O-CB 3.47Å; W318-F322 PolarHBondContact O-N 3.26Å; W318-L326 HydrophobicContact CB-CD1 3.8Å; W318-L326 HydrophobicContact CE3-CD1 3.89Å
319	E	97.4	Very high	96.3	Very high	52 Å²	52	71.7 Å²	71.7	24%	0.243	35%	0.351	C	S	.	.	H	α-helix	trans	-54.5	-41.6	175.4	-69.2	178.8	147.3	0	0	111.6	I315 K323 L326	I315-E319 HydrophobicContact CG2-CG 4.34Å; I315-E319 WeakPolarHBondContact O-CG 3.46Å; I315-E319 PolarHBondContact O-N 3.28Å; E319-K323 WeakPolarHBondContact O-CA 3.26Å; E319-K323 PolarHBondContact O-N 3.45Å; E319-L326 HydrophobicContact CG-CB 4.21Å; E319-L326 HydrophobicContact CG-CD1 4.19Å; E319-L326 HydrophobicContact CG-CG 3.95Å
320	K	97.6	Very high	96.3	Very high	152 Å²	152	68.4 Å²	68.4	66%	0.661	33%	0.333	S	S	*	.	H	α-helix	trans	-71.9	-40	179.8	-176.9	-174.2	172	-163.3	0	112.2	T316 Y317 W318 K323	T316-K320 WeakPolarHBondContact O-CB 3.27Å; T316-K320 PolarHBondContact O-N 2.79Å; Y317-K320 PolarHBondContact O-N 2.85Å; W318-K320 PolarHBondContact O-N 2.93Å; K320-K323 WeakPolarHBondContact O-CD 3.27Å; K320-K323 WeakPolarHBondContact O-CE 3.45Å; K320-K323 PolarHBondContact O-NZ 3.39Å
321	T	96.9	Very high	96.3	Very high	47 Å²	47	65.5 Å²	65.5	29%	0.288	32%	0.317	S	S	.	.	H	α-helix	trans	-74.5	-53.8	-175.7	-59	0	0	0	0	109.8	Y317 W318 A339	Y317-T321 VanDerWaalsContact CE2-OG1 3.25Å; Y317-T321 WeakPolarHBondContact CE2-OG1 3.36Å; Y317-T321 VanDerWaalsContact O-CB 3.3Å; Y317-T321 WeakPolarHBondContact O-CB 3.4Å; Y317-T321 PolarHBondContact O-N 2.61Å; Y317-T321 PolarHBondContact O-OG1 3.28Å; W318-T321 PolarHBondContact O-N 2.94Å; W318-T321 VanDerWaalsContact O-N 3.11Å; T321-A339 HydrophobicContact CG2-CB 4.22Å
322	F	96.6	Very high	96.3	Very high	14 Å²	14	65.2 Å²	65.2	6%	0.061	32%	0.316	C	S	.	.	H	α-helix	trans	-87.6	-9.4	-173.3	-56.5	-37.3	0	0	0	114.3	F273 W318 I324 V334 S341 W343	F273-F322 HydrophobicContact CE2-CD2 4.33Å; F273-F322 HydrophobicContact CE2-CE2 4.43Å; F273-F322 HydrophobicContact CZ-CE2 4.42Å; W318-F322 HydrophobicContact CB-CD2 3.95Å; W318-F322 HydrophobicContact CB-CE2 4.13Å; W318-F322 AromaticContact CD1-CE2 3.39Å; W318-F322 HydrophobicContact CG-CD2 4.33Å; W318-F322 HydrophobicContact CG-CE2 4Å; W318-F322 WeakPolarHBondContact O-CB 3.47Å; W318-F322 PolarHBondContact O-N 3.26Å; F322-I324 HydrophobicContact CB-CD1 3.85Å; F322-I324 HydrophobicContact CB-CG1 3.96Å; F322-I324 HydrophobicContact CB-CG2 4.27Å; F322-I324 HydrophobicContact CD2-CD1 4.07Å; F322-I324 HydrophobicContact CG-CD1 4.44Å; F322-I324 PolarHBondContact O-N 2.8Å; F322-V334 HydrophobicContact CE1-CG1 3.91Å; F322-V334 HydrophobicContact CE1-CG2 4.1Å; F322-V334 HydrophobicContact CZ-CG1 4Å; F322-V334 HydrophobicContact CZ-CG2 4Å; F322-S341 WeakPolarHBondContact CD1-OG 3.12Å; F322-W343 HydrophobicContact CB-CZ2 3.9Å; F322-W343 HydrophobicContact CD1-CZ2 4.29Å; F322-W343 HydrophobicContact CD2-CH2 4.39Å; F322-W343 AromaticContact CD2-CZ2 3.66Å; F322-W343 HydrophobicContact CD2-CZ2 3.66Å; F322-W343 HydrophobicContact CE2-CZ2 4.22Å; F322-W343 AromaticContact CG-CZ2 3.7Å; F322-W343 HydrophobicContact CG-CZ2 3.7Å
323	K	96.3	Very high	96.3	Very high	167 Å²	167	61.3 Å²	61.3	73%	0.726	29%	0.29	S	S	*	.			trans	60.8	25.9	-179.4	-47.8	-56.5	-178.2	-165.8	0	114.3	E319 K320	E319-K323 WeakPolarHBondContact O-CA 3.26Å; E319-K323 PolarHBondContact O-N 3.45Å; K320-K323 WeakPolarHBondContact O-CD 3.27Å; K320-K323 WeakPolarHBondContact O-CE 3.45Å; K320-K323 PolarHBondContact O-NZ 3.39Å
324	I	95.3	Very high	96.4	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.108	25%	0.254	C	S	.	.			trans	-99.3	165.2	177	63.6	-171.9	0	0	0	111.8	F273 F322 L326 Q330 W343	F273-I324 HydrophobicContact CD2-CD1 3.82Å; F273-I324 HydrophobicContact CE2-CD1 3.74Å; F322-I324 HydrophobicContact CB-CD1 3.85Å; F322-I324 HydrophobicContact CB-CG1 3.96Å; F322-I324 HydrophobicContact CB-CG2 4.27Å; F322-I324 HydrophobicContact CD2-CD1 4.07Å; F322-I324 HydrophobicContact CG-CD1 4.44Å; F322-I324 PolarHBondContact O-N 2.8Å; I324-L326 HydrophobicContact CD1-CD2 3.64Å; I324-L326 HydrophobicContact CD1-CG 4.47Å; I324-L326 HydrophobicContact CG1-CD2 3.97Å; I324-L326 HydrophobicContact CG1-CG 4.35Å; I324-Q330 HydrophobicContact CB-CG 4.18Å; I324-Q330 HydrophobicContact CD1-CB 4.45Å; I324-Q330 HydrophobicContact CD1-CG 4.2Å; I324-W343 HydrophobicContact CD1-CD2 4.22Å; I324-W343 HydrophobicContact CD1-CE3 4.21Å; I324-W343 HydrophobicContact CD1-CH2 3.83Å; I324-W343 HydrophobicContact CD1-CZ2 3.77Å; I324-W343 HydrophobicContact CD1-CZ3 4.03Å; I324-W343 HydrophobicContact CG2-CB 4.27Å; I324-W343 HydrophobicContact CG2-CD2 3.64Å; I324-W343 HydrophobicContact CG2-CE3 4.25Å; I324-W343 HydrophobicContact CG2-CG 3.58Å
325	D	93.8	Very high	96.3	Very high	68 Å²	68	53 Å²	53	36%	0.364	25%	0.247	S	C	.	.			trans	-105.7	110.2	172.6	-175.3	-1.6	0	0	0	108.9	F327 R328 Q330	D325-F327 PolarHBondContact O-N 3.37Å; D325-F327 WeakPolarHBondContact OD1-CB 3.29Å; D325-F327 WeakPolarHBondContact OD1-CD2 3.37Å; D325-F327 PolarHBondContact OD1-N 3.43Å; D325-F327 VanDerWaalsContact OD1-N 3.13Å; D325-R328 PolarHBondContact O-N 2.9Å; D325-Q330 PolarHBondContact O-NE2 2.86Å
