A0A087XGA0_POEFO Loading...

Serine/threonine kinase 19

AlphaFold DB , UniProt , Accession A0A087XGA0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 254 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	36.1	Very low	36.9	Very low	252 Å²	252	168.2 Å²	168.2	100%	1.241	88%	0.875	S	S	*	*				0	113.4	0	-110.4	169.2	170.2	0	0	108.6
2	N	33.4	Very low	36.7	Very low	146 Å²	146	170.4 Å²	170.4	78%	0.781	87%	0.874	S	S	*	*			trans	-70.8	144	177.8	-85.4	-46.5	0	0	0	111.2
3	R	36.3	Very low	36.5	Very low	250 Å²	250	172.8 Å²	172.8	94%	0.943	87%	0.874	S	S	*	*			trans	-150.6	98.6	141.7	-109.6	170	-169.8	-177	2.2	110.6
4	K	40.5	Very low	36.5	Very low	185 Å²	185	169 Å²	169	80%	0.804	87%	0.867	S	S	*	*			trans	-60.1	139.7	166	-58.7	174.9	176	-179.3	0	110.2
5	R	39.5	Very low	36.2	Very low	249 Å²	249	171.5 Å²	171.5	94%	0.94	87%	0.869	S	S	*	*			trans	-145.2	93.6	153.4	-75.7	-172.5	173.7	171.2	-3.7	106.1
6	A	38.4	Very low	36.1	Very low	92 Å²	92	173.6 Å²	173.6	76%	0.76	87%	0.87	S	S	*	*				74.9	119.2	77.6	0	0	0	0	0	112.2
7	L	36.8	Very low	35.8	Very low	170 Å²	170	177.1 Å²	177.1	89%	0.89	87%	0.871	S	S	*	*			trans	-51	140.4	178	-72.4	106.1	0	0	0	112.4
8	V	38.3	Very low	35.7	Very low	150 Å²	150	180.1 Å²	180.1	91%	0.909	87%	0.871	S	S	*	*			trans	-95.9	99.3	162	179.1	0	0	0	0	107.2
9	S	34.9	Very low	35.4	Very low	95 Å²	95	178.2 Å²	178.2	66%	0.664	87%	0.866	S	S	*	*			trans	-102.6	155.3	157.7	50.6	0	0	0	0	108.5
10	D	35.7	Very low	35.2	Very low	158 Å²	158	173.1 Å²	173.1	85%	0.845	86%	0.862	S	S	*	*			trans	82.9	90.6	174.8	-77.1	-25.4	0	0	0	118.9
11	A	35.8	Very low	35.1	Very low	103 Å²	103	171.2 Å²	171.2	85%	0.851	86%	0.86	S	S	*	*			trans	-150.2	48.5	142.6	0	0	0	0	0	112.2
12	F	35.1	Very low	34.8	Very low	195 Å²	195	168.2 Å²	168.2	86%	0.855	84%	0.842	S	S	*	*			trans	-100.2	98	163.4	-90.4	-86.9	0	0	0	109.9
13	K	33.3	Very low	34.8	Very low	201 Å²	201	170.9 Å²	170.9	87%	0.874	85%	0.847	S	S	*	*			trans	-143.6	95.9	156.5	-73.8	-167.9	-179.1	179.2	0	109.7	K15	K13-K15 PolarHBondContact O-N 2.96Å
14	P	37.5	Very low	34.4	Very low	120 Å²	120	169 Å²	169	78%	0.779	85%	0.846	S	S	*	*			trans	-72.9	122.3	167.9	26.9	-29.1	0	0	0	110.1	K16	P14-K16 PolarHBondContact O-N 3.06Å
15	K	32.1	Very low	33.8	Very low	206 Å²	206	164 Å²	164	90%	0.896	85%	0.847	S	S	*	*			trans	-66	110.4	170.8	-103.2	177.6	173.9	174.3	0	109.4	K13 R17	K13-K15 PolarHBondContact O-N 2.96Å; K15-R17 PolarHBondContact O-N 3.29Å; K15-R17 VanDerWaalsContact O-N 3.1Å
16	K	34.7	Very low	33.4	Very low	205 Å²	205	156.9 Å²	156.9	89%	0.891	84%	0.842	S	S	*	*			trans	-59.3	102.9	167.4	-169.6	173.7	-175.1	173	0	109.8	P14	P14-K16 PolarHBondContact O-N 3.06Å
17	R	31.1	Very low	32.9	Very low	234 Å²	234	156.4 Å²	156.4	88%	0.883	85%	0.846	S	S	*	*			trans	-82.6	121.2	165.2	-99	-176.5	166.7	175.8	-3.4	108.5	K15	K15-R17 PolarHBondContact O-N 3.29Å; K15-R17 VanDerWaalsContact O-N 3.1Å
18	R	33.5	Very low	32.8	Very low	231 Å²	231	156 Å²	156	87%	0.872	85%	0.845	S	S	*	*			trans	-99.3	96.9	-178.3	-167.2	178.2	-177.8	172.1	-0.5	106.2
19	N	30.4	Very low	32.7	Very low	144 Å²	144	157.6 Å²	157.6	77%	0.77	84%	0.842	S	S	*	*			trans	-105.4	103.2	167.9	-78.6	7.8	0	0	0	107.5
20	G	31	Very low	32.7	Very low	76 Å²	76	157.2 Å²	157.2	78%	0.784	85%	0.854	S	S	*	*			trans	-67.1	130.4	162.8	0	0	0	0	0	108.6
21	T	31.8	Very low	32.5	Very low	134 Å²	134	152.9 Å²	152.9	82%	0.822	85%	0.846	S	S	*	*			trans	-129.6	116.3	156.5	-43.5	0	0	0	0	105.6
22	E	29.9	Very low	32.7	Very low	188 Å²	188	156.3 Å²	156.3	88%	0.879	84%	0.844	S	S	*	*			trans	-64.9	142.9	-179.5	-68.5	172	120.6	0	0	110.4
23	K	33.5	Very low	33.2	Very low	202 Å²	202	153 Å²	153	88%	0.878	84%	0.843	S	S	*	*			trans	-67.9	134.6	-178.6	-65.9	-179.7	173.9	-175.5	0	110.8
24	F	28	Very low	34.1	Very low	211 Å²	211	146 Å²	146	93%	0.925	82%	0.822	S	S	*	*			trans	-125.3	123.1	149.5	-93.4	-88.3	0	0	0	108.4
25	G	29.3	Very low	35.7	Very low	80 Å²	80	145.2 Å²	145.2	83%	0.825	81%	0.811	S	S	*	*			trans	-81.6	150.1	-165.2	0	0	0	0	0	114.7
26	A	30.1	Very low	37.8	Very low	100 Å²	100	136.7 Å²	136.7	83%	0.826	78%	0.775	S	S	*	*			trans	-138	129	139.5	0	0	0	0	0	105	D28	A26-D28 PolarHBondContact O-N 3.14Å
27	G	29.1	Very low	39.7	Very low	82 Å²	82	130.1 Å²	130.1	85%	0.845	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-57.7	132.5	-168.1	0	0	0	0	0	112.6
28	D	34.2	Very low	42.1	Very low	161 Å²	161	120.8 Å²	120.8	86%	0.861	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-95.4	119.3	151.5	-160.6	32.7	0	0	0	105.3	A26 G30	A26-D28 PolarHBondContact O-N 3.14Å; D28-G30 PolarHBondContact O-N 2.8Å
29	E	35.5	Very low	44.5	Very low	183 Å²	183	110.3 Å²	110.3	86%	0.855	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-53.4	136.4	-177.2	-66.8	179.4	141.7	0	0	109.7	G31	E29-G31 VanDerWaalsContact C-N 3.28Å; E29-G31 PolarHBondContact O-N 3.03Å
30	G	35.1	Very low	46.9	Very low	88 Å²	88	103.7 Å²	103.7	91%	0.907	64%	0.643	S	S	*	*			trans	-59.3	92.4	171.6	0	0	0	0	0	110.4	D28	D28-G30 PolarHBondContact O-N 2.8Å
31	G	32.3	Very low	49.4	Very low	66 Å²	66	104.5 Å²	104.5	68%	0.68	63%	0.627	S	S	*	*			trans	-82.4	126.5	152	0	0	0	0	0	107.3	E29	E29-G31 VanDerWaalsContact C-N 3.28Å; E29-G31 PolarHBondContact O-N 3.03Å
32	E	39.3	Very low	51.9	Low	176 Å²	176	102.9 Å²	102.9	82%	0.822	61%	0.613	S	S	*	*			trans	-35.4	146.8	157.1	-66.7	173.9	138.4	0	0	110.3	A34	E32-A34 VanDerWaalsContact C-N 3.31Å; E32-A34 WeakPolarHBondContact O-CA 3.49Å; E32-A34 PolarHBondContact O-N 3.1Å
33	P	45.4	Very low	54.4	Low	126 Å²	126	94.2 Å²	94.2	82%	0.818	57%	0.572	S	S	*	*			trans	-53.9	103	-179.8	24	-32.1	0	0	0	107.3	D35	P33-D35 PolarHBondContact O-N 3.04Å
34	A	51.3	Low	56.7	Low	54 Å²	54	84.8 Å²	84.8	45%	0.446	53%	0.532	S	S	.	.			trans	-54.6	113.5	-172.9	0	0	0	0	0	105.3	E32 M36	E32-A34 VanDerWaalsContact C-N 3.31Å; E32-A34 WeakPolarHBondContact O-CA 3.49Å; E32-A34 PolarHBondContact O-N 3.1Å; A34-M36 PolarHBondContact O-N 3.13Å
35	D	72.1	Confident	59.2	Low	102 Å²	102	79.9 Å²	79.9	55%	0.545	52%	0.519	S	S	.	.			trans	-44.7	122.2	-169.2	-176.4	-1.1	0	0	0	107.5	P33 K37 S38 T39	P33-D35 PolarHBondContact O-N 3.04Å; D35-K37 CarbonylContact O-C 3.57Å; D35-K37 PolarHBondContact O-N 2.79Å; D35-K37 PolarHBondContact OD1-N 3.19Å; D35-S38 PolarHBondContact N-OG 3.47Å; D35-S38 WeakPolarHBondContact O-CA 3.37Å; D35-S38 WeakPolarHBondContact O-CB 3.49Å; D35-S38 PolarHBondContact O-N 3.09Å; D35-S38 PolarHBondContact O-OG 3.46Å; D35-T39 PolarHBondContact O-N 2.96Å; D35-T39 VanDerWaalsContact O-N 3.08Å
36	M	75.9	Confident	61.5	Low	27 Å²	27	78.1 Å²	78.1	13%	0.133	49%	0.49	C	S	.	.	H	α-helix	trans	-56.8	-27.6	-172.9	-86.2	-148.7	-132.3	0	0	111.6	A34 T39 L40 L74 V75 E78	A34-M36 PolarHBondContact O-N 3.13Å; M36-T39 PolarHBondContact O-N 2.84Å; M36-L40 WeakPolarHBondContact O-CB 3.49Å; M36-L40 PolarHBondContact O-N 3.41Å; M36-L74 VanDerWaalsContact CE-C 3.4Å; M36-L74 HydrophobicContact CE-CB 4.27Å; M36-L74 WeakPolarHBondContact CE-O 3.17Å; M36-V75 VanDerWaalsContact CE-CA 3.44Å; M36-V75 HydrophobicContact CE-CB 4.48Å; M36-V75 HydrophobicContact CE-CG2 4.34Å; M36-V75 HydrophobicContact SD-CB 4.45Å; M36-V75 HydrophobicContact SD-CG2 4.31Å; M36-E78 HydrophobicContact CB-CB 4.36Å; M36-E78 HydrophobicContact CE-CB 3.39Å; M36-E78 HydrophobicContact CE-CG 3.21Å; M36-E78 HydrophobicContact CG-CB 4.32Å; M36-E78 HydrophobicContact CG-CG 4.37Å; M36-E78 HydrophobicContact SD-CB 3.61Å; M36-E78 HydrophobicContact SD-CG 4.02Å
37	K	75.9	Confident	63.8	Low	67 Å²	67	73.6 Å²	73.6	29%	0.291	45%	0.452	S	S	.	.	H	α-helix	trans	-59	-47.7	169.7	-163.4	169.9	-175.7	160.4	0	112.5	D35 T39 L40 E41 E87	D35-K37 CarbonylContact O-C 3.57Å; D35-K37 PolarHBondContact O-N 2.79Å; D35-K37 PolarHBondContact OD1-N 3.19Å; K37-T39 PolarHBondContact O-N 2.94Å; K37-L40 WeakPolarHBondContact O-CB 3.43Å; K37-L40 PolarHBondContact O-N 3.12Å; K37-E41 WeakPolarHBondContact O-CB 3.34Å; K37-E41 VanDerWaalsContact O-CG 3.31Å; K37-E41 WeakPolarHBondContact O-CG 3.48Å; K37-E41 PolarHBondContact O-N 3.04Å; K37-E87 IonicContact NZ-OE2 3.11Å; K37-E87 PolarHBondContact NZ-OE2 3.42Å