326	L	95.3	Very high	96.2	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.052	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.6	-176.9	-69.2	-174.3	0	0	0	113.7	F273 I315 W318 E319 I324 R328 Q330	F273-L326 HydrophobicContact CB-CD2 3.74Å; F273-L326 HydrophobicContact CD1-CD1 4.44Å; F273-L326 HydrophobicContact CD1-CD2 3.67Å; F273-L326 HydrophobicContact CD2-CD2 3.5Å; F273-L326 HydrophobicContact CE1-CD1 4.28Å; F273-L326 HydrophobicContact CE1-CD2 4.07Å; F273-L326 HydrophobicContact CE2-CD2 3.91Å; F273-L326 HydrophobicContact CG-CD2 3.36Å; F273-L326 HydrophobicContact CZ-CD2 4.18Å; I315-L326 HydrophobicContact CB-CD1 4.39Å; I315-L326 HydrophobicContact CG2-CB 4.33Å; I315-L326 HydrophobicContact CG2-CD1 4.02Å; W318-L326 HydrophobicContact CB-CD1 3.8Å; W318-L326 HydrophobicContact CE3-CD1 3.89Å; E319-L326 HydrophobicContact CG-CB 4.21Å; E319-L326 HydrophobicContact CG-CD1 4.19Å; E319-L326 HydrophobicContact CG-CG 3.95Å; I324-L326 HydrophobicContact CD1-CD2 3.64Å; I324-L326 HydrophobicContact CD1-CG 4.47Å; I324-L326 HydrophobicContact CG1-CD2 3.97Å; I324-L326 HydrophobicContact CG1-CG 4.35Å; L326-R328 PolarHBondContact O-N 2.97Å; L326-Q330 HydrophobicContact CD2-CG 4.49Å
327	F	90.3	Very high	95.9	Very high	162 Å²	162	54.2 Å²	54.2	71%	0.711	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	3.5	166.1	-69.2	-78.6	0	0	0	112.9	D325	D325-F327 PolarHBondContact O-N 3.37Å; D325-F327 WeakPolarHBondContact OD1-CB 3.29Å; D325-F327 WeakPolarHBondContact OD1-CD2 3.37Å; D325-F327 PolarHBondContact OD1-N 3.43Å; D325-F327 VanDerWaalsContact OD1-N 3.13Å
328	R	92.2	Very high	95.7	Very high	89 Å²	89	53.4 Å²	53.4	34%	0.336	26%	0.26	S	S	.	.	S	Bend	trans	-136.4	150.8	-176.4	-58.1	-176.7	153.6	-164	-15.8	109.4	D325 L326 Q330 D349	D325-R328 PolarHBondContact O-N 2.9Å; L326-R328 PolarHBondContact O-N 2.97Å; R328-Q330 WeakPolarHBondContact O-CG 3.5Å; R328-Q330 PolarHBondContact O-N 3.47Å; R328-D349 WeakPolarHBondContact CD-OD1 3.31Å; R328-D349 WeakPolarHBondContact CG-OD1 3.1Å; R328-D349 IonicContact CZ-OD1 2.57Å; R328-D349 IonicContact CZ-OD2 3.64Å; R328-D349 IonicContact NE-OD1 3.81Å; R328-D349 PolarHBondContact NE-OD1 2.67Å; R328-D349 IonicContact NE-OD2 2.85Å; R328-D349 PolarHBondContact NE-OD2 3.25Å; R328-D349 VanDerWaalsContact NE-OD2 3.15Å; R328-D349 IonicContact NH2-OD1 3.89Å; R328-D349 IonicContact NH2-OD2 2.91Å; R328-D349 PolarHBondContact NH2-OD2 2.94Å
329	P	96.6	Very high	95.5	Very high	5 Å²	5	54 Å²	54	3%	0.032	27%	0.269	C	S	.	.			trans	-59.7	137.8	172.9	-24.1	35.9	0	0	0	111.8	F273 D280 F284 L352	F273-P329 CarbonylContact O-C 3.54Å; F273-P329 VanDerWaalsContact O-CA 3.28Å; F273-P329 WeakPolarHBondContact O-CA 3.3Å; D280-P329 HydrophobicContact CB-CG 4.38Å; F284-P329 HydrophobicContact CB-CB 3.67Å; F284-P329 HydrophobicContact CB-CG 3.9Å; F284-P329 HydrophobicContact CD1-CB 3.56Å; F284-P329 HydrophobicContact CD2-CB 4.19Å; F284-P329 HydrophobicContact CE1-CB 4.17Å; F284-P329 HydrophobicContact CG-CB 3.54Å; F284-P329 HydrophobicContact CG-CG 4.32Å; P329-L352 HydrophobicContact CB-CD2 4.14Å; P329-L352 HydrophobicContact CG-CD2 3.96Å
330	Q	97.3	Very high	95.4	Very high	23 Å²	23	54.2 Å²	54.2	11%	0.107	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.3	178.9	-54.9	-65.5	-24.2	0	0	109.6	A272 F273 I324 D325 L326 R328 W343	A272-Q330 CarbonylContact C-O 3.6Å; A272-Q330 VanDerWaalsContact CA-O 3.24Å; A272-Q330 WeakPolarHBondContact CA-O 3.03Å; F273-Q330 HydrophobicContact CB-CB 4.17Å; F273-Q330 HydrophobicContact CD2-CB 4.3Å; F273-Q330 PolarHBondContact N-O 3.47Å; F273-Q330 PolarHBondContact O-N 3.44Å; I324-Q330 HydrophobicContact CB-CG 4.18Å; I324-Q330 HydrophobicContact CD1-CB 4.45Å; I324-Q330 HydrophobicContact CD1-CG 4.2Å; D325-Q330 PolarHBondContact O-NE2 2.86Å; L326-Q330 HydrophobicContact CD2-CG 4.49Å; R328-Q330 WeakPolarHBondContact O-CG 3.5Å; R328-Q330 PolarHBondContact O-N 3.47Å; Q330-W343 HydrophobicContact CB-CE3 3.78Å; Q330-W343 HydrophobicContact CB-CZ3 3.86Å
331	I	97.9	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.4	162.8	-169.4	174.9	0	0	0	110.1	I270 V271 A272 F284 L288 M344 L358 W361 I362	I270-I331 HydrophobicContact CG2-CD1 3.97Å; I270-I331 HydrophobicContact CG2-CG1 4.09Å; V271-I331 CarbonylContact O-C 3.56Å; V271-I331 VanDerWaalsContact O-CA 3.3Å; V271-I331 WeakPolarHBondContact O-CA 3.39Å; V271-I331 WeakPolarHBondContact O-CG1 3.34Å; A272-I331 HydrophobicContact CB-CB 4.38Å; A272-I331 HydrophobicContact CB-CD1 4.43Å; A272-I331 HydrophobicContact CB-CG1 4.13Å; F284-I331 HydrophobicContact CE1-CB 4.43Å; F284-I331 HydrophobicContact CZ-CB 3.95Å; F284-I331 HydrophobicContact CZ-CG2 4Å; L288-I331 HydrophobicContact CD2-CD1 4.02Å; I331-M344 HydrophobicContact CG2-CB 3.72Å; I331-M344 HydrophobicContact CG2-CG 4.45Å; I331-M344 HydrophobicContact CG2-SD 3.91Å; I331-M344 PolarHBondContact O-N 2.88Å; I331-L358 HydrophobicContact CD1-CD1 3.68Å; I331-L358 HydrophobicContact CG2-CD1 3.84Å; I331-W361 HydrophobicContact CD1-CZ3 4.28Å; I331-W361 HydrophobicContact CG1-CZ3 4.13Å; I331-I362 HydrophobicContact CD1-CD1 4.41Å
332	G	97.6	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	176.1	-174.6	0	0	0	0	0	112.7	I270 V271 I342	I270-G332 CarbonylContact C-O 3.58Å; I270-G332 WeakPolarHBondContact CA-O 3.44Å; V271-G332 PolarHBondContact N-O 3.48Å; V271-G332 PolarHBondContact O-N 3.36Å; G332-I342 CarbonylContact C-O 3.58Å; G332-I342 WeakPolarHBondContact CA-O 3.38Å
333	V	97.6	Very high	95.3	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.4	171.2	-174.3	0	0	0	0	107.8	I268 H269 S341 I342 W361 V365 T372	I268-V333 HydrophobicContact CB-CG1 3.85Å; I268-V333 HydrophobicContact CD1-CG1 3.78Å; I268-V333 HydrophobicContact CG1-CG1 4.38Å; I268-V333 HydrophobicContact CG2-CG1 4.09Å; H269-V333 CarbonylContact O-C 3.46Å; H269-V333 WeakPolarHBondContact O-CA 3.42Å; V333-S341 WeakPolarHBondContact O-CA 3.5Å; V333-S341 VanDerWaalsContact O-CB 3.32Å; V333-S341 WeakPolarHBondContact O-CB 3.26Å; V333-I342 HydrophobicContact CB-CG2 3.96Å; V333-I342 HydrophobicContact CG2-CG2 4.27Å; V333-I342 PolarHBondContact N-O 2.94Å; V333-I342 PolarHBondContact O-N 2.82Å; V333-I342 VanDerWaalsContact O-N 3.09Å; V333-W361 HydrophobicContact CG2-CH2 3.85Å; V333-V365 HydrophobicContact CG2-CB 4.16Å; V333-V365 HydrophobicContact CG2-CG1 3.45Å; V333-V365 VanDerWaalsContact CG2-CG1 3.45Å; V333-V365 HydrophobicContact CG2-CG2 3.55Å; V333-T372 HydrophobicContact CG1-CG2 4.49Å
334	V	97.8	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.7	176.5	-177.7	0	0	0	0	109.4	W261 I268 H269 V271 F322 D340 W343	W261-V334 HydrophobicContact CH2-CB 4.24Å; W261-V334 HydrophobicContact CH2-CG1 4.03Å; W261-V334 HydrophobicContact CZ2-CG1 3.98Å; I268-V334 CarbonylContact C-O 3.59Å; I268-V334 VanDerWaalsContact CA-O 3.31Å; I268-V334 WeakPolarHBondContact CA-O 3.44Å; H269-V334 PolarHBondContact N-O 2.93Å; H269-V334 PolarHBondContact O-N 3.24Å; V271-V334 HydrophobicContact CB-CG2 4.3Å; V271-V334 HydrophobicContact CG2-CB 4.29Å; V271-V334 HydrophobicContact CG2-CG2 3.87Å; F322-V334 HydrophobicContact CE1-CG1 3.91Å; F322-V334 HydrophobicContact CE1-CG2 4.1Å; F322-V334 HydrophobicContact CZ-CG1 4Å; F322-V334 HydrophobicContact CZ-CG2 4Å; V334-D340 WeakPolarHBondContact CA-O 3.42Å; V334-W343 HydrophobicContact CG2-CH2 4.4Å; V334-W343 HydrophobicContact CG2-CZ2 4Å
335	N	95.9	Very high	95	Very high	23 Å²	23	49.4 Å²	49.4	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.8	170.2	-171.5	-42.7	0	0	0	109.9	T337 D338 A339 D340 T372	N335-T337 PolarHBondContact O-N 3Å; N335-T337 VanDerWaalsContact OD1-CB 3.27Å; N335-T337 WeakPolarHBondContact OD1-CB 3.45Å; N335-T337 PolarHBondContact OD1-N 3.32Å; N335-T337 PolarHBondContact OD1-OG1 3.2Å; N335-D338 WeakPolarHBondContact CB-OD1 3.5Å; N335-A339 WeakPolarHBondContact O-CA 3.48Å; N335-A339 PolarHBondContact O-N 3.21Å; N335-D340 HydrophobicContact CB-CB 4.47Å; N335-D340 PolarHBondContact N-O 2.86Å; N335-T372 HydrophobicContact CB-CG2 4.41Å
336	V	94.3	Very high	94.7	Very high	44 Å²	44	47.8 Å²	47.8	27%	0.267	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-15	-174.8	-54.9	0	0	0	0	113.5	D264 G267 H269	D264-V336 HydrophobicContact CB-CG1 3.98Å; D264-V336 HydrophobicContact CB-CG2 4.32Å; D264-V336 WeakPolarHBondContact OD1-CG2 3.33Å; G267-V336 WeakPolarHBondContact O-CG2 3.25Å; G267-V336 PolarHBondContact O-N 3.23Å; H269-V336 VanDerWaalsContact CD2-CG1 3.44Å; H269-V336 WeakPolarHBondContact CD2-CG1 3.21Å
337	T	92	Very high	93.6	Very high	122 Å²	122	57.1 Å²	57.1	75%	0.748	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-40.4	-174.1	-54.7	0	0	0	0	112.6	N335	N335-T337 PolarHBondContact O-N 3Å; N335-T337 VanDerWaalsContact OD1-CB 3.27Å; N335-T337 WeakPolarHBondContact OD1-CB 3.45Å; N335-T337 PolarHBondContact OD1-N 3.32Å; N335-T337 PolarHBondContact OD1-OG1 3.2Å
338	D	92.9	Very high	92.9	Very high	105 Å²	105	52.2 Å²	52.2	56%	0.561	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	-1.3	-174	54.5	13.8	0	0	0	114.1	N335 D340	N335-D338 WeakPolarHBondContact CB-OD1 3.5Å; D338-D340 PolarHBondContact O-N 2.99Å; D338-D340 WeakPolarHBondContact OD1-CB 3.49Å; D338-D340 PolarHBondContact OD1-N 3.5Å; D338-D340 VanDerWaalsContact OD1-N 3.07Å
339	A	94.1	Very high	91.8	Very high	29 Å²	29	50 Å²	50	24%	0.24	25%	0.253	C	S	.	.			trans	61.7	24.7	-175.7	0	0	0	0	0	113.8	T321 N335	T321-A339 HydrophobicContact CG2-CB 4.22Å; N335-A339 WeakPolarHBondContact O-CA 3.48Å; N335-A339 PolarHBondContact O-N 3.21Å
340	D	94.7	Very high	90.8	Very high	55 Å²	55	57 Å²	57	29%	0.294	29%	0.291	S	S	.	.			trans	-67.1	148.3	166.8	-168.5	23.6	0	0	0	110.9	V334 N335 D338 T372	V334-D340 WeakPolarHBondContact CA-O 3.42Å; N335-D340 HydrophobicContact CB-CB 4.47Å; N335-D340 PolarHBondContact N-O 2.86Å; D338-D340 PolarHBondContact O-N 2.99Å; D338-D340 WeakPolarHBondContact OD1-CB 3.49Å; D338-D340 PolarHBondContact OD1-N 3.5Å; D338-D340 VanDerWaalsContact OD1-N 3.07Å; D340-T372 WeakPolarHBondContact OD2-CB 3.35Å; D340-T372 VanDerWaalsContact OD2-O 3.06Å