38	S	81.1	Confident	65.8	Low	39 Å²	39	70.8 Å²	70.8	27%	0.273	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-38.6	175.3	74.6	0	0	0	0	112.7	D35 L40 E41 N42	D35-S38 PolarHBondContact N-OG 3.47Å; D35-S38 WeakPolarHBondContact O-CA 3.37Å; D35-S38 WeakPolarHBondContact O-CB 3.49Å; D35-S38 PolarHBondContact O-N 3.09Å; D35-S38 PolarHBondContact O-OG 3.46Å; S38-L40 VanDerWaalsContact C-N 3.34Å; S38-E41 PolarHBondContact O-N 3.38Å; S38-N42 WeakPolarHBondContact O-CB 3.4Å; S38-N42 PolarHBondContact O-N 2.8Å; S38-N42 PolarHBondContact O-ND2 2.77Å; S38-N42 VanDerWaalsContact O-ND2 3.16Å
39	T	82.6	Confident	67.6	Low	11 Å²	11	67.8 Å²	67.8	7%	0.067	40%	0.396	C	S	.	.	H	α-helix	trans	-63.2	-44.1	174.7	-59.8	0	0	0	0	110.6	D35 M36 K37 N42 L43 L65 V68 H69	D35-T39 PolarHBondContact O-N 2.96Å; D35-T39 VanDerWaalsContact O-N 3.08Å; M36-T39 PolarHBondContact O-N 2.84Å; K37-T39 PolarHBondContact O-N 2.94Å; T39-N42 PolarHBondContact O-N 3.2Å; T39-L43 HydrophobicContact CG2-CD1 4.45Å; T39-L43 WeakPolarHBondContact O-CG 3.35Å; T39-L43 PolarHBondContact O-N 2.9Å; T39-L65 HydrophobicContact CG2-CD2 4.16Å; T39-V68 HydrophobicContact CG2-CB 4.12Å; T39-V68 HydrophobicContact CG2-CG1 3.82Å; T39-V68 HydrophobicContact CG2-CG2 4.25Å; T39-H69 PolarHBondContact OG1-NE2 3.02Å; T39-H69 VanDerWaalsContact OG1-NE2 3.14Å
40	L	82.3	Confident	69.1	Low	4 Å²	4	67.9 Å²	67.9	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-64.3	-45.8	178	-174.1	67.6	0	0	0	111.2	M36 K37 S38 N42 L43 M44 V60 L65 L88 F104	M36-L40 WeakPolarHBondContact O-CB 3.49Å; M36-L40 PolarHBondContact O-N 3.41Å; K37-L40 WeakPolarHBondContact O-CB 3.43Å; K37-L40 PolarHBondContact O-N 3.12Å; S38-L40 VanDerWaalsContact C-N 3.34Å; L40-N42 VanDerWaalsContact C-N 3.33Å; L40-N42 PolarHBondContact O-N 3.4Å; L40-L43 PolarHBondContact O-N 3.01Å; L40-M44 HydrophobicContact CD1-CE 4.16Å; L40-M44 HydrophobicContact CD2-CE 4.11Å; L40-M44 HydrophobicContact CG-CE 3.91Å; L40-M44 WeakPolarHBondContact O-CB 3.48Å; L40-M44 VanDerWaalsContact O-CG 3.3Å; L40-M44 WeakPolarHBondContact O-CG 3.22Å; L40-M44 PolarHBondContact O-N 2.99Å; L40-V60 HydrophobicContact CD1-CB 3.84Å; L40-V60 HydrophobicContact CD1-CG1 3.89Å; L40-V60 HydrophobicContact CD1-CG2 4.09Å; L40-L65 HydrophobicContact CD1-CD2 4.44Å; L40-L88 HydrophobicContact CD2-CD1 3.65Å; L40-L88 HydrophobicContact CD2-CD2 4.29Å; L40-F104 HydrophobicContact CD2-CE1 3.84Å; L40-F104 HydrophobicContact CD2-CE2 4.2Å; L40-F104 HydrophobicContact CD2-CZ 3.55Å; L40-F104 HydrophobicContact CG-CE2 4.48Å; L40-F104 HydrophobicContact CG-CZ 4.16Å
41	E	83.5	Confident	70.7	Confident	94 Å²	94	67.4 Å²	67.4	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-57.5	-45.8	174.5	-75.6	175	-175.7	0	0	111.2	K37 S38 L43 M44 T45 F104	K37-E41 WeakPolarHBondContact O-CB 3.34Å; K37-E41 VanDerWaalsContact O-CG 3.31Å; K37-E41 WeakPolarHBondContact O-CG 3.48Å; K37-E41 PolarHBondContact O-N 3.04Å; S38-E41 PolarHBondContact O-N 3.38Å; E41-L43 PolarHBondContact O-N 3.47Å; E41-M44 CarbonylContact O-C 3.55Å; E41-M44 WeakPolarHBondContact O-CA 3.35Å; E41-M44 WeakPolarHBondContact O-CB 3.43Å; E41-M44 PolarHBondContact O-N 2.86Å; E41-M44 VanDerWaalsContact O-N 3.12Å; E41-T45 WeakPolarHBondContact O-CG2 3.31Å; E41-T45 PolarHBondContact O-N 2.8Å; E41-F104 HydrophobicContact CG-CE2 4.26Å; E41-F104 HydrophobicContact CG-CZ 4.35Å
42	N	83.1	Confident	72.4	Confident	100 Å²	100	65 Å²	65	54%	0.535	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-47.4	175.5	-74.2	-27.8	0	0	0	111.7	S38 T39 L40 M44 T45 L46	S38-N42 WeakPolarHBondContact O-CB 3.4Å; S38-N42 PolarHBondContact O-N 2.8Å; S38-N42 PolarHBondContact O-ND2 2.77Å; S38-N42 VanDerWaalsContact O-ND2 3.16Å; T39-N42 PolarHBondContact O-N 3.2Å; L40-N42 VanDerWaalsContact C-N 3.33Å; L40-N42 PolarHBondContact O-N 3.4Å; N42-M44 VanDerWaalsContact C-N 3.27Å; N42-M44 PolarHBondContact O-N 2.85Å; N42-T45 PolarHBondContact O-N 2.75Å; N42-T45 VanDerWaalsContact O-N 3.14Å; N42-T45 PolarHBondContact O-OG1 2.54Å; N42-L46 PolarHBondContact O-N 3.14Å
43	L	82	Confident	73.7	Confident	5 Å²	5	63 Å²	63	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-34.3	175.6	-71.1	175.5	0	0	0	112.2	T39 L40 E41 T45 L46 V60 Q64 L65 H230	T39-L43 HydrophobicContact CG2-CD1 4.45Å; T39-L43 WeakPolarHBondContact O-CG 3.35Å; T39-L43 PolarHBondContact O-N 2.9Å; L40-L43 PolarHBondContact O-N 3.01Å; E41-L43 PolarHBondContact O-N 3.47Å; L43-T45 VanDerWaalsContact C-N 3.34Å; L43-L46 HydrophobicContact CD2-CD1 4.15Å; L43-L46 WeakPolarHBondContact O-CB 3.43Å; L43-L46 PolarHBondContact O-N 3.35Å; L43-V60 HydrophobicContact CB-CG1 3.89Å; L43-V60 HydrophobicContact CB-CG2 3.76Å; L43-V60 HydrophobicContact CD1-CG1 3.68Å; L43-V60 HydrophobicContact CG-CG1 4.43Å; L43-Q64 HydrophobicContact CD1-CB 4.36Å; L43-L65 HydrophobicContact CD1-CD2 3.71Å; L43-L65 HydrophobicContact CD1-CG 4.46Å; L43-H230 HydrophobicContact CD2-CB 4.46Å
44	M	82.6	Confident	74.7	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-29.1	174.9	-73.4	-170.3	-178.2	0	0	113.2	L40 E41 N42 L46 F47 P58 V60 F104	L40-M44 HydrophobicContact CD1-CE 4.16Å; L40-M44 HydrophobicContact CD2-CE 4.11Å; L40-M44 HydrophobicContact CG-CE 3.91Å; L40-M44 WeakPolarHBondContact O-CB 3.48Å; L40-M44 VanDerWaalsContact O-CG 3.3Å; L40-M44 WeakPolarHBondContact O-CG 3.22Å; L40-M44 PolarHBondContact O-N 2.99Å; E41-M44 CarbonylContact O-C 3.55Å; E41-M44 WeakPolarHBondContact O-CA 3.35Å; E41-M44 WeakPolarHBondContact O-CB 3.43Å; E41-M44 PolarHBondContact O-N 2.86Å; E41-M44 VanDerWaalsContact O-N 3.12Å; N42-M44 VanDerWaalsContact C-N 3.27Å; N42-M44 PolarHBondContact O-N 2.85Å; M44-L46 PolarHBondContact O-N 3.03Å; M44-F47 VanDerWaalsContact O-CB 3.28Å; M44-F47 WeakPolarHBondContact O-CB 3.35Å; M44-F47 PolarHBondContact O-N 3.46Å; M44-F47 VanDerWaalsContact O-N 3.16Å; M44-P58 HydrophobicContact CB-CB 3.88Å; M44-P58 HydrophobicContact CG-CB 3.84Å; M44-P58 HydrophobicContact SD-CB 4.05Å; M44-V60 HydrophobicContact CB-CG2 4.39Å; M44-V60 HydrophobicContact CE-CG2 4.42Å; M44-V60 HydrophobicContact CG-CG2 3.46Å; M44-V60 VanDerWaalsContact CG-CG2 3.46Å; M44-F104 HydrophobicContact CE-CD2 3.42Å; M44-F104 VanDerWaalsContact CE-CD2 3.42Å; M44-F104 HydrophobicContact CE-CE2 3.56Å; M44-F104 HydrophobicContact CE-CG 4.09Å; M44-F104 HydrophobicContact CE-CZ 4.34Å; M44-F104 HydrophobicContact SD-CD2 3.25Å; M44-F104 WeakPolarHBondContact SD-CD2 3.5Å; M44-F104 HydrophobicContact SD-CE2 3.27Å; M44-F104 WeakPolarHBondContact SD-CE2 3.47Å; M44-F104 HydrophobicContact SD-CG 4.4Å; M44-F104 HydrophobicContact SD-CZ 4.44Å
45	T	81.3	Confident	75.6	Confident	107 Å²	107	61 Å²	61	66%	0.656	31%	0.312	S	S	*	.	H	α-helix	trans	-66.6	-27.9	172.1	70.9	0	0	0	0	112.5	E41 N42 L43 F47	E41-T45 WeakPolarHBondContact O-CG2 3.31Å; E41-T45 PolarHBondContact O-N 2.8Å; N42-T45 PolarHBondContact O-N 2.75Å; N42-T45 VanDerWaalsContact O-N 3.14Å; N42-T45 PolarHBondContact O-OG1 2.54Å; L43-T45 VanDerWaalsContact C-N 3.34Å; T45-F47 PolarHBondContact O-N 2.86Å
46	L	77	Confident	75.9	Confident	43 Å²	43	56.3 Å²	56.3	23%	0.225	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.7	175.5	-58	177.5	0	0	0	112.5	N42 L43 M44 P48 K226 Y227	N42-L46 PolarHBondContact O-N 3.14Å; L43-L46 HydrophobicContact CD2-CD1 4.15Å; L43-L46 WeakPolarHBondContact O-CB 3.43Å; L43-L46 PolarHBondContact O-N 3.35Å; M44-L46 PolarHBondContact O-N 3.03Å; L46-P48 WeakPolarHBondContact O-CD 3.45Å; L46-K226 HydrophobicContact CD1-CB 4.23Å; L46-K226 HydrophobicContact CD2-CB 4.47Å; L46-Y227 HydrophobicContact CB-CD2 4.3Å