341	S	96.4	Very high	90.2	Very high	20 Å²	20	60.5 Å²	60.5	14%	0.14	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	143.1	-170.2	68.4	0	0	0	0	114.5	F322 V333 W343	F322-S341 WeakPolarHBondContact CD1-OG 3.12Å; V333-S341 WeakPolarHBondContact O-CA 3.5Å; V333-S341 VanDerWaalsContact O-CB 3.32Å; V333-S341 WeakPolarHBondContact O-CB 3.26Å; S341-W343 PolarHBondContact OG-NE1 2.82Å
342	I	96.7	Very high	89.9	Confident	33 Å²	33	61.8 Å²	61.8	17%	0.169	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	138.6	171.2	-175.6	160.9	0	0	0	109.7	G332 V333 I370 T372	G332-I342 CarbonylContact C-O 3.58Å; G332-I342 WeakPolarHBondContact CA-O 3.38Å; V333-I342 HydrophobicContact CB-CG2 3.96Å; V333-I342 HydrophobicContact CG2-CG2 4.27Å; V333-I342 PolarHBondContact N-O 2.94Å; V333-I342 PolarHBondContact O-N 2.82Å; V333-I342 VanDerWaalsContact O-N 3.09Å; I342-I370 HydrophobicContact CD1-CG2 3.93Å; I342-I370 HydrophobicContact CG1-CG2 4.35Å; I342-I370 HydrophobicContact CG2-CG2 3.84Å; I342-T372 HydrophobicContact CG2-CG2 4.35Å
343	W	96.4	Very high	89.8	Confident	39 Å²	39	62.1 Å²	62.1	15%	0.148	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.8	-173.7	-62.5	85.1	0	0	0	111.1	V271 F273 F322 I324 Q330 V334 S341 E345	V271-W343 HydrophobicContact CB-CH2 4.23Å; V271-W343 HydrophobicContact CG1-CH2 4.21Å; F273-W343 AromaticContact CD2-CH2 3.72Å; F273-W343 HydrophobicContact CD2-CH2 3.72Å; F273-W343 AromaticContact CD2-CZ3 3.82Å; F273-W343 HydrophobicContact CD2-CZ3 3.82Å; F273-W343 AromaticContact CE2-CH2 3.47Å; F273-W343 HydrophobicContact CE2-CH2 3.47Å; F273-W343 VanDerWaalsContact CE2-CH2 3.47Å; F273-W343 HydrophobicContact CE2-CZ2 4.27Å; F273-W343 HydrophobicContact CE2-CZ3 4.08Å; F322-W343 HydrophobicContact CB-CZ2 3.9Å; F322-W343 HydrophobicContact CD1-CZ2 4.29Å; F322-W343 HydrophobicContact CD2-CH2 4.39Å; F322-W343 AromaticContact CD2-CZ2 3.66Å; F322-W343 HydrophobicContact CD2-CZ2 3.66Å; F322-W343 HydrophobicContact CE2-CZ2 4.22Å; F322-W343 AromaticContact CG-CZ2 3.7Å; F322-W343 HydrophobicContact CG-CZ2 3.7Å; I324-W343 HydrophobicContact CD1-CD2 4.22Å; I324-W343 HydrophobicContact CD1-CE3 4.21Å; I324-W343 HydrophobicContact CD1-CH2 3.83Å; I324-W343 HydrophobicContact CD1-CZ2 3.77Å; I324-W343 HydrophobicContact CD1-CZ3 4.03Å; I324-W343 HydrophobicContact CG2-CB 4.27Å; I324-W343 HydrophobicContact CG2-CD2 3.64Å; I324-W343 HydrophobicContact CG2-CE3 4.25Å; I324-W343 HydrophobicContact CG2-CG 3.58Å; Q330-W343 HydrophobicContact CB-CE3 3.78Å; Q330-W343 HydrophobicContact CB-CZ3 3.86Å; V334-W343 HydrophobicContact CG2-CH2 4.4Å; V334-W343 HydrophobicContact CG2-CZ2 4Å; S341-W343 PolarHBondContact OG-NE1 2.82Å; W343-E345 PolarHBondContact O-N 2.95Å
344	M	95.3	Very high	89.7	Confident	30 Å²	30	65.5 Å²	65.5	15%	0.148	34%	0.339	C	S	.	.			trans	-63.3	132.9	175	-174.1	179.9	-174.2	0	0	110.3	I331 I346 P353 L358 W361	I331-M344 HydrophobicContact CG2-CB 3.72Å; I331-M344 HydrophobicContact CG2-CG 4.45Å; I331-M344 HydrophobicContact CG2-SD 3.91Å; I331-M344 PolarHBondContact O-N 2.88Å; M344-I346 HydrophobicContact CG-CG1 4.46Å; M344-I346 PolarHBondContact O-N 3.1Å; M344-P353 HydrophobicContact CE-CB 3.67Å; M344-P353 HydrophobicContact CE-CG 4.2Å; M344-P353 HydrophobicContact SD-CB 4.34Å; M344-P353 HydrophobicContact SD-CG 4.23Å; M344-L358 HydrophobicContact SD-CD1 4.13Å; M344-W361 HydrophobicContact CB-CD2 4.23Å; M344-W361 HydrophobicContact CB-CG 4.47Å; M344-W361 HydrophobicContact CB-CZ2 4.22Å; M344-W361 HydrophobicContact CE-CB 4.41Å; M344-W361 HydrophobicContact CG-CD2 4.45Å; M344-W361 HydrophobicContact CG-CG 4.2Å; M344-W361 HydrophobicContact SD-CB 4.39Å; M344-W361 HydrophobicContact SD-CG 4.2Å
345	E	90.5	Very high	89.7	Confident	178 Å²	178	66.8 Å²	66.8	83%	0.832	35%	0.35	S	S	*	.			trans	-71.9	96.3	175.2	-70.9	-168.1	168.8	0	0	111.3	W343	W343-E345 PolarHBondContact O-N 2.95Å
346	I	86.8	Confident	89.7	Confident	35 Å²	35	72.5 Å²	72.5	18%	0.179	38%	0.376	C	S	.	.			trans	-96.5	114	169.7	-56.5	173.3	0	0	0	107.7	F284 M344 L352	F284-I346 HydrophobicContact CE2-CD1 4.3Å; F284-I346 HydrophobicContact CZ-CD1 4.46Å; M344-I346 HydrophobicContact CG-CG1 4.46Å; M344-I346 PolarHBondContact O-N 3.1Å; I346-L352 HydrophobicContact CG2-CD2 4.47Å
347	R	73.3	Confident	89.8	Confident	205 Å²	205	75.3 Å²	75.3	77%	0.774	39%	0.386	S	S	*	.			trans	-68.6	-44.3	-167.7	-70.1	-177.3	178	153.5	7.1	113
348	D	74.8	Confident	90.1	Very high	59 Å²	59	69.5 Å²	69.5	32%	0.316	35%	0.351	S	S	.	.			trans	-161.4	173.2	174.4	57.6	39.1	0	0	0	110.9	D350 D351	D348-D350 PolarHBondContact O-N 2.75Å; D348-D350 PolarHBondContact OD1-N 2.95Å; D348-D351 PolarHBondContact O-N 3Å; D348-D351 VanDerWaalsContact O-N 3.15Å; D348-D351 WeakPolarHBondContact OD1-CB 3.35Å; D348-D351 PolarHBondContact OD1-N 3.37Å; D348-D351 VanDerWaalsContact OD1-N 3.11Å
349	D	70.1	Confident	90.3	Very high	42 Å²	42	67 Å²	67	23%	0.225	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.8	-174.4	-43.4	-38.3	0	0	0	112	R328	R328-D349 WeakPolarHBondContact CD-OD1 3.31Å; R328-D349 WeakPolarHBondContact CG-OD1 3.1Å; R328-D349 IonicContact CZ-OD1 2.57Å; R328-D349 IonicContact CZ-OD2 3.64Å; R328-D349 IonicContact NE-OD1 3.81Å; R328-D349 PolarHBondContact NE-OD1 2.67Å; R328-D349 IonicContact NE-OD2 2.85Å; R328-D349 PolarHBondContact NE-OD2 3.25Å; R328-D349 VanDerWaalsContact NE-OD2 3.15Å; R328-D349 IonicContact NH2-OD1 3.89Å; R328-D349 IonicContact NH2-OD2 2.91Å; R328-D349 PolarHBondContact NH2-OD2 2.94Å
350	D	73.7	Confident	90.4	Very high	153 Å²	153	69.8 Å²	69.8	82%	0.818	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-14.1	177.1	-72.6	-50.1	0	0	0	112.6	D348	D348-D350 PolarHBondContact O-N 2.75Å; D348-D350 PolarHBondContact OD1-N 2.95Å
351	D	84.8	Confident	90.5	Very high	96 Å²	96	68.7 Å²	68.7	51%	0.513	34%	0.338	S	S	.	.	S	Bend	trans	-117	45.1	-175.1	-76.9	-20	0	0	0	111.5	D348	D348-D351 PolarHBondContact O-N 3Å; D348-D351 VanDerWaalsContact O-N 3.15Å; D348-D351 WeakPolarHBondContact OD1-CB 3.35Å; D348-D351 PolarHBondContact OD1-N 3.37Å; D348-D351 VanDerWaalsContact OD1-N 3.11Å
352	L	93	Very high	90.5	Very high	27 Å²	27	68 Å²	68	14%	0.141	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-56.6	142.8	172	-67.5	178.3	0	0	0	111.4	E283 F284 I287 P329 I346	E283-L352 HydrophobicContact CB-CD1 3.9Å; E283-L352 HydrophobicContact CG-CD1 3.85Å; F284-L352 HydrophobicContact CB-CD1 4.23Å; F284-L352 HydrophobicContact CB-CD2 4.34Å; F284-L352 HydrophobicContact CD2-CD2 4.2Å; I287-L352 HydrophobicContact CD1-CB 4.37Å; P329-L352 HydrophobicContact CB-CD2 4.14Å; P329-L352 HydrophobicContact CG-CD2 3.96Å; I346-L352 HydrophobicContact CG2-CD2 4.47Å
353	P	95.1	Very high	90.3	Very high	7 Å²	7	71.5 Å²	71.5	5%	0.045	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-66.9	145.5	-179.7	29.5	-35.3	0	0	0	110.8	F284 I287 M344 E357	F284-P353 HydrophobicContact CD2-CG 4.32Å; F284-P353 HydrophobicContact CE2-CG 3.74Å; I287-P353 VanDerWaalsContact CD1-O 3.24Å; I287-P353 WeakPolarHBondContact CD1-O 3.36Å; M344-P353 HydrophobicContact CE-CB 3.67Å; M344-P353 HydrophobicContact CE-CG 4.2Å; M344-P353 HydrophobicContact SD-CB 4.34Å; M344-P353 HydrophobicContact SD-CG 4.23Å; P353-E357 HydrophobicContact CB-CB 4.22Å
354	T	95.9	Very high	90.3	Very high	73 Å²	73	72.2 Å²	72.2	45%	0.448	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-70.1	161.6	167	61.2	0	0	0	0	110.9	E356 E357 L358	T354-E356 PolarHBondContact O-N 3.16Å; T354-E357 WeakPolarHBondContact CB-OE2 3.32Å; T354-E357 PolarHBondContact N-OE2 2.74Å; T354-E357 PolarHBondContact O-N 3.04Å; T354-E357 VanDerWaalsContact O-N 3.15Å; T354-E357 WeakPolarHBondContact OG1-CG 3.49Å; T354-E357 PolarHBondContact OG1-N 3.32Å; T354-E357 PolarHBondContact OG1-OE2 2.86Å; T354-L358 PolarHBondContact O-N 3.27Å
355	A	96.9	Very high	90.2	Very high	27 Å²	27	71.1 Å²	71.1	22%	0.223	35%	0.351	C	S	.	.	H	α-helix	trans	-56.2	-36.2	175.4	0	0	0	0	0	112.8	I287 Q290 V291 L358 E359	I287-A355 HydrophobicContact CG2-CB 4.28Å; Q290-A355 HydrophobicContact CG-CB 4.22Å; V291-A355 HydrophobicContact CG2-CB 3.86Å; V291-A355 WeakPolarHBondContact CG2-O 3.39Å; A355-L358 PolarHBondContact O-N 3.1Å; A355-E359 VanDerWaalsContact O-CB 3.26Å; A355-E359 WeakPolarHBondContact O-CB 3.12Å; A355-E359 PolarHBondContact O-N 3Å
356	E	96.9	Very high	90.2	Very high	143 Å²	143	66 Å²	66	67%	0.668	33%	0.328	S	S	*	.	H	α-helix	trans	-66.8	-43.9	176.9	-174.5	176.1	-175.5	0	0	111.5	T354 L358 E359 D360	T354-E356 PolarHBondContact O-N 3.16Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.45Å; E356-E359 PolarHBondContact O-N 3.14Å; E356-D360 WeakPolarHBondContact O-CB 3.47Å; E356-D360 PolarHBondContact O-N 3.38Å
357	E	96.5	Very high	90.5	Very high	103 Å²	103	67.6 Å²	67.6	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-35.7	177.3	-72.3	163.4	144.9	0	0	112.2	P353 T354 W361	P353-E357 HydrophobicContact CB-CB 4.22Å; T354-E357 WeakPolarHBondContact CB-OE2 3.32Å; T354-E357 PolarHBondContact N-OE2 2.74Å; T354-E357 PolarHBondContact O-N 3.04Å; T354-E357 VanDerWaalsContact O-N 3.15Å; T354-E357 WeakPolarHBondContact OG1-CG 3.49Å; T354-E357 PolarHBondContact OG1-N 3.32Å; T354-E357 PolarHBondContact OG1-OE2 2.86Å; E357-W361 PolarHBondContact O-N 2.86Å
358	L	97	Very high	91.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-71.2	-42.3	176.6	-176.7	58.7	0	0	0	111.9	I287 L288 V291 I331 M344 T354 A355 E356 W361 I362	I287-L358 HydrophobicContact CG2-CD2 3.86Å; L288-L358 HydrophobicContact CD2-CD2 3.84Å; L288-L358 HydrophobicContact CG-CD2 4.44Å; V291-L358 HydrophobicContact CB-CD2 4.49Å; V291-L358 HydrophobicContact CG2-CB 4.15Å; V291-L358 HydrophobicContact CG2-CD2 3.94Å; V291-L358 HydrophobicContact CG2-CG 4.16Å; I331-L358 HydrophobicContact CD1-CD1 3.68Å; I331-L358 HydrophobicContact CG2-CD1 3.84Å; M344-L358 HydrophobicContact SD-CD1 4.13Å; T354-L358 PolarHBondContact O-N 3.27Å; A355-L358 PolarHBondContact O-N 3.1Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.45Å; L358-W361 PolarHBondContact O-N 3.17Å; L358-I362 HydrophobicContact CD1-CD1 4.44Å; L358-I362 HydrophobicContact CG-CD1 4.22Å; L358-I362 WeakPolarHBondContact O-CG1 3.48Å; L358-I362 PolarHBondContact O-N 3.07Å