47	F	77.9	Confident	76.2	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.026	28%	0.282	C	S	.	.	S	Bend	trans	-70.5	122.9	178.3	-173.8	-92.2	0	0	0	110.6	M44 T45 R49 F52 L56 P58 I59 F184 F223 Y227	M44-F47 VanDerWaalsContact O-CB 3.28Å; M44-F47 WeakPolarHBondContact O-CB 3.35Å; M44-F47 PolarHBondContact O-N 3.46Å; M44-F47 VanDerWaalsContact O-N 3.16Å; T45-F47 PolarHBondContact O-N 2.86Å; F47-R49 VanDerWaalsContact C-N 3.3Å; F47-R49 HydrophobicContact CD1-CG 3.87Å; F47-R49 HydrophobicContact CE1-CG 4.49Å; F47-R49 PolarHBondContact O-N 3.3Å; F47-F52 AromaticContact CE1-CD2 3.93Å; F47-F52 HydrophobicContact CE1-CD2 3.93Å; F47-F52 HydrophobicContact CE1-CE2 4.3Å; F47-F52 HydrophobicContact CE2-CE2 4.48Å; F47-F52 AromaticContact CZ-CD2 3.83Å; F47-F52 HydrophobicContact CZ-CD2 3.83Å; F47-F52 AromaticContact CZ-CE2 3.84Å; F47-F52 HydrophobicContact CZ-CE2 3.84Å; F47-L56 HydrophobicContact CZ-CB 4.47Å; F47-P58 HydrophobicContact CB-CB 4.14Å; F47-P58 HydrophobicContact CD1-CB 4.3Å; F47-P58 HydrophobicContact CG-CB 4.24Å; F47-I59 HydrophobicContact CD2-CB 4.48Å; F47-I59 WeakPolarHBondContact CD2-O 3.42Å; F47-I59 HydrophobicContact CE2-CB 4.01Å; F47-I59 HydrophobicContact CE2-CG1 4.33Å; F47-F184 HydrophobicContact CD2-CE2 4.36Å; F47-F184 AromaticContact CE2-CD2 3.71Å; F47-F184 HydrophobicContact CE2-CD2 3.71Å; F47-F184 AromaticContact CE2-CE2 3.54Å; F47-F184 HydrophobicContact CE2-CE2 3.54Å; F47-F184 HydrophobicContact CZ-CD2 4.12Å; F47-F184 HydrophobicContact CZ-CE2 4.39Å; F47-F223 HydrophobicContact CE2-CE1 4.41Å; F47-Y227 HydrophobicContact CD2-CE2 4.48Å
48	P	70.4	Confident	76.5	Confident	22 Å²	22	52 Å²	52	14%	0.143	27%	0.268	C	S	.	.			trans	-80.1	75.3	-175.4	34.4	-37.7	0	0	0	111.6	L46 K50 L51 F223	L46-P48 WeakPolarHBondContact O-CD 3.45Å; P48-K50 PolarHBondContact O-N 3.29Å; P48-K50 VanDerWaalsContact O-N 3.14Å; P48-L51 HydrophobicContact CB-CB 4.48Å; P48-L51 HydrophobicContact CB-CD1 3.46Å; P48-L51 VanDerWaalsContact CB-CD1 3.46Å; P48-L51 HydrophobicContact CB-CG 3.9Å; P48-L51 HydrophobicContact CG-CD1 3.51Å; P48-L51 HydrophobicContact CG-CG 4.34Å; P48-L51 WeakPolarHBondContact O-CB 3.32Å; P48-L51 PolarHBondContact O-N 3.24Å; P48-F223 VanDerWaalsContact CD-CD1 3.47Å; P48-F223 HydrophobicContact CG-CB 4.45Å; P48-F223 HydrophobicContact CG-CD1 3.33Å; P48-F223 HydrophobicContact CG-CE1 3.78Å; P48-F223 HydrophobicContact CG-CG 4.12Å
49	R	73.1	Confident	76.7	Confident	99 Å²	99	50.1 Å²	50.1	37%	0.374	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-51.1	-38.5	-179.6	-61.2	-178.9	-174.2	-155.9	-3.4	113.1	F47 L51 F52 D54	F47-R49 VanDerWaalsContact C-N 3.3Å; F47-R49 HydrophobicContact CD1-CG 3.87Å; F47-R49 HydrophobicContact CE1-CG 4.49Å; F47-R49 PolarHBondContact O-N 3.3Å; R49-L51 VanDerWaalsContact C-N 3.26Å; R49-L51 PolarHBondContact O-N 2.92Å; R49-F52 PolarHBondContact O-N 2.92Å; R49-F52 VanDerWaalsContact O-N 3.13Å; R49-D54 PolarHBondContact O-N 3.48Å
50	K	67.8	Low	76.8	Confident	184 Å²	184	49.6 Å²	49.6	80%	0.8	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-61.3	-28.2	179.7	-63.8	-175.3	-179.9	-179	0	113.9	P48 F52 N53	P48-K50 PolarHBondContact O-N 3.29Å; P48-K50 VanDerWaalsContact O-N 3.14Å; K50-F52 PolarHBondContact O-N 3.11Å; K50-N53 PolarHBondContact O-N 3.06Å
51	L	67	Low	77	Confident	78 Å²	78	49.4 Å²	49.4	41%	0.408	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-71.8	-21.3	179.4	-67.1	174.2	0	0	0	113	P48 R49 K222	P48-L51 HydrophobicContact CB-CB 4.48Å; P48-L51 HydrophobicContact CB-CD1 3.46Å; P48-L51 VanDerWaalsContact CB-CD1 3.46Å; P48-L51 HydrophobicContact CB-CG 3.9Å; P48-L51 HydrophobicContact CG-CD1 3.51Å; P48-L51 HydrophobicContact CG-CG 4.34Å; P48-L51 WeakPolarHBondContact O-CB 3.32Å; P48-L51 PolarHBondContact O-N 3.24Å; R49-L51 VanDerWaalsContact C-N 3.26Å; R49-L51 PolarHBondContact O-N 2.92Å; L51-K222 HydrophobicContact CD1-CB 4.1Å; L51-K222 WeakPolarHBondContact CD1-O 3.44Å
52	F	69.1	Low	77.2	Confident	15 Å²	15	46.7 Å²	46.7	7%	0.066	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-108.6	15.5	-178.3	-59.9	-72.3	0	0	0	112	F47 R49 K50 D54 T55 L56 K183 F184 Y187 F223	F47-F52 AromaticContact CE1-CD2 3.93Å; F47-F52 HydrophobicContact CE1-CD2 3.93Å; F47-F52 HydrophobicContact CE1-CE2 4.3Å; F47-F52 HydrophobicContact CE2-CE2 4.48Å; F47-F52 AromaticContact CZ-CD2 3.83Å; F47-F52 HydrophobicContact CZ-CD2 3.83Å; F47-F52 AromaticContact CZ-CE2 3.84Å; F47-F52 HydrophobicContact CZ-CE2 3.84Å; R49-F52 PolarHBondContact O-N 2.92Å; R49-F52 VanDerWaalsContact O-N 3.13Å; K50-F52 PolarHBondContact O-N 3.11Å; F52-D54 PolarHBondContact O-N 3.36Å; F52-D54 VanDerWaalsContact O-N 3.1Å; F52-T55 VanDerWaalsContact O-CB 3.23Å; F52-T55 WeakPolarHBondContact O-CB 3.42Å; F52-T55 PolarHBondContact O-N 2.92Å; F52-T55 PolarHBondContact O-OG1 3.41Å; F52-L56 HydrophobicContact CB-CB 4.18Å; F52-L56 HydrophobicContact CB-CD1 4.17Å; F52-L56 HydrophobicContact CB-CG 4.21Å; F52-L56 HydrophobicContact CD1-CD1 3.52Å; F52-L56 HydrophobicContact CD1-CG 4.4Å; F52-L56 HydrophobicContact CD2-CD1 4.27Å; F52-L56 HydrophobicContact CE1-CD1 3.93Å; F52-L56 HydrophobicContact CG-CB 4.39Å; F52-L56 HydrophobicContact CG-CD1 3.72Å; F52-L56 HydrophobicContact CG-CG 4.29Å; F52-L56 HydrophobicContact CZ-CD1 4.46Å; F52-K183 HydrophobicContact CE1-CB 4.38Å; F52-F184 HydrophobicContact CE1-CB 3.96Å; F52-F184 HydrophobicContact CE2-CD2 4.16Å; F52-F184 HydrophobicContact CZ-CB 3.86Å; F52-F184 AromaticContact CZ-CD2 3.97Å; F52-F184 HydrophobicContact CZ-CD2 3.97Å; F52-F184 HydrophobicContact CZ-CG 4.43Å; F52-Y187 HydrophobicContact CE1-CD2 4.06Å; F52-Y187 HydrophobicContact CE1-CE2 4.45Å; F52-Y187 HydrophobicContact CZ-CD2 4.24Å; F52-F223 AromaticContact CE2-CE1 3.87Å; F52-F223 HydrophobicContact CE2-CE1 3.87Å; F52-F223 AromaticContact CE2-CZ 3.94Å; F52-F223 HydrophobicContact CE2-CZ 3.94Å; F52-F223 HydrophobicContact CZ-CE1 4.1Å; F52-F223 AromaticContact CZ-CZ 3.67Å; F52-F223 HydrophobicContact CZ-CZ 3.67Å
53	N	65.7	Low	77.4	Confident	136 Å²	136	42.6 Å²	42.6	73%	0.727	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.3	41.2	-175.9	-61.8	-21	0	0	0	112	K50 T55	K50-N53 PolarHBondContact O-N 3.06Å; N53-T55 PolarHBondContact O-N 3.49Å; N53-T55 PolarHBondContact O-OG1 3.14Å
54	D	68.3	Low	77.5	Confident	79 Å²	79	42.4 Å²	42.4	42%	0.422	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	15.8	-178.7	-82.7	-58	0	0	0	115.5	R49 F52 K111	R49-D54 PolarHBondContact O-N 3.48Å; F52-D54 PolarHBondContact O-N 3.36Å; F52-D54 VanDerWaalsContact O-N 3.1Å; D54-K111 VanDerWaalsContact O-CD 3.23Å; D54-K111 WeakPolarHBondContact O-CD 3.38Å; D54-K111 VanDerWaalsContact O-CE 3.27Å; D54-K111 WeakPolarHBondContact O-CE 3.23Å; D54-K111 PolarHBondContact O-NZ 3Å; D54-K111 IonicContact OD1-NZ 2.85Å; D54-K111 PolarHBondContact OD1-NZ 3.49Å
55	T	68.8	Low	77.6	Confident	58 Å²	58	42.3 Å²	42.3	36%	0.356	21%	0.214	S	C	.	.			trans	-80.6	-19.8	-178.8	-44.5	0	0	0	0	112.2	F52 N53	F52-T55 VanDerWaalsContact O-CB 3.23Å; F52-T55 WeakPolarHBondContact O-CB 3.42Å; F52-T55 PolarHBondContact O-N 2.92Å; F52-T55 PolarHBondContact O-OG1 3.41Å; N53-T55 PolarHBondContact O-N 3.49Å; N53-T55 PolarHBondContact O-OG1 3.14Å
56	L	77.9	Confident	77.7	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.191	C	C	.	.	S	Bend	trans	-110.4	140.5	177.9	-67.1	178.8	0	0	0	110.8	F47 F52 I178 P179 N180 F184	F47-L56 HydrophobicContact CZ-CB 4.47Å; F52-L56 HydrophobicContact CB-CB 4.18Å; F52-L56 HydrophobicContact CB-CD1 4.17Å; F52-L56 HydrophobicContact CB-CG 4.21Å; F52-L56 HydrophobicContact CD1-CD1 3.52Å; F52-L56 HydrophobicContact CD1-CG 4.4Å; F52-L56 HydrophobicContact CD2-CD1 4.27Å; F52-L56 HydrophobicContact CE1-CD1 3.93Å; F52-L56 HydrophobicContact CG-CB 4.39Å; F52-L56 HydrophobicContact CG-CD1 3.72Å; F52-L56 HydrophobicContact CG-CG 4.29Å; F52-L56 HydrophobicContact CZ-CD1 4.46Å; L56-I178 HydrophobicContact CD2-CG2 3.83Å; L56-P179 WeakPolarHBondContact CD2-O 3.3Å; L56-N180 HydrophobicContact CD2-CB 4.22Å; L56-F184 HydrophobicContact CD1-CB 3.66Å
57	P	82.1	Confident	77.8	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.019	19%	0.186	C	C	.	.			trans	-69.5	161.6	169.2	33.4	-36.3	0	0	0	110.4	I59 V103 D107 Y108 K111 I178	P57-I59 WeakPolarHBondContact O-CG1 3.32Å; P57-I59 PolarHBondContact O-N 3.46Å; P57-V103 HydrophobicContact CB-CG1 3.5Å; P57-V103 VanDerWaalsContact CB-CG1 3.5Å; P57-V103 HydrophobicContact CG-CG1 3.68Å; P57-V103 HydrophobicContact CG-CG2 4.43Å; P57-D107 HydrophobicContact CB-CB 4.28Å; P57-Y108 HydrophobicContact CG-CD2 4.45Å; P57-K111 HydrophobicContact CB-CB 4.39Å; P57-K111 HydrophobicContact CB-CG 4.02Å; P57-I178 HydrophobicContact CG-CD1 4.49Å; P57-I178 HydrophobicContact CG-CG2 4Å