359	E	96.5	Very high	91.8	Very high	53 Å²	53	63.6 Å²	63.6	25%	0.248	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-47.2	174.9	-177.1	172.2	-152.2	0	0	111.2	V291 N295 A355 E356 W361 I362 E363	V291-E359 HydrophobicContact CG1-CB 4.47Å; N295-E359 PolarHBondContact ND2-OE1 3.22Å; N295-E359 PolarHBondContact OD1-OE1 3.43Å; A355-E359 VanDerWaalsContact O-CB 3.26Å; A355-E359 WeakPolarHBondContact O-CB 3.12Å; A355-E359 PolarHBondContact O-N 3Å; E356-E359 PolarHBondContact O-N 3.14Å; E359-W361 VanDerWaalsContact C-N 3.29Å; E359-W361 PolarHBondContact O-N 3.04Å; E359-I362 PolarHBondContact O-N 2.91Å; E359-I362 VanDerWaalsContact O-N 3.16Å; E359-E363 WeakPolarHBondContact O-CG 3.45Å; E359-E363 PolarHBondContact O-N 2.97Å
360	D	96.6	Very high	92.5	Very high	88 Å²	88	63.1 Å²	63.1	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-56.2	-42.3	175.5	-82.8	-11.7	0	0	0	111.8	E356 E363 D364	E356-D360 WeakPolarHBondContact O-CB 3.47Å; E356-D360 PolarHBondContact O-N 3.38Å; D360-E363 PolarHBondContact O-N 3.09Å; D360-D364 PolarHBondContact O-N 2.84Å; D360-D364 VanDerWaalsContact O-N 3.1Å
361	W	97.2	Very high	93	Very high	31 Å²	31	57.8 Å²	57.8	12%	0.117	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-42.6	177.9	-175.1	89.6	0	0	0	111.9	I270 I331 V333 M344 E357 L358 E359 D364 V365 I370	I270-W361 HydrophobicContact CG2-CZ3 4.44Å; I331-W361 HydrophobicContact CD1-CZ3 4.28Å; I331-W361 HydrophobicContact CG1-CZ3 4.13Å; V333-W361 HydrophobicContact CG2-CH2 3.85Å; M344-W361 HydrophobicContact CB-CD2 4.23Å; M344-W361 HydrophobicContact CB-CG 4.47Å; M344-W361 HydrophobicContact CB-CZ2 4.22Å; M344-W361 HydrophobicContact CE-CB 4.41Å; M344-W361 HydrophobicContact CG-CD2 4.45Å; M344-W361 HydrophobicContact CG-CG 4.2Å; M344-W361 HydrophobicContact SD-CB 4.39Å; M344-W361 HydrophobicContact SD-CG 4.2Å; E357-W361 PolarHBondContact O-N 2.86Å; L358-W361 PolarHBondContact O-N 3.17Å; E359-W361 VanDerWaalsContact C-N 3.29Å; E359-W361 PolarHBondContact O-N 3.04Å; W361-D364 PolarHBondContact O-N 3.31Å; W361-V365 HydrophobicContact CD2-CG2 4.24Å; W361-V365 HydrophobicContact CE3-CG2 4.01Å; W361-V365 HydrophobicContact CH2-CG2 3.73Å; W361-V365 HydrophobicContact CZ2-CG2 3.98Å; W361-V365 HydrophobicContact CZ3-CG2 3.76Å; W361-V365 WeakPolarHBondContact O-CG2 3.47Å; W361-V365 PolarHBondContact O-N 2.9Å; W361-I370 HydrophobicContact CD2-CD1 4.49Å; W361-I370 HydrophobicContact CG-CD1 4.2Å; W361-I370 HydrophobicContact CZ2-CG2 4.4Å
362	I	95.6	Very high	92.9	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-41.3	176	-70.1	171.8	0	0	0	111	I270 V291 L301 I303 I331 L358 E359 D364 V365 L366	I270-I362 HydrophobicContact CD1-CG2 4.16Å; V291-I362 HydrophobicContact CG1-CD1 3.91Å; L301-I362 HydrophobicContact CD1-CG2 3.59Å; L301-I362 HydrophobicContact CD2-CG2 4.49Å; I303-I362 HydrophobicContact CD1-CD1 3.76Å; I331-I362 HydrophobicContact CD1-CD1 4.41Å; L358-I362 HydrophobicContact CD1-CD1 4.44Å; L358-I362 HydrophobicContact CG-CD1 4.22Å; L358-I362 WeakPolarHBondContact O-CG1 3.48Å; L358-I362 PolarHBondContact O-N 3.07Å; E359-I362 PolarHBondContact O-N 2.91Å; E359-I362 VanDerWaalsContact O-N 3.16Å; I362-D364 VanDerWaalsContact C-N 3.27Å; I362-D364 PolarHBondContact O-N 2.63Å; I362-V365 WeakPolarHBondContact O-CB 3.27Å; I362-V365 PolarHBondContact O-N 3.41Å; I362-V365 VanDerWaalsContact O-N 3.17Å; I362-L366 HydrophobicContact CG2-CD1 3.99Å; I362-L366 HydrophobicContact CG2-CG 4.15Å; I362-L366 WeakPolarHBondContact O-CG 3.2Å; I362-L366 PolarHBondContact O-N 3.07Å
363	E	94.3	Very high	92.2	Very high	106 Å²	106	59.4 Å²	59.4	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-60.7	-38	175.1	-73.5	-166.8	169	0	0	112.1	E359 D360 L366 S367	E359-E363 WeakPolarHBondContact O-CG 3.45Å; E359-E363 PolarHBondContact O-N 2.97Å; D360-E363 PolarHBondContact O-N 3.09Å; E363-L366 PolarHBondContact O-N 3.28Å; E363-S367 VanDerWaalsContact O-CB 3.25Å; E363-S367 WeakPolarHBondContact O-CB 3.25Å; E363-S367 PolarHBondContact O-N 2.82Å; E363-S367 PolarHBondContact O-OG 3.22Å
364	D	94.8	Very high	90.8	Very high	55 Å²	55	63.5 Å²	63.5	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-67.8	-35.5	175.8	-80.4	-7.4	0	0	0	112.1	D360 W361 I362 S367 G368 K369 I370	D360-D364 PolarHBondContact O-N 2.84Å; D360-D364 VanDerWaalsContact O-N 3.1Å; W361-D364 PolarHBondContact O-N 3.31Å; I362-D364 VanDerWaalsContact C-N 3.27Å; I362-D364 PolarHBondContact O-N 2.63Å; D364-S367 WeakPolarHBondContact CA-OG 3.44Å; D364-S367 PolarHBondContact O-OG 3.5Å; D364-G368 PolarHBondContact O-N 3.08Å; D364-K369 HydrophobicContact CB-CB 4.33Å; D364-K369 HydrophobicContact CB-CD 4.39Å; D364-K369 WeakPolarHBondContact O-CB 3.33Å; D364-K369 PolarHBondContact O-N 3.37Å; D364-K369 VanDerWaalsContact OD1-CD 3.31Å; D364-K369 WeakPolarHBondContact OD1-CD 3.31Å; D364-K369 IonicContact OD1-NZ 2.82Å; D364-K369 PolarHBondContact OD1-NZ 3.48Å; D364-I370 HydrophobicContact CB-CD1 3.66Å; D364-I370 HydrophobicContact CB-CG1 3.95Å; D364-I370 PolarHBondContact O-N 3Å; D364-I370 VanDerWaalsContact O-N 3.08Å