58	P	82.7	Confident	78	Confident	1 Å²	1	41 Å²	41	1%	0.006	20%	0.204	C	C	.	.			trans	-64.8	120.1	175.5	-14.5	29	0	0	0	110.2	M44 F47 D107	M44-P58 HydrophobicContact CB-CB 3.88Å; M44-P58 HydrophobicContact CG-CB 3.84Å; M44-P58 HydrophobicContact SD-CB 4.05Å; F47-P58 HydrophobicContact CB-CB 4.14Å; F47-P58 HydrophobicContact CD1-CB 4.3Å; F47-P58 HydrophobicContact CG-CB 4.24Å; P58-D107 WeakPolarHBondContact CD-OD2 3.01Å
59	I	85.3	Confident	78.4	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.			trans	-105	125.2	179.5	-55.8	167.4	0	0	0	108.3	F47 P57 L93 V103 I178 F184 Y227	F47-I59 HydrophobicContact CD2-CB 4.48Å; F47-I59 WeakPolarHBondContact CD2-O 3.42Å; F47-I59 HydrophobicContact CE2-CB 4.01Å; F47-I59 HydrophobicContact CE2-CG1 4.33Å; P57-I59 WeakPolarHBondContact O-CG1 3.32Å; P57-I59 PolarHBondContact O-N 3.46Å; I59-L93 HydrophobicContact CG2-CD1 4.16Å; I59-V103 HydrophobicContact CB-CG2 4.43Å; I59-V103 HydrophobicContact CG1-CG2 3.93Å; I59-I178 HydrophobicContact CD1-CD1 3.55Å; I59-I178 HydrophobicContact CG1-CD1 3.68Å; I59-F184 HydrophobicContact CB-CE2 4.46Å; I59-F184 HydrophobicContact CB-CZ 4.17Å; I59-F184 HydrophobicContact CD1-CD1 3.88Å; I59-F184 HydrophobicContact CD1-CD2 4.33Å; I59-F184 HydrophobicContact CD1-CE1 4.04Å; I59-F184 HydrophobicContact CD1-CE2 4.49Å; I59-F184 HydrophobicContact CD1-CG 4.05Å; I59-F184 HydrophobicContact CD1-CZ 4.34Å; I59-F184 HydrophobicContact CG2-CE1 4.25Å; I59-F184 HydrophobicContact CG2-CZ 4.15Å; I59-Y227 PolarHBondContact O-OH 2.97Å
60	V	85.9	Confident	78.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.2	169.8	177.5	0	0	0	0	108.1	L40 L43 M44 Q64 G101 L102	L40-V60 HydrophobicContact CD1-CB 3.84Å; L40-V60 HydrophobicContact CD1-CG1 3.89Å; L40-V60 HydrophobicContact CD1-CG2 4.09Å; L43-V60 HydrophobicContact CB-CG1 3.89Å; L43-V60 HydrophobicContact CB-CG2 3.76Å; L43-V60 HydrophobicContact CD1-CG1 3.68Å; L43-V60 HydrophobicContact CG-CG1 4.43Å; M44-V60 HydrophobicContact CB-CG2 4.39Å; M44-V60 HydrophobicContact CE-CG2 4.42Å; M44-V60 HydrophobicContact CG-CG2 3.46Å; M44-V60 VanDerWaalsContact CG-CG2 3.46Å; V60-Q64 HydrophobicContact CG1-CB 4.46Å; V60-G101 CarbonylContact O-C 3.45Å; V60-L102 PolarHBondContact N-O 3.29Å; V60-L102 WeakPolarHBondContact O-CB 3.39Å; V60-L102 PolarHBondContact O-N 3.23Å
61	L	86.4	Confident	79	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	141	178.5	-64.5	158	0	0	0	110.2	H63 Q64 L93 F95 A99 F100 F188	L61-H63 WeakPolarHBondContact CB-CE1 3.4Å; L61-H63 PolarHBondContact O-N 3.14Å; L61-Q64 HydrophobicContact CB-CG 3.96Å; L61-Q64 VanDerWaalsContact O-CB 3.29Å; L61-Q64 WeakPolarHBondContact O-CB 3.28Å; L61-Q64 PolarHBondContact O-N 3Å; L61-L93 HydrophobicContact CD2-CD1 3.31Å; L61-F95 HydrophobicContact CD2-CZ 4.03Å; L61-A99 HydrophobicContact CD2-CB 4.48Å; L61-F100 CarbonylContact C-O 3.59Å; L61-F100 WeakPolarHBondContact CA-O 3.44Å; L61-F188 HydrophobicContact CD1-CE1 3.68Å; L61-F188 HydrophobicContact CD1-CE2 3.67Å; L61-F188 HydrophobicContact CD1-CZ 3.09Å
62	K	87.1	Confident	79.7	Confident	36 Å²	36	41.1 Å²	41.1	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-53.3	-44.2	179.2	-172	-174.7	-177	-157.5	0	111.5	Q64 L65 Y66 D76 F100 L102	K62-Q64 VanDerWaalsContact C-N 3.27Å; K62-Q64 PolarHBondContact O-N 3.29Å; K62-L65 WeakPolarHBondContact O-CB 3.42Å; K62-L65 PolarHBondContact O-N 2.7Å; K62-L65 VanDerWaalsContact O-N 3.13Å; K62-Y66 WeakPolarHBondContact CE-OH 3.47Å; K62-Y66 PolarHBondContact NZ-OH 2.96Å; K62-D76 WeakPolarHBondContact CE-OD1 3.38Å; K62-D76 IonicContact NZ-OD1 2.96Å; K62-D76 PolarHBondContact NZ-OD1 3.26Å; K62-D76 IonicContact NZ-OD2 3.01Å; K62-F100 HydrophobicContact CB-CB 4.16Å; K62-F100 HydrophobicContact CD-CD2 4.49Å; K62-F100 PolarHBondContact N-O 3.07Å; K62-L102 HydrophobicContact CB-CD1 4.31Å; K62-L102 HydrophobicContact CB-CG 4.47Å
63	H	86.5	Confident	80.4	Confident	15 Å²	15	45.5 Å²	45.5	7%	0.069	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-23.3	179.9	65.2	-93.8	0	0	0	113.5	L61 L65 Y66 D231 G234 A235	L61-H63 WeakPolarHBondContact CB-CE1 3.4Å; L61-H63 PolarHBondContact O-N 3.14Å; H63-L65 PolarHBondContact O-N 3.28Å; H63-Y66 HydrophobicContact CB-CD2 4Å; H63-Y66 HydrophobicContact CB-CE2 4.27Å; H63-Y66 WeakPolarHBondContact O-CB 3.43Å; H63-Y66 PolarHBondContact O-N 2.97Å; H63-Y66 VanDerWaalsContact O-N 3.09Å; H63-D231 PolarHBondContact CD2-O 3.45Å; H63-D231 IonicContact CD2-OD1 3.63Å; H63-D231 IonicContact CE1-OD1 2.82Å; H63-D231 IonicContact NE2-OD1 2.64Å; H63-D231 PolarHBondContact NE2-OD1 2.96Å; H63-G234 CarbonylContact O-C 3.41Å; H63-G234 WeakPolarHBondContact O-CA 3.4Å; H63-A235 PolarHBondContact CD2-N 3.08Å
64	Q	84.8	Confident	81.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-28.6	173.3	-72.8	173.7	-39.2	0	0	111.8	L43 V60 L61 K62 Y66 S67 Y227 H230 D231	L43-Q64 HydrophobicContact CD1-CB 4.36Å; V60-Q64 HydrophobicContact CG1-CB 4.46Å; L61-Q64 HydrophobicContact CB-CG 3.96Å; L61-Q64 VanDerWaalsContact O-CB 3.29Å; L61-Q64 WeakPolarHBondContact O-CB 3.28Å; L61-Q64 PolarHBondContact O-N 3Å; K62-Q64 VanDerWaalsContact C-N 3.27Å; K62-Q64 PolarHBondContact O-N 3.29Å; Q64-Y66 VanDerWaalsContact C-N 3.31Å; Q64-Y66 PolarHBondContact O-N 3.22Å; Q64-S67 WeakPolarHBondContact O-CB 3.05Å; Q64-S67 PolarHBondContact O-N 3.24Å; Q64-S67 PolarHBondContact O-OG 3.07Å; Q64-Y227 PolarHBondContact NE2-O 3.04Å; Q64-H230 HydrophobicContact CB-CB 4.3Å; Q64-H230 HydrophobicContact CG-CB 4.21Å; Q64-D231 HydrophobicContact CG-CB 4.25Å
65	L	84	Confident	82.1	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-33	175.9	-64.4	169.3	0	0	0	112	T39 L40 L43 K62 H63 S67 V68 H69 V75 V79 L102	T39-L65 HydrophobicContact CG2-CD2 4.16Å; L40-L65 HydrophobicContact CD1-CD2 4.44Å; L43-L65 HydrophobicContact CD1-CD2 3.71Å; L43-L65 HydrophobicContact CD1-CG 4.46Å; K62-L65 WeakPolarHBondContact O-CB 3.42Å; K62-L65 PolarHBondContact O-N 2.7Å; K62-L65 VanDerWaalsContact O-N 3.13Å; H63-L65 PolarHBondContact O-N 3.28Å; L65-S67 PolarHBondContact O-N 2.69Å; L65-V68 PolarHBondContact O-N 2.77Å; L65-V68 VanDerWaalsContact O-N 3.08Å; L65-H69 PolarHBondContact O-N 3.25Å; L65-V75 HydrophobicContact CB-CG1 3.62Å; L65-V75 HydrophobicContact CD1-CG1 3.99Å; L65-V75 HydrophobicContact CG-CG1 4.46Å; L65-V79 HydrophobicContact CD1-CG2 3.72Å; L65-L102 HydrophobicContact CD1-CD1 3.64Å
66	Y	83.9	Confident	82.9	Confident	46 Å²	46	39 Å²	39	18%	0.18	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-18.6	175	-52.1	-36	0	0	0	112.8	K62 H63 Q64 V68 H69 K72 V75 D76	K62-Y66 WeakPolarHBondContact CE-OH 3.47Å; K62-Y66 PolarHBondContact NZ-OH 2.96Å; H63-Y66 HydrophobicContact CB-CD2 4Å; H63-Y66 HydrophobicContact CB-CE2 4.27Å; H63-Y66 WeakPolarHBondContact O-CB 3.43Å; H63-Y66 PolarHBondContact O-N 2.97Å; H63-Y66 VanDerWaalsContact O-N 3.09Å; Q64-Y66 VanDerWaalsContact C-N 3.31Å; Q64-Y66 PolarHBondContact O-N 3.22Å; Y66-V68 VanDerWaalsContact C-N 3.3Å; Y66-H69 CarbonylContact C-O 3.59Å; Y66-H69 VanDerWaalsContact O-O 3.14Å; Y66-K72 HydrophobicContact CD1-CB 4.18Å; Y66-K72 HydrophobicContact CD1-CG 3.94Å; Y66-K72 HydrophobicContact CE1-CB 4.08Å; Y66-K72 HydrophobicContact CE1-CG 4.26Å; Y66-K72 HydrophobicContact CG-CG 4.15Å; Y66-V75 HydrophobicContact CD1-CB 4.01Å; Y66-V75 HydrophobicContact CD1-CG1 3.84Å; Y66-V75 HydrophobicContact CD1-CG2 4.24Å; Y66-V75 HydrophobicContact CE1-CB 3.83Å; Y66-V75 HydrophobicContact CE1-CG1 3.57Å; Y66-D76 PolarHBondContact OH-OD1 3.27Å
67	S	80.1	Confident	83.3	Confident	17 Å²	17	45.8 Å²	45.8	12%	0.119	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-18.4	174.3	77.7	0	0	0	0	113.7	Q64 L65 H230	Q64-S67 WeakPolarHBondContact O-CB 3.05Å; Q64-S67 PolarHBondContact O-N 3.24Å; Q64-S67 PolarHBondContact O-OG 3.07Å; L65-S67 PolarHBondContact O-N 2.69Å; S67-H230 WeakPolarHBondContact CB-O 3.31Å; S67-H230 PolarHBondContact OG-ND1 3.23Å; S67-H230 PolarHBondContact OG-O 2.82Å
68	V	81.4	Confident	83.5	Confident	65 Å²	65	48.4 Å²	48.4	39%	0.394	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-40.5	-179.4	-176.5	0	0	0	0	110.3	T39 L65 Y66	T39-V68 HydrophobicContact CG2-CB 4.12Å; T39-V68 HydrophobicContact CG2-CG1 3.82Å; T39-V68 HydrophobicContact CG2-CG2 4.25Å; L65-V68 PolarHBondContact O-N 2.77Å; L65-V68 VanDerWaalsContact O-N 3.08Å; Y66-V68 VanDerWaalsContact C-N 3.3Å
69	H	78.5	Confident	83.6	Confident	43 Å²	43	48.6 Å²	48.6	20%	0.199	25%	0.247	C	C	.	.			trans	-112	121.4	-178.9	-65.7	-76.4	0	0	0	110.3	T39 L65 Y66 D71 V75	T39-H69 PolarHBondContact OG1-NE2 3.02Å; T39-H69 VanDerWaalsContact OG1-NE2 3.14Å; L65-H69 PolarHBondContact O-N 3.25Å; Y66-H69 CarbonylContact C-O 3.59Å; Y66-H69 VanDerWaalsContact O-O 3.14Å; H69-D71 VanDerWaalsContact C-N 3.25Å; H69-D71 PolarHBondContact O-N 3.23Å; H69-V75 HydrophobicContact CB-CG2 3.55Å
70	N	71	Confident	83.6	Confident	156 Å²	156	52 Å²	52	83%	0.834	27%	0.265	S	S	*	.	S	Bend	trans	-68.2	-24.9	179.2	-76	-23.5	0	0	0	112.9	K72	N70-K72 PolarHBondContact O-N 3.13Å
71	D	81.9	Confident	83.6	Confident	96 Å²	96	57.5 Å²	57.5	51%	0.513	29%	0.289	S	S	.	.			trans	-88	86.8	-176.6	-70.5	-37.9	0	0	0	111.9	H69 T73 L74 V75	H69-D71 VanDerWaalsContact C-N 3.25Å; H69-D71 PolarHBondContact O-N 3.23Å; D71-T73 PolarHBondContact O-N 3.01Å; D71-T73 VanDerWaalsContact O-N 3.15Å; D71-L74 HydrophobicContact CB-CB 3.96Å; D71-L74 HydrophobicContact CB-CD1 3.76Å; D71-L74 HydrophobicContact CB-CG 3.88Å; D71-L74 PolarHBondContact O-N 2.98Å; D71-L74 VanDerWaalsContact O-N 3.08Å; D71-V75 PolarHBondContact O-N 2.84Å; D71-V75 VanDerWaalsContact O-N 3.09Å
72	K	82.3	Confident	83.5	Confident	90 Å²	90	58.6 Å²	58.6	39%	0.391	30%	0.295	S	S	.	.	H	α-helix	trans	-52.3	-37.4	177.7	-61.5	-173.5	-179.3	-176.5	0	113.2	Y66 N70 V75 D76 E236	Y66-K72 HydrophobicContact CD1-CB 4.18Å; Y66-K72 HydrophobicContact CD1-CG 3.94Å; Y66-K72 HydrophobicContact CE1-CB 4.08Å; Y66-K72 HydrophobicContact CE1-CG 4.26Å; Y66-K72 HydrophobicContact CG-CG 4.15Å; N70-K72 PolarHBondContact O-N 3.13Å; K72-V75 PolarHBondContact O-N 3.26Å; K72-D76 WeakPolarHBondContact O-CB 3.4Å; K72-D76 VanDerWaalsContact O-CG 3.24Å; K72-D76 PolarHBondContact O-N 3.38Å; K72-E236 WeakPolarHBondContact CE-OE1 3.48Å; K72-E236 VanDerWaalsContact NZ-CD 3.35Å; K72-E236 IonicContact NZ-OE1 3.67Å; K72-E236 PolarHBondContact NZ-OE1 2.99Å; K72-E236 IonicContact NZ-OE2 2.66Å
73	T	84.3	Confident	83.3	Confident	108 Å²	108	58.3 Å²	58.3	66%	0.663	29%	0.294	S	S	*	.	H	α-helix	trans	-69	-37.4	-179.6	51.3	0	0	0	0	112.8	D71 K77	D71-T73 PolarHBondContact O-N 3.01Å; D71-T73 VanDerWaalsContact O-N 3.15Å; T73-K77 WeakPolarHBondContact O-CB 3.45Å; T73-K77 PolarHBondContact O-N 2.93Å; T73-K77 VanDerWaalsContact O-N 3.08Å
74	L	84.1	Confident	83.1	Confident	90 Å²	90	65.2 Å²	65.2	47%	0.471	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-47.5	175	-69.2	-179.3	0	0	0	109.6	M36 D71 D76 K77 E78	M36-L74 VanDerWaalsContact CE-C 3.4Å; M36-L74 HydrophobicContact CE-CB 4.27Å; M36-L74 WeakPolarHBondContact CE-O 3.17Å; D71-L74 HydrophobicContact CB-CB 3.96Å; D71-L74 HydrophobicContact CB-CD1 3.76Å; D71-L74 HydrophobicContact CB-CG 3.88Å; D71-L74 PolarHBondContact O-N 2.98Å; D71-L74 VanDerWaalsContact O-N 3.08Å; L74-D76 VanDerWaalsContact C-N 3.31Å; L74-D76 PolarHBondContact O-N 3.45Å; L74-K77 WeakPolarHBondContact O-CB 3.46Å; L74-K77 PolarHBondContact O-N 2.9Å; L74-E78 PolarHBondContact O-N 2.8Å
75	V	84.4	Confident	83	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-52.9	-49.7	176.2	175.1	0	0	0	0	111.3	M36 L65 Y66 H69 D71 K72 K77 E78 V79	M36-V75 VanDerWaalsContact CE-CA 3.44Å; M36-V75 HydrophobicContact CE-CB 4.48Å; M36-V75 HydrophobicContact CE-CG2 4.34Å; M36-V75 HydrophobicContact SD-CB 4.45Å; M36-V75 HydrophobicContact SD-CG2 4.31Å; L65-V75 HydrophobicContact CB-CG1 3.62Å; L65-V75 HydrophobicContact CD1-CG1 3.99Å; L65-V75 HydrophobicContact CG-CG1 4.46Å; Y66-V75 HydrophobicContact CD1-CB 4.01Å; Y66-V75 HydrophobicContact CD1-CG1 3.84Å; Y66-V75 HydrophobicContact CD1-CG2 4.24Å; Y66-V75 HydrophobicContact CE1-CB 3.83Å; Y66-V75 HydrophobicContact CE1-CG1 3.57Å; H69-V75 HydrophobicContact CB-CG2 3.55Å; D71-V75 PolarHBondContact O-N 2.84Å; D71-V75 VanDerWaalsContact O-N 3.09Å; K72-V75 PolarHBondContact O-N 3.26Å; V75-K77 VanDerWaalsContact C-N 3.31Å; V75-K77 PolarHBondContact O-N 3.27Å; V75-E78 PolarHBondContact O-N 2.89Å; V75-V79 HydrophobicContact CG1-CG2 4.24Å; V75-V79 WeakPolarHBondContact O-CB 3.4Å; V75-V79 WeakPolarHBondContact O-CG2 3.41Å; V75-V79 PolarHBondContact O-N 3.1Å
76	D	85.6	Confident	82.7	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.251	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-40.1	178.1	-72.4	-15.8	0	0	0	112.3	K62 Y66 K72 L74 N80	K62-D76 WeakPolarHBondContact CE-OD1 3.38Å; K62-D76 IonicContact NZ-OD1 2.96Å; K62-D76 PolarHBondContact NZ-OD1 3.26Å; K62-D76 IonicContact NZ-OD2 3.01Å; Y66-D76 PolarHBondContact OH-OD1 3.27Å; K72-D76 WeakPolarHBondContact O-CB 3.4Å; K72-D76 VanDerWaalsContact O-CG 3.24Å; K72-D76 PolarHBondContact O-N 3.38Å; L74-D76 VanDerWaalsContact C-N 3.31Å; L74-D76 PolarHBondContact O-N 3.45Å; D76-N80 VanDerWaalsContact O-CB 3.31Å; D76-N80 WeakPolarHBondContact O-CB 3.35Å; D76-N80 PolarHBondContact O-N 3.1Å; D76-N80 PolarHBondContact O-ND2 2.94Å; D76-N80 PolarHBondContact O-OD1 2.76Å
77	K	87.1	Confident	82.6	Confident	144 Å²	144	71.1 Å²	71.1	63%	0.626	37%	0.37	S	S	*	.	H	α-helix	trans	-65.4	-46.9	179.7	-171.7	-178	179.3	-172.8	0	112.3	T73 L74 V75 N80 K81	T73-K77 WeakPolarHBondContact O-CB 3.45Å; T73-K77 PolarHBondContact O-N 2.93Å; T73-K77 VanDerWaalsContact O-N 3.08Å; L74-K77 WeakPolarHBondContact O-CB 3.46Å; L74-K77 PolarHBondContact O-N 2.9Å; V75-K77 VanDerWaalsContact C-N 3.31Å; V75-K77 PolarHBondContact O-N 3.27Å; K77-N80 PolarHBondContact O-N 3.42Å; K77-K81 WeakPolarHBondContact O-CB 3.41Å; K77-K81 PolarHBondContact O-N 2.93Å
78	E	85.4	Confident	82.8	Confident	58 Å²	58	70.4 Å²	70.4	27%	0.271	37%	0.365	S	S	.	.	H	α-helix	trans	-73.3	-35.8	179.1	-66.1	-62.9	136.5	0	0	112.1	M36 L74 V75 N80 K81 L82	M36-E78 HydrophobicContact CB-CB 4.36Å; M36-E78 HydrophobicContact CE-CB 3.39Å; M36-E78 HydrophobicContact CE-CG 3.21Å; M36-E78 HydrophobicContact CG-CB 4.32Å; M36-E78 HydrophobicContact CG-CG 4.37Å; M36-E78 HydrophobicContact SD-CB 3.61Å; M36-E78 HydrophobicContact SD-CG 4.02Å; L74-E78 PolarHBondContact O-N 2.8Å; V75-E78 PolarHBondContact O-N 2.89Å; E78-N80 VanDerWaalsContact C-N 3.3Å; E78-N80 PolarHBondContact O-N 3.2Å; E78-K81 PolarHBondContact O-N 2.94Å; E78-K81 IonicContact OE1-NZ 3.81Å; E78-K81 WeakPolarHBondContact OE2-CD 3.35Å; E78-K81 IonicContact OE2-NZ 2.74Å; E78-K81 PolarHBondContact OE2-NZ 3.06Å; E78-L82 WeakPolarHBondContact O-CG 3.49Å; E78-L82 PolarHBondContact O-N 3.37Å
79	V	84.9	Confident	83	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.03	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-44.7	173.2	169.2	0	0	0	0	110.2	L65 V75 L82 Q83 L88 L102	L65-V79 HydrophobicContact CD1-CG2 3.72Å; V75-V79 HydrophobicContact CG1-CG2 4.24Å; V75-V79 WeakPolarHBondContact O-CB 3.4Å; V75-V79 WeakPolarHBondContact O-CG2 3.41Å; V75-V79 PolarHBondContact O-N 3.1Å; V79-L82 PolarHBondContact O-N 2.98Å; V79-Q83 WeakPolarHBondContact O-CB 3.23Å; V79-Q83 PolarHBondContact O-N 3.01Å; V79-L88 HydrophobicContact CG1-CD2 4.24Å; V79-L102 HydrophobicContact CG1-CD1 4.21Å; V79-L102 HydrophobicContact CG1-CD2 3.91Å; V79-L102 HydrophobicContact CG2-CD1 4.12Å
80	N	85.4	Confident	83.3	Confident	71 Å²	71	66.7 Å²	66.7	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-41.2	175.4	-71.9	-11.7	0	0	0	111.7	D76 K77 E78 L82 Q83 E84	D76-N80 VanDerWaalsContact O-CB 3.31Å; D76-N80 WeakPolarHBondContact O-CB 3.35Å; D76-N80 PolarHBondContact O-N 3.1Å; D76-N80 PolarHBondContact O-ND2 2.94Å; D76-N80 PolarHBondContact O-OD1 2.76Å; K77-N80 PolarHBondContact O-N 3.42Å; E78-N80 VanDerWaalsContact C-N 3.3Å; E78-N80 PolarHBondContact O-N 3.2Å; N80-L82 PolarHBondContact O-N 3.43Å; N80-Q83 CarbonylContact O-C 3.56Å; N80-Q83 WeakPolarHBondContact O-CB 3.27Å; N80-Q83 PolarHBondContact O-N 2.96Å; N80-Q83 VanDerWaalsContact O-N 3.16Å; N80-E84 WeakPolarHBondContact O-CB 3.23Å; N80-E84 WeakPolarHBondContact O-CG 3.37Å; N80-E84 PolarHBondContact O-N 2.87Å