365	V	93.3	Very high	89	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-63.8	-54.7	169.7	168.8	0	0	0	0	111.3	I270 V333 W361 I362 S367 G368 I370	I270-V365 HydrophobicContact CD1-CG1 4.21Å; I270-V365 HydrophobicContact CG1-CG1 4.25Å; V333-V365 HydrophobicContact CG2-CB 4.16Å; V333-V365 HydrophobicContact CG2-CG1 3.45Å; V333-V365 VanDerWaalsContact CG2-CG1 3.45Å; V333-V365 HydrophobicContact CG2-CG2 3.55Å; W361-V365 HydrophobicContact CD2-CG2 4.24Å; W361-V365 HydrophobicContact CE3-CG2 4.01Å; W361-V365 HydrophobicContact CH2-CG2 3.73Å; W361-V365 HydrophobicContact CZ2-CG2 3.98Å; W361-V365 HydrophobicContact CZ3-CG2 3.76Å; W361-V365 WeakPolarHBondContact O-CG2 3.47Å; W361-V365 PolarHBondContact O-N 2.9Å; I362-V365 WeakPolarHBondContact O-CB 3.27Å; I362-V365 PolarHBondContact O-N 3.41Å; I362-V365 VanDerWaalsContact O-N 3.17Å; V365-S367 PolarHBondContact O-N 3.22Å; V365-G368 WeakPolarHBondContact O-CA 3.4Å; V365-G368 PolarHBondContact O-N 2.91Å; V365-I370 HydrophobicContact CG2-CB 3.8Å; V365-I370 HydrophobicContact CG2-CD1 4.36Å; V365-I370 HydrophobicContact CG2-CG2 3.72Å
366	L	91.9	Very high	87	Confident	69 Å²	69	70 Å²	70	36%	0.361	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-28.1	-176.6	-65.6	-178.2	0	0	0	112.5	I270 D300 L301 I362 E363 G368	I270-L366 HydrophobicContact CD1-CD2 4.25Å; D300-L366 VanDerWaalsContact O-CD2 3.26Å; D300-L366 WeakPolarHBondContact O-CD2 3.47Å; L301-L366 HydrophobicContact CB-CD1 4.32Å; L301-L366 HydrophobicContact CD1-CD1 4.4Å; I362-L366 HydrophobicContact CG2-CD1 3.99Å; I362-L366 HydrophobicContact CG2-CG 4.15Å; I362-L366 WeakPolarHBondContact O-CG 3.2Å; I362-L366 PolarHBondContact O-N 3.07Å; E363-L366 PolarHBondContact O-N 3.28Å; L366-G368 VanDerWaalsContact C-N 3.27Å
367	S	92.4	Very high	84.9	Confident	70 Å²	70	69.2 Å²	69.2	49%	0.49	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-3.6	173.9	64	0	0	0	0	114.2	E363 D364 V365 K369	E363-S367 VanDerWaalsContact O-CB 3.25Å; E363-S367 WeakPolarHBondContact O-CB 3.25Å; E363-S367 PolarHBondContact O-N 2.82Å; E363-S367 PolarHBondContact O-OG 3.22Å; D364-S367 WeakPolarHBondContact CA-OG 3.44Å; D364-S367 PolarHBondContact O-OG 3.5Å; V365-S367 PolarHBondContact O-N 3.22Å; S367-K369 VanDerWaalsContact C-N 3.28Å; S367-K369 PolarHBondContact O-N 2.92Å
368	G	88.8	Confident	82.6	Confident	39 Å²	39	71.7 Å²	71.7	40%	0.402	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	10.2	180	0	0	0	0	0	114.4	D364 V365 L366 I370 N371	D364-G368 PolarHBondContact O-N 3.08Å; V365-G368 WeakPolarHBondContact O-CA 3.4Å; V365-G368 PolarHBondContact O-N 2.91Å; L366-G368 VanDerWaalsContact C-N 3.27Å; G368-I370 VanDerWaalsContact C-N 3.32Å; G368-N371 PolarHBondContact O-ND2 2.89Å
369	K	86.6	Confident	80.4	Confident	140 Å²	140	79.1 Å²	79.1	61%	0.609	42%	0.419	S	S	*	.	S	Bend	trans	-72.1	-31.2	174.1	-62.7	176.7	-161.3	155.4	0	111.6	D364 S367	D364-K369 HydrophobicContact CB-CB 4.33Å; D364-K369 HydrophobicContact CB-CD 4.39Å; D364-K369 WeakPolarHBondContact O-CB 3.33Å; D364-K369 PolarHBondContact O-N 3.37Å; D364-K369 VanDerWaalsContact OD1-CD 3.31Å; D364-K369 WeakPolarHBondContact OD1-CD 3.31Å; D364-K369 IonicContact OD1-NZ 2.82Å; D364-K369 PolarHBondContact OD1-NZ 3.48Å; S367-K369 VanDerWaalsContact C-N 3.28Å; S367-K369 PolarHBondContact O-N 2.92Å
370	I	84.1	Confident	78.2	Confident	32 Å²	32	84.3 Å²	84.3	16%	0.164	45%	0.448	C	S	.	.	S	Bend	trans	-107.7	117.8	169.2	-63.3	173.5	0	0	0	106.1	I342 W361 D364 V365 G368	I342-I370 HydrophobicContact CD1-CG2 3.93Å; I342-I370 HydrophobicContact CG1-CG2 4.35Å; I342-I370 HydrophobicContact CG2-CG2 3.84Å; W361-I370 HydrophobicContact CD2-CD1 4.49Å; W361-I370 HydrophobicContact CG-CD1 4.2Å; W361-I370 HydrophobicContact CZ2-CG2 4.4Å; D364-I370 HydrophobicContact CB-CD1 3.66Å; D364-I370 HydrophobicContact CB-CG1 3.95Å; D364-I370 PolarHBondContact O-N 3Å; D364-I370 VanDerWaalsContact O-N 3.08Å; V365-I370 HydrophobicContact CG2-CB 3.8Å; V365-I370 HydrophobicContact CG2-CD1 4.36Å; V365-I370 HydrophobicContact CG2-CG2 3.72Å; G368-I370 VanDerWaalsContact C-N 3.32Å
371	N	84.9	Confident	76.1	Confident	42 Å²	42	87.3 Å²	87.3	23%	0.225	46%	0.464	C	S	.	.			trans	-148.6	164.6	178.4	64.3	69.5	0	0	0	108.9	G368 E373 D374	G368-N371 PolarHBondContact O-ND2 2.89Å; N371-E373 PolarHBondContact OD1-N 3.29Å; N371-D374 PolarHBondContact ND2-OD2 2.92Å; N371-D374 PolarHBondContact OD1-N 3.48Å; N371-D374 PolarHBondContact OD1-OD2 3.02Å