81	K	86.3	Confident	84	Confident	116 Å²	116	59.3 Å²	59.3	50%	0.504	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-40.1	177.2	-175.6	-175.1	169.2	-161.6	0	112.7	K77 E78 Q83 E84 S85	K77-K81 WeakPolarHBondContact O-CB 3.41Å; K77-K81 PolarHBondContact O-N 2.93Å; E78-K81 PolarHBondContact O-N 2.94Å; E78-K81 IonicContact OE1-NZ 3.81Å; E78-K81 WeakPolarHBondContact OE2-CD 3.35Å; E78-K81 IonicContact OE2-NZ 2.74Å; E78-K81 PolarHBondContact OE2-NZ 3.06Å; K81-Q83 VanDerWaalsContact C-N 3.31Å; K81-E84 PolarHBondContact O-N 2.95Å; K81-S85 PolarHBondContact O-N 3.05Å
82	L	83.5	Confident	84	Confident	24 Å²	24	57.2 Å²	57.2	13%	0.126	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-28.4	174.8	-69	169.4	0	0	0	112.4	E78 V79 N80 S85 E87 L88	E78-L82 WeakPolarHBondContact O-CG 3.49Å; E78-L82 PolarHBondContact O-N 3.37Å; V79-L82 PolarHBondContact O-N 2.98Å; N80-L82 PolarHBondContact O-N 3.43Å; L82-S85 WeakPolarHBondContact CA-OG 3.14Å; L82-S85 PolarHBondContact O-OG 3.3Å; L82-S85 VanDerWaalsContact O-OG 3.05Å; L82-E87 PolarHBondContact O-N 3.26Å; L82-E87 VanDerWaalsContact O-N 3.15Å; L82-L88 HydrophobicContact CB-CB 3.88Å; L82-L88 HydrophobicContact CB-CD2 4.23Å; L82-L88 PolarHBondContact O-N 3.41Å
83	Q	84.2	Confident	83.7	Confident	29 Å²	29	53.7 Å²	53.7	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-72.8	-41.8	171.6	-172.1	-179.6	13.3	0	0	111.1	V79 N80 K81 S85 G86 T137	V79-Q83 WeakPolarHBondContact O-CB 3.23Å; V79-Q83 PolarHBondContact O-N 3.01Å; N80-Q83 CarbonylContact O-C 3.56Å; N80-Q83 WeakPolarHBondContact O-CB 3.27Å; N80-Q83 PolarHBondContact O-N 2.96Å; N80-Q83 VanDerWaalsContact O-N 3.16Å; K81-Q83 VanDerWaalsContact C-N 3.31Å; Q83-S85 VanDerWaalsContact C-N 3.31Å; Q83-S85 PolarHBondContact O-N 2.81Å; Q83-G86 PolarHBondContact O-N 2.8Å; Q83-G86 VanDerWaalsContact O-N 3.14Å; Q83-T137 HydrophobicContact CG-CG2 4.49Å; Q83-T137 PolarHBondContact NE2-O 3.32Å; Q83-T137 VanDerWaalsContact O-CB 3.25Å; Q83-T137 WeakPolarHBondContact O-CB 3.39Å; Q83-T137 WeakPolarHBondContact O-CG2 3.45Å; Q83-T137 PolarHBondContact O-OG1 3.32Å
84	E	82.4	Confident	83	Confident	161 Å²	161	51.7 Å²	51.7	75%	0.752	28%	0.278	S	S	*	.	H	α-helix	trans	-65.2	-34	175.5	-75.1	174.1	-174.2	0	0	112	N80 K81 G86	N80-E84 WeakPolarHBondContact O-CB 3.23Å; N80-E84 WeakPolarHBondContact O-CG 3.37Å; N80-E84 PolarHBondContact O-N 2.87Å; K81-E84 PolarHBondContact O-N 2.95Å; E84-G86 PolarHBondContact O-N 2.85Å
85	S	81.5	Confident	82.4	Confident	65 Å²	65	49.7 Å²	49.7	46%	0.455	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-8	174.8	73.4	0	0	0	0	114	K81 L82 Q83 E87	K81-S85 PolarHBondContact O-N 3.05Å; L82-S85 WeakPolarHBondContact CA-OG 3.14Å; L82-S85 PolarHBondContact O-OG 3.3Å; L82-S85 VanDerWaalsContact O-OG 3.05Å; Q83-S85 VanDerWaalsContact C-N 3.31Å; Q83-S85 PolarHBondContact O-N 2.81Å; S85-E87 PolarHBondContact O-N 3.08Å
86	G	78.7	Confident	81.6	Confident	28 Å²	28	52.6 Å²	52.6	29%	0.289	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	4.8	-178.5	0	0	0	0	0	114.5	Q83 E84 A105	Q83-G86 PolarHBondContact O-N 2.8Å; Q83-G86 VanDerWaalsContact O-N 3.14Å; E84-G86 PolarHBondContact O-N 2.85Å; G86-A105 VanDerWaalsContact O-CB 3.24Å; G86-A105 WeakPolarHBondContact O-CB 3.47Å
87	E	81.9	Confident	80.7	Confident	80 Å²	80	54.6 Å²	54.6	37%	0.374	30%	0.299	S	S	.	.	S	Bend	trans	-79.3	-32.3	-180	-71.6	-177.1	-140.3	0	0	112	K37 L82 S85 F104 A105	K37-E87 IonicContact NZ-OE2 3.11Å; K37-E87 PolarHBondContact NZ-OE2 3.42Å; L82-E87 PolarHBondContact O-N 3.26Å; L82-E87 VanDerWaalsContact O-N 3.15Å; S85-E87 PolarHBondContact O-N 3.08Å; E87-F104 WeakPolarHBondContact O-CA 3.22Å; E87-A105 PolarHBondContact O-N 3.31Å
88	L	84.6	Confident	79.8	Confident	2 Å²	2	55 Å²	55	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.4	-174.3	-164.3	69	0	0	0	111.9	L40 V79 L82 L102 F104	L40-L88 HydrophobicContact CD2-CD1 3.65Å; L40-L88 HydrophobicContact CD2-CD2 4.29Å; V79-L88 HydrophobicContact CG1-CD2 4.24Å; L82-L88 HydrophobicContact CB-CB 3.88Å; L82-L88 HydrophobicContact CB-CD2 4.23Å; L82-L88 PolarHBondContact O-N 3.41Å; L88-L102 HydrophobicContact CD1-CB 4.21Å; L88-L102 HydrophobicContact CD2-CB 4.24Å; L88-L102 HydrophobicContact CD2-CD1 4.25Å; L88-L102 HydrophobicContact CD2-CD2 4Å; L88-L102 HydrophobicContact CD2-CG 4.39Å; L88-L102 HydrophobicContact CG-CB 4.39Å; L88-L102 HydrophobicContact CG-CD2 4.48Å; L88-F104 HydrophobicContact CD1-CD1 4.06Å; L88-F104 HydrophobicContact CD1-CE1 4.28Å
89	L	84.2	Confident	79.3	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.3	173.5	-62.5	176.6	0	0	0	109.8	F91 L102 V103 A105 Y108 V133 T137	L89-F91 HydrophobicContact CB-CD2 4.39Å; L89-F91 HydrophobicContact CB-CE2 3.47Å; L89-F91 VanDerWaalsContact CB-CE2 3.47Å; L89-F91 HydrophobicContact CB-CZ 3.82Å; L89-F91 HydrophobicContact CD1-CE2 4.46Å; L89-F91 HydrophobicContact CD1-CZ 4.06Å; L89-L102 WeakPolarHBondContact O-CA 3.47Å; L89-V103 PolarHBondContact N-O 2.83Å; L89-V103 PolarHBondContact O-N 3.4Å; L89-A105 HydrophobicContact CD1-CB 4.13Å; L89-A105 HydrophobicContact CG-CB 3.97Å; L89-Y108 HydrophobicContact CD1-CD1 3.49Å; L89-Y108 VanDerWaalsContact CD1-CD1 3.49Å; L89-Y108 HydrophobicContact CD1-CE1 4.17Å; L89-Y108 HydrophobicContact CD1-CG 3.81Å; L89-V133 HydrophobicContact CD1-CG1 3.72Å; L89-V133 HydrophobicContact CD2-CG1 4.09Å; L89-V133 HydrophobicContact CG-CG1 4.42Å; L89-T137 HydrophobicContact CD2-CG2 4.15Å
90	M	85.6	Confident	79.3	Confident	28 Å²	28	54.3 Å²	54.3	14%	0.138	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	144.4	174.5	-170.1	163.7	54.7	0	0	109.4	F100 G101 L102 L139	M90-F100 HydrophobicContact CG-CB 3.75Å; M90-F100 HydrophobicContact CG-CD1 4.03Å; M90-F100 HydrophobicContact CG-CG 4.17Å; M90-F100 HydrophobicContact SD-CB 3.7Å; M90-F100 HydrophobicContact SD-CD1 3.96Å; M90-F100 HydrophobicContact SD-CG 3.8Å; M90-G101 CarbonylContact C-O 3.57Å; M90-G101 VanDerWaalsContact CA-O 3.3Å; M90-G101 WeakPolarHBondContact CA-O 3.48Å; M90-L102 HydrophobicContact CB-CD2 4.18Å; M90-L102 HydrophobicContact CG-CD2 4.04Å; M90-L102 HydrophobicContact SD-CD2 4.33Å; M90-L139 HydrophobicContact CB-CD1 4.27Å; M90-L139 HydrophobicContact CE-CD2 4.27Å; M90-L139 HydrophobicContact CG-CD1 4.3Å; M90-L139 WeakPolarHBondContact O-CD1 3.15Å
91	F	85	Confident	79.3	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138.2	-178.8	-61.2	-93.6	0	0	0	110.2	L89 F100 G101 V103 Y108 L176 I178	L89-F91 HydrophobicContact CB-CD2 4.39Å; L89-F91 HydrophobicContact CB-CE2 3.47Å; L89-F91 VanDerWaalsContact CB-CE2 3.47Å; L89-F91 HydrophobicContact CB-CZ 3.82Å; L89-F91 HydrophobicContact CD1-CE2 4.46Å; L89-F91 HydrophobicContact CD1-CZ 4.06Å; F91-F100 CarbonylContact O-C 3.47Å; F91-F100 WeakPolarHBondContact O-CA 3.39Å; F91-G101 PolarHBondContact N-O 3.21Å; F91-G101 PolarHBondContact O-N 3.1Å; F91-V103 HydrophobicContact CD2-CB 4.33Å; F91-V103 HydrophobicContact CD2-CG2 3.95Å; F91-V103 HydrophobicContact CE2-CB 3.8Å; F91-V103 HydrophobicContact CE2-CG2 3.85Å; F91-Y108 HydrophobicContact CE1-CD2 4.12Å; F91-Y108 AromaticContact CE1-CE2 3.6Å; F91-Y108 HydrophobicContact CE1-CE2 3.6Å; F91-Y108 AromaticContact CE1-CZ 3.9Å; F91-Y108 HydrophobicContact CE2-CD2 4.37Å; F91-Y108 HydrophobicContact CZ-CD1 4.42Å; F91-Y108 AromaticContact CZ-CD2 3.52Å; F91-Y108 HydrophobicContact CZ-CD2 3.52Å; F91-Y108 HydrophobicContact CZ-CE1 4.39Å; F91-Y108 AromaticContact CZ-CE2 3.49Å; F91-Y108 HydrophobicContact CZ-CE2 3.49Å; F91-Y108 VanDerWaalsContact CZ-CE2 3.49Å; F91-Y108 HydrophobicContact CZ-CG 4Å; F91-Y108 AromaticContact CZ-CZ 3.94Å; F91-L176 HydrophobicContact CD1-CB 4.33Å; F91-L176 HydrophobicContact CD1-CD2 4.18Å; F91-L176 HydrophobicContact CD1-CG 3.97Å; F91-L176 HydrophobicContact CE1-CB 4.38Å; F91-L176 HydrophobicContact CE1-CD2 3.57Å; F91-L176 HydrophobicContact CE1-CG 3.53Å; F91-L176 HydrophobicContact CZ-CD2 3.9Å; F91-L176 HydrophobicContact CZ-CG 4.35Å; F91-I178 HydrophobicContact CB-CD1 4.4Å; F91-I178 HydrophobicContact CB-CG1 4.42Å; F91-I178 HydrophobicContact CD1-CD1 4.31Å; F91-I178 HydrophobicContact CD1-CG1 3.55Å; F91-I178 HydrophobicContact CD2-CD1 3.89Å; F91-I178 HydrophobicContact CD2-CG1 3.95Å; F91-I178 HydrophobicContact CE1-CG1 3.6Å; F91-I178 HydrophobicContact CE2-CD1 4.23Å; F91-I178 HydrophobicContact CE2-CG1 4.06Å; F91-I178 HydrophobicContact CG-CD1 3.95Å; F91-I178 HydrophobicContact CG-CG1 3.71Å; F91-I178 HydrophobicContact CZ-CG1 3.89Å
92	Q	82.8	Confident	79.4	Confident	51 Å²	51	45.5 Å²	45.5	24%	0.238	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.7	170.9	-169.5	175.8	9.3	0	0	109.4	G94	Q92-G94 VanDerWaalsContact C-N 3.3Å; Q92-G94 PolarHBondContact O-N 3.26Å
93	L	76.2	Confident	79.6	Confident	16 Å²	16	44.3 Å²	44.3	8%	0.084	25%	0.251	C	S	.	.			trans	-88	1.7	-174.3	-66.5	164.1	0	0	0	113.7	I59 L61 F95 F184	I59-L93 HydrophobicContact CG2-CD1 4.16Å; L61-L93 HydrophobicContact CD2-CD1 3.31Å; L93-F95 HydrophobicContact CB-CD1 3.63Å; L93-F95 HydrophobicContact CB-CE1 3.35Å; L93-F95 HydrophobicContact CB-CZ 4.35Å; L93-F95 HydrophobicContact CD1-CE1 3.88Å; L93-F95 HydrophobicContact CD1-CZ 4.42Å; L93-F95 HydrophobicContact CG-CE1 4.25Å; L93-F95 WeakPolarHBondContact O-CD1 3.26Å; L93-F95 PolarHBondContact O-N 2.96Å; L93-F184 HydrophobicContact CD1-CE1 4.15Å; L93-F184 HydrophobicContact CD2-CE1 4.36Å
94	G	69.3	Low	79.7	Confident	67 Å²	67	44 Å²	44	69%	0.691	25%	0.249	S	C	*	.	S	Bend	trans	72.3	-4	166.1	0	0	0	0	0	116.5	Q92	Q92-G94 VanDerWaalsContact C-N 3.3Å; Q92-G94 PolarHBondContact O-N 3.26Å
95	F	71.4	Confident	79.8	Confident	47 Å²	47	36.7 Å²	36.7	21%	0.206	22%	0.216	C	C	.	.	S	Bend	trans	-92.6	-17.2	178.1	63.2	-100.3	0	0	0	114	L61 L93 A99 T185 F188 I189	L61-F95 HydrophobicContact CD2-CZ 4.03Å; L93-F95 HydrophobicContact CB-CD1 3.63Å; L93-F95 HydrophobicContact CB-CE1 3.35Å; L93-F95 HydrophobicContact CB-CZ 4.35Å; L93-F95 HydrophobicContact CD1-CE1 3.88Å; L93-F95 HydrophobicContact CD1-CZ 4.42Å; L93-F95 HydrophobicContact CG-CE1 4.25Å; L93-F95 WeakPolarHBondContact O-CD1 3.26Å; L93-F95 PolarHBondContact O-N 2.96Å; F95-A99 HydrophobicContact CD2-CB 4.08Å; F95-A99 HydrophobicContact CE1-CB 4.25Å; F95-A99 HydrophobicContact CE2-CB 3.29Å; F95-A99 HydrophobicContact CZ-CB 3.4Å; F95-A99 VanDerWaalsContact CZ-CB 3.4Å; F95-T185 HydrophobicContact CB-CG2 4.05Å; F95-T185 HydrophobicContact CD1-CG2 3.67Å; F95-T185 HydrophobicContact CG-CG2 4.27Å; F95-F188 HydrophobicContact CE1-CD1 4.14Å; F95-F188 HydrophobicContact CE1-CE1 4.24Å; F95-F188 HydrophobicContact CE2-CD1 4.42Å; F95-F188 AromaticContact CE2-CE1 3.93Å; F95-F188 HydrophobicContact CE2-CE1 3.93Å; F95-F188 AromaticContact CZ-CD1 3.92Å; F95-F188 HydrophobicContact CZ-CD1 3.92Å; F95-F188 AromaticContact CZ-CE1 3.56Å; F95-F188 HydrophobicContact CZ-CE1 3.56Å; F95-I189 HydrophobicContact CB-CD1 3.64Å; F95-I189 HydrophobicContact CB-CG1 4.17Å; F95-I189 HydrophobicContact CG-CD1 4.28Å; F95-I189 HydrophobicContact CG-CG1 4.33Å
96	D	68.4	Low	79.9	Confident	61 Å²	61	37.1 Å²	37.1	33%	0.326	22%	0.22	S	C	.	.			trans	-153.9	142	179.3	-172.1	-16	0	0	0	107.9	E98 A99	D96-E98 PolarHBondContact O-N 2.91Å; D96-E98 PolarHBondContact OD1-N 2.88Å; D96-E98 VanDerWaalsContact OD1-N 3.14Å; D96-A99 HydrophobicContact CB-CB 3.68Å; D96-A99 PolarHBondContact O-N 3.37Å
97	S	66.5	Low	80.1	Confident	89 Å²	89	37.9 Å²	37.9	62%	0.622	22%	0.217	S	C	*	.	S	Bend	trans	-67.3	-23.9	178.7	44	0	0	0	0	112.7
98	E	68	Low	80.3	Confident	154 Å²	154	34 Å²	34	72%	0.72	20%	0.199	S	C	*	.	S	Bend	trans	-102.6	-5	-179.9	-60.2	-168	141.1	0	0	113.1	D96 F100	D96-E98 PolarHBondContact O-N 2.91Å; D96-E98 PolarHBondContact OD1-N 2.88Å; D96-E98 VanDerWaalsContact OD1-N 3.14Å; E98-F100 WeakPolarHBondContact O-CD2 3.47Å; E98-F100 PolarHBondContact O-N 2.97Å
99	A	75.1	Confident	80.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.213	C	C	.	.			trans	-86.4	93.9	177.9	0	0	0	0	0	112	L61 F95 D96	L61-A99 HydrophobicContact CD2-CB 4.48Å; F95-A99 HydrophobicContact CD2-CB 4.08Å; F95-A99 HydrophobicContact CE1-CB 4.25Å; F95-A99 HydrophobicContact CE2-CB 3.29Å; F95-A99 HydrophobicContact CZ-CB 3.4Å; F95-A99 VanDerWaalsContact CZ-CB 3.4Å; D96-A99 HydrophobicContact CB-CB 3.68Å; D96-A99 PolarHBondContact O-N 3.37Å
100	F	83.4	Confident	80.1	Confident	47 Å²	47	41.5 Å²	41.5	21%	0.206	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.2	169.3	-61.5	-77.7	0	0	0	110.6	L61 K62 M90 F91 E98 L139	L61-F100 CarbonylContact C-O 3.59Å; L61-F100 WeakPolarHBondContact CA-O 3.44Å; K62-F100 HydrophobicContact CB-CB 4.16Å; K62-F100 HydrophobicContact CD-CD2 4.49Å; K62-F100 PolarHBondContact N-O 3.07Å; M90-F100 HydrophobicContact CG-CB 3.75Å; M90-F100 HydrophobicContact CG-CD1 4.03Å; M90-F100 HydrophobicContact CG-CG 4.17Å; M90-F100 HydrophobicContact SD-CB 3.7Å; M90-F100 HydrophobicContact SD-CD1 3.96Å; M90-F100 HydrophobicContact SD-CG 3.8Å; F91-F100 CarbonylContact O-C 3.47Å; F91-F100 WeakPolarHBondContact O-CA 3.39Å; E98-F100 WeakPolarHBondContact O-CD2 3.47Å; E98-F100 PolarHBondContact O-N 2.97Å; F100-L139 HydrophobicContact CD1-CD2 3.94Å; F100-L139 HydrophobicContact CE1-CD2 3.63Å
101	G	86.4	Confident	80	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	137.6	169.2	0	0	0	0	0	110.7	V60 M90 F91	V60-G101 CarbonylContact O-C 3.45Å; M90-G101 CarbonylContact C-O 3.57Å; M90-G101 VanDerWaalsContact CA-O 3.3Å; M90-G101 WeakPolarHBondContact CA-O 3.48Å; F91-G101 PolarHBondContact N-O 3.21Å; F91-G101 PolarHBondContact O-N 3.1Å
102	L	87.5	Confident	79.8	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.4	177.5	-58.1	175.6	0	0	0	108.3	V60 K62 L65 V79 L88 L89 M90	V60-L102 PolarHBondContact N-O 3.29Å; V60-L102 WeakPolarHBondContact O-CB 3.39Å; V60-L102 PolarHBondContact O-N 3.23Å; K62-L102 HydrophobicContact CB-CD1 4.31Å; K62-L102 HydrophobicContact CB-CG 4.47Å; L65-L102 HydrophobicContact CD1-CD1 3.64Å; V79-L102 HydrophobicContact CG1-CD1 4.21Å; V79-L102 HydrophobicContact CG1-CD2 3.91Å; V79-L102 HydrophobicContact CG2-CD1 4.12Å; L88-L102 HydrophobicContact CD1-CB 4.21Å; L88-L102 HydrophobicContact CD2-CB 4.24Å; L88-L102 HydrophobicContact CD2-CD1 4.25Å; L88-L102 HydrophobicContact CD2-CD2 4Å; L88-L102 HydrophobicContact CD2-CG 4.39Å; L88-L102 HydrophobicContact CG-CB 4.39Å; L88-L102 HydrophobicContact CG-CD2 4.48Å; L89-L102 WeakPolarHBondContact O-CA 3.47Å; M90-L102 HydrophobicContact CB-CD2 4.18Å; M90-L102 HydrophobicContact CG-CD2 4.04Å; M90-L102 HydrophobicContact SD-CD2 4.33Å
103	V	87.5	Confident	79.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.9	179.6	-175.5	0	0	0	0	109.1	P57 I59 L89 F91 I178	P57-V103 HydrophobicContact CB-CG1 3.5Å; P57-V103 VanDerWaalsContact CB-CG1 3.5Å; P57-V103 HydrophobicContact CG-CG1 3.68Å; P57-V103 HydrophobicContact CG-CG2 4.43Å; I59-V103 HydrophobicContact CB-CG2 4.43Å; I59-V103 HydrophobicContact CG1-CG2 3.93Å; L89-V103 PolarHBondContact N-O 2.83Å; L89-V103 PolarHBondContact O-N 3.4Å; F91-V103 HydrophobicContact CD2-CB 4.33Å; F91-V103 HydrophobicContact CD2-CG2 3.95Å; F91-V103 HydrophobicContact CE2-CB 3.8Å; F91-V103 HydrophobicContact CE2-CG2 3.85Å; V103-I178 HydrophobicContact CG2-CD1 3.65Å
104	F	86.9	Confident	79.8	Confident	22 Å²	22	45.1 Å²	45.1	10%	0.096	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.7	173.4	-72.3	-61.7	0	0	0	111.8	L40 E41 M44 E87 L88 S106 D107 Y108	L40-F104 HydrophobicContact CD2-CE1 3.84Å; L40-F104 HydrophobicContact CD2-CE2 4.2Å; L40-F104 HydrophobicContact CD2-CZ 3.55Å; L40-F104 HydrophobicContact CG-CE2 4.48Å; L40-F104 HydrophobicContact CG-CZ 4.16Å; E41-F104 HydrophobicContact CG-CE2 4.26Å; E41-F104 HydrophobicContact CG-CZ 4.35Å; M44-F104 HydrophobicContact CE-CD2 3.42Å; M44-F104 VanDerWaalsContact CE-CD2 3.42Å; M44-F104 HydrophobicContact CE-CE2 3.56Å; M44-F104 HydrophobicContact CE-CG 4.09Å; M44-F104 HydrophobicContact CE-CZ 4.34Å; M44-F104 HydrophobicContact SD-CD2 3.25Å; M44-F104 WeakPolarHBondContact SD-CD2 3.5Å; M44-F104 HydrophobicContact SD-CE2 3.27Å; M44-F104 WeakPolarHBondContact SD-CE2 3.47Å; M44-F104 HydrophobicContact SD-CG 4.4Å; M44-F104 HydrophobicContact SD-CZ 4.44Å; E87-F104 WeakPolarHBondContact O-CA 3.22Å; L88-F104 HydrophobicContact CD1-CD1 4.06Å; L88-F104 HydrophobicContact CD1-CE1 4.28Å; F104-S106 VanDerWaalsContact C-N 3.25Å; F104-S106 PolarHBondContact O-N 2.99Å; F104-D107 HydrophobicContact CB-CB 4.33Å; F104-D107 PolarHBondContact O-N 3.01Å; F104-Y108 WeakPolarHBondContact O-CB 3.19Å; F104-Y108 PolarHBondContact O-N 2.93Å