372	T	83.3	Confident	73.9	Confident	7 Å²	7	93.5 Å²	93.5	4%	0.043	50%	0.499	C	S	.	.	S	Bend	trans	-78.3	-20	-178.6	63.1	0	0	0	0	112.7	V333 N335 D340 I342	V333-T372 HydrophobicContact CG1-CG2 4.49Å; N335-T372 HydrophobicContact CB-CG2 4.41Å; D340-T372 WeakPolarHBondContact OD2-CB 3.35Å; D340-T372 VanDerWaalsContact OD2-O 3.06Å; I342-T372 HydrophobicContact CG2-CG2 4.35Å
373	E	78.3	Confident	71.9	Confident	149 Å²	149	99.7 Å²	99.7	70%	0.696	53%	0.533	S	S	*	.	S	Bend	trans	-81.2	-20.6	-174.1	-59.1	-172.5	166.5	0	0	114	N371	N371-E373 PolarHBondContact OD1-N 3.29Å
374	D	64.7	Low	69.8	Low	94 Å²	94	102.2 Å²	102.2	50%	0.503	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-82.1	-17.3	-176.3	-78.8	-28.2	0	0	0	113.7	N371 D376	N371-D374 PolarHBondContact ND2-OD2 2.92Å; N371-D374 PolarHBondContact OD1-N 3.48Å; N371-D374 PolarHBondContact OD1-OD2 3.02Å; D374-D376 PolarHBondContact O-N 2.77Å
375	D	58.4	Low	68.2	Low	98 Å²	98	106.1 Å²	106.1	52%	0.524	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-71.7	-11.7	178.2	-80	-15.1	0	0	0	113.3	N377	D375-N377 PolarHBondContact O-N 3.49Å
376	D	55.9	Low	66.2	Low	138 Å²	138	112.9 Å²	112.9	74%	0.738	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-82.8	-3.6	-178.7	-87.9	-18.8	0	0	0	114.5	D374	D374-D376 PolarHBondContact O-N 2.77Å
377	N	50.9	Low	64.3	Low	126 Å²	126	115.4 Å²	115.4	67%	0.674	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-106.1	3.4	-168.5	-77.6	-48.6	0	0	0	116.8	D375	D375-N377 PolarHBondContact O-N 3.49Å
378	D	49.8	Very low	62.4	Low	156 Å²	156	118.4 Å²	118.4	83%	0.834	63%	0.631	S	S	*	*	S	Bend	trans	-106.1	19.2	-169.7	-89	-3.2	0	0	0	116.4
379	D	50.8	Low	60.6	Low	155 Å²	155	122.7 Å²	122.7	83%	0.829	64%	0.644	S	S	*	*	S	Bend	trans	-127.9	68.5	176.6	-91.6	-18.5	0	0	0	112.6
380	D	50.5	Low	58.8	Low	162 Å²	162	122.5 Å²	122.5	87%	0.866	65%	0.65	S	S	*	*			trans	-175.6	72.3	153.5	-92.5	-24.7	0	0	0	111.5
381	D	52.4	Low	57.3	Low	151 Å²	151	126.9 Å²	126.9	81%	0.807	67%	0.674	S	S	*	*			trans	-157.5	78.9	156.9	-97.4	-20	0	0	0	109.7
382	D	50.7	Low	55.6	Low	161 Å²	161	130.7 Å²	130.7	86%	0.861	69%	0.694	S	S	*	*			trans	-130.1	86.1	155.4	-100.3	-19.5	0	0	0	109.2	N384	D382-N384 PolarHBondContact O-N 3.37Å
383	D	52.9	Low	54.1	Low	136 Å²	136	136.1 Å²	136.1	73%	0.727	72%	0.723	S	S	*	*			trans	-50.2	121.1	157.1	-80	-36.1	0	0	0	110.2
384	N	49.7	Very low	52.8	Low	159 Å²	159	135.2 Å²	135.2	85%	0.85	72%	0.723	S	S	*	*			trans	-137	78.7	148	-87.7	-56.5	0	0	0	108.9	D382	D382-N384 PolarHBondContact O-N 3.37Å
385	D	60.9	Low	52.3	Low	137 Å²	137	137.1 Å²	137.1	73%	0.733	73%	0.733	S	S	*	*			trans	-66.3	127.3	145.5	-82.1	-26.2	0	0	0	108.4
386	D	52.5	Low	52	Low	150 Å²	150	138.7 Å²	138.7	80%	0.802	74%	0.742	S	S	*	*			trans	-167.5	88.8	141	-98	-15.3	0	0	0	108.1
387	D	52.1	Low	51.8	Low	121 Å²	121	137.9 Å²	137.9	65%	0.647	74%	0.737	S	S	*	*				51.1	114.8	116.7	-67.8	-8.5	0	0	0	119.9
388	D	51.2	Low	51.9	Low	133 Å²	133	137.9 Å²	137.9	71%	0.711	74%	0.737	S	S	*	*				89.2	139.6	117	-75.2	-14.9	0	0	0	122.5
389	D	51.2	Low	52.1	Low	129 Å²	129	136.3 Å²	136.3	69%	0.69	73%	0.729	S	S	*	*			trans	90.7	92.1	146.8	-64	-15	0	0	0	119.3
390	D	49.9	Very low	52.1	Low	136 Å²	136	135.2 Å²	135.2	73%	0.727	72%	0.723	S	S	*	*				65.2	145.2	101.7	-81.8	-10.2	0	0	0	121.2
391	D	51.6	Low	52.3	Low	125 Å²	125	134.1 Å²	134.1	67%	0.668	72%	0.717	S	S	*	*			trans	91.8	100.2	150.3	-64.2	-12.5	0	0	0	119.3
392	D	50.9	Low	52.3	Low	122 Å²	122	133.3 Å²	133.3	65%	0.652	71%	0.713	S	S	*	*				91.3	120.6	108.9	-71.7	-12.1	0	0	0	120.3
393	D	51	Low	52.7	Low	121 Å²	121	133.1 Å²	133.1	65%	0.647	71%	0.712	S	S	*	*				81.8	119.2	124.8	-68.4	-11.3	0	0	0	120.3
394	D	51	Low	52.7	Low	129 Å²	129	138.1 Å²	138.1	69%	0.69	74%	0.739	S	S	*	*				63.5	112.4	123	-65.3	-13.8	0	0	0	118
395	D	53.3	Low	52.8	Low	135 Å²	135	137.1 Å²	137.1	72%	0.722	73%	0.733	S	S	*	*				167.3	122.9	92.2	-97.3	-26.6	0	0	0	110.3
396	D	52.4	Low	52.4	Low	130 Å²	130	137.1 Å²	137.1	70%	0.695	73%	0.733	S	S	*	*				62	134.8	123.8	-74.3	-9	0	0	0	123.5
397	D	52.6	Low	52.4	Low	122 Å²	122	136.4 Å²	136.4	65%	0.652	73%	0.729	S	S	*	*			trans	88.6	102.4	136.5	-66.4	-7.8	0	0	0	120.4
398	D	53.2	Low	52.4	Low	125 Å²	125	137.3 Å²	137.3	67%	0.668	73%	0.734	S	S	*	*				101.6	122.8	108.5	-76	-12	0	0	0	120.4
399	D	52.8	Low	52.5	Low	123 Å²	123	137.6 Å²	137.6	66%	0.658	74%	0.736	S	S	*	*			trans	84.5	110.6	132	-68	-10.9	0	0	0	121
400	D	52.3	Low	52.5	Low	133 Å²	133	138.1 Å²	138.1	71%	0.711	74%	0.739	S	S	*	*				63.6	116	120.3	-67	-15.1	0	0	0	119.4
401	D	54.2	Low	52.7	Low	138 Å²	138	138.3 Å²	138.3	74%	0.738	74%	0.739	S	S	*	*				178	146	86.5	-102	-30.3	0	0	0	112.8
402	D	52.7	Low	52.8	Low	134 Å²	134	139.3 Å²	139.3	72%	0.717	75%	0.745	S	S	*	*			trans	72.5	105.7	151.8	-65	-26.9	0	0	0	121.8
403	D	58.7	Low	53	Low	158 Å²	158	140.8 Å²	140.8	85%	0.845	75%	0.753	S	S	*	*				-174	128.3	101.5	-94.2	-26.3	0	0	0	112.9
404	D	51.7	Low	53.2	Low	241 Å²	241	142.5 Å²	142.5	100%	1.289	76%	0.762	S	S	*	*			trans	77.2	0	163.8	-77.7	-21.1	0	0	0	123.5

Retrieved 404 of 404 residues in 98.1 ms (Link to these results)

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