105	A	84.5	Confident	80.1	Confident	7 Å²	7	43.1 Å²	43.1	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-35.3	-179.7	0	0	0	0	0	112.2	G86 E87 L89 K109 V133	G86-A105 VanDerWaalsContact O-CB 3.24Å; G86-A105 WeakPolarHBondContact O-CB 3.47Å; E87-A105 PolarHBondContact O-N 3.31Å; L89-A105 HydrophobicContact CD1-CB 4.13Å; L89-A105 HydrophobicContact CG-CB 3.97Å; A105-K109 WeakPolarHBondContact O-CB 3.42Å; A105-K109 VanDerWaalsContact O-CG 3.28Å; A105-K109 WeakPolarHBondContact O-CG 3.31Å; A105-K109 PolarHBondContact O-N 2.89Å; A105-V133 HydrophobicContact CB-CG1 4.46Å
106	S	83.4	Confident	80.2	Confident	75 Å²	75	41.1 Å²	41.1	52%	0.524	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-55.7	174.9	50.2	0	0	0	0	111.6	F104 Y108 K109 T110	F104-S106 VanDerWaalsContact C-N 3.25Å; F104-S106 PolarHBondContact O-N 2.99Å; S106-Y108 VanDerWaalsContact C-N 3.28Å; S106-Y108 PolarHBondContact O-N 3.2Å; S106-K109 PolarHBondContact O-N 3.29Å; S106-T110 PolarHBondContact O-N 3.44Å; S106-T110 PolarHBondContact O-OG1 3Å
107	D	84.3	Confident	80.2	Confident	43 Å²	43	45.7 Å²	45.7	23%	0.23	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-42.3	178.7	-80.2	-4.4	0	0	0	110.9	P57 P58 F104 K111	P57-D107 HydrophobicContact CB-CB 4.28Å; P58-D107 WeakPolarHBondContact CD-OD2 3.01Å; F104-D107 HydrophobicContact CB-CB 4.33Å; F104-D107 PolarHBondContact O-N 3.01Å; D107-K111 WeakPolarHBondContact O-CB 3.15Å; D107-K111 WeakPolarHBondContact O-CG 3.49Å; D107-K111 PolarHBondContact O-N 2.48Å
108	Y	84.6	Confident	80.1	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-50.8	176.5	-179.4	-105.9	0	0	0	112	P57 L89 F91 F104 S106 T110 K111 V112 L129 V133 S177 I178	P57-Y108 HydrophobicContact CG-CD2 4.45Å; L89-Y108 HydrophobicContact CD1-CD1 3.49Å; L89-Y108 VanDerWaalsContact CD1-CD1 3.49Å; L89-Y108 HydrophobicContact CD1-CE1 4.17Å; L89-Y108 HydrophobicContact CD1-CG 3.81Å; F91-Y108 HydrophobicContact CE1-CD2 4.12Å; F91-Y108 AromaticContact CE1-CE2 3.6Å; F91-Y108 HydrophobicContact CE1-CE2 3.6Å; F91-Y108 AromaticContact CE1-CZ 3.9Å; F91-Y108 HydrophobicContact CE2-CD2 4.37Å; F91-Y108 HydrophobicContact CZ-CD1 4.42Å; F91-Y108 AromaticContact CZ-CD2 3.52Å; F91-Y108 HydrophobicContact CZ-CD2 3.52Å; F91-Y108 HydrophobicContact CZ-CE1 4.39Å; F91-Y108 AromaticContact CZ-CE2 3.49Å; F91-Y108 HydrophobicContact CZ-CE2 3.49Å; F91-Y108 VanDerWaalsContact CZ-CE2 3.49Å; F91-Y108 HydrophobicContact CZ-CG 4Å; F91-Y108 AromaticContact CZ-CZ 3.94Å; F104-Y108 WeakPolarHBondContact O-CB 3.19Å; F104-Y108 PolarHBondContact O-N 2.93Å; S106-Y108 VanDerWaalsContact C-N 3.28Å; S106-Y108 PolarHBondContact O-N 3.2Å; Y108-T110 PolarHBondContact O-N 2.8Å; Y108-K111 PolarHBondContact O-N 3.08Å; Y108-V112 HydrophobicContact CD1-CG2 4.21Å; Y108-V112 HydrophobicContact CD2-CG2 3.87Å; Y108-V112 HydrophobicContact CE1-CG2 3.89Å; Y108-V112 HydrophobicContact CE2-CG2 3.5Å; Y108-V112 VanDerWaalsContact CE2-CG2 3.5Å; Y108-V112 HydrophobicContact CG-CG2 4.21Å; Y108-V112 WeakPolarHBondContact O-CB 3.41Å; Y108-V112 VanDerWaalsContact O-CG2 3.24Å; Y108-V112 WeakPolarHBondContact O-CG2 3.48Å; Y108-V112 PolarHBondContact O-N 3.45Å; Y108-L129 HydrophobicContact CD1-CD2 4Å; Y108-L129 HydrophobicContact CE1-CD2 3.59Å; Y108-V133 HydrophobicContact CE1-CG2 4.27Å; Y108-S177 PolarHBondContact OH-O 3.16Å; Y108-I178 HydrophobicContact CD2-CG1 4.49Å; Y108-I178 HydrophobicContact CE2-CG1 4.23Å
109	K	82.3	Confident	80.5	Confident	70 Å²	70	42.1 Å²	42.1	30%	0.304	25%	0.25	S	C	.	.	H	α-helix	trans	-57.9	-49.6	179.3	-75.2	175.4	-176.7	-177.4	0	111.5	A105 S106 K111 V112 L113 L129 V133	A105-K109 WeakPolarHBondContact O-CB 3.42Å; A105-K109 VanDerWaalsContact O-CG 3.28Å; A105-K109 WeakPolarHBondContact O-CG 3.31Å; A105-K109 PolarHBondContact O-N 2.89Å; S106-K109 PolarHBondContact O-N 3.29Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3.46Å; K109-V112 PolarHBondContact O-N 3.25Å; K109-L113 WeakPolarHBondContact O-CB 3.49Å; K109-L113 VanDerWaalsContact O-CG 3.26Å; K109-L113 WeakPolarHBondContact O-CG 3.37Å; K109-L113 PolarHBondContact O-N 3.14Å; K109-L129 HydrophobicContact CG-CB 4.46Å; K109-L129 HydrophobicContact CG-CD1 4.46Å; K109-L129 HydrophobicContact CG-CD2 4.26Å; K109-V133 HydrophobicContact CG-CG1 4.5Å
110	T	83.6	Confident	80.4	Confident	92 Å²	92	46.8 Å²	46.8	56%	0.564	29%	0.289	S	S	*	.	H	α-helix	trans	-60.4	-42.1	-179.7	-55.8	0	0	0	0	111.9	S106 Y108 A114	S106-T110 PolarHBondContact O-N 3.44Å; S106-T110 PolarHBondContact O-OG1 3Å; Y108-T110 PolarHBondContact O-N 2.8Å; T110-A114 WeakPolarHBondContact O-CB 3.2Å; T110-A114 PolarHBondContact O-N 3.43Å
111	K	82.1	Confident	80.1	Confident	42 Å²	42	45.4 Å²	45.4	18%	0.183	28%	0.284	C	S	.	.	H	α-helix	trans	-74.3	-37.8	-178.5	-65.7	-53.6	-168.9	174.7	0	113.3	D54 P57 D107 Y108 K109 G115	D54-K111 VanDerWaalsContact O-CD 3.23Å; D54-K111 WeakPolarHBondContact O-CD 3.38Å; D54-K111 VanDerWaalsContact O-CE 3.27Å; D54-K111 WeakPolarHBondContact O-CE 3.23Å; D54-K111 PolarHBondContact O-NZ 3Å; D54-K111 IonicContact OD1-NZ 2.85Å; D54-K111 PolarHBondContact OD1-NZ 3.49Å; P57-K111 HydrophobicContact CB-CB 4.39Å; P57-K111 HydrophobicContact CB-CG 4.02Å; D107-K111 WeakPolarHBondContact O-CB 3.15Å; D107-K111 WeakPolarHBondContact O-CG 3.49Å; D107-K111 PolarHBondContact O-N 2.48Å; Y108-K111 PolarHBondContact O-N 3.08Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3.46Å; K111-G115 PolarHBondContact O-N 3.02Å
112	V	81.6	Confident	79.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-43.7	175.9	173.1	0	0	0	0	110.5	Y108 K109 G115 E116 V125 L129 V165 P179	Y108-V112 HydrophobicContact CD1-CG2 4.21Å; Y108-V112 HydrophobicContact CD2-CG2 3.87Å; Y108-V112 HydrophobicContact CE1-CG2 3.89Å; Y108-V112 HydrophobicContact CE2-CG2 3.5Å; Y108-V112 VanDerWaalsContact CE2-CG2 3.5Å; Y108-V112 HydrophobicContact CG-CG2 4.21Å; Y108-V112 WeakPolarHBondContact O-CB 3.41Å; Y108-V112 VanDerWaalsContact O-CG2 3.24Å; Y108-V112 WeakPolarHBondContact O-CG2 3.48Å; Y108-V112 PolarHBondContact O-N 3.45Å; K109-V112 PolarHBondContact O-N 3.25Å; V112-G115 PolarHBondContact O-N 3.02Å; V112-E116 HydrophobicContact CG1-CG 4.49Å; V112-E116 WeakPolarHBondContact O-CB 3.46Å; V112-E116 WeakPolarHBondContact O-CG 3.3Å; V112-E116 PolarHBondContact O-N 3.13Å; V112-V125 HydrophobicContact CG1-CG1 3.31Å; V112-L129 HydrophobicContact CB-CD1 4.13Å; V112-L129 HydrophobicContact CG1-CD1 3.92Å; V112-L129 HydrophobicContact CG1-CD2 4.41Å; V112-L129 HydrophobicContact CG1-CG 4.48Å; V112-V165 HydrophobicContact CG1-CG2 4.04Å; V112-P179 HydrophobicContact CG2-CG 3.99Å
113	L	79.9	Confident	79.5	Confident	65 Å²	65	52 Å²	52	34%	0.34	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-45.9	176	-71.3	171.9	0	0	0	111.6	K109 G115 E116 E117 E126 L129	K109-L113 WeakPolarHBondContact O-CB 3.49Å; K109-L113 VanDerWaalsContact O-CG 3.26Å; K109-L113 WeakPolarHBondContact O-CG 3.37Å; K109-L113 PolarHBondContact O-N 3.14Å; L113-G115 VanDerWaalsContact C-N 3.3Å; L113-G115 PolarHBondContact O-N 3.38Å; L113-E116 PolarHBondContact O-N 3.04Å; L113-E117 PolarHBondContact O-N 3.22Å; L113-E126 HydrophobicContact CD2-CB 4.32Å; L113-E126 HydrophobicContact CD2-CG 4.34Å; L113-L129 HydrophobicContact CD2-CD1 4.02Å; L113-L129 HydrophobicContact CG-CD1 3.91Å
114	A	80.1	Confident	79.3	Confident	62 Å²	62	52.6 Å²	52.6	51%	0.512	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-34.6	176	0	0	0	0	0	113	T110	T110-A114 WeakPolarHBondContact O-CB 3.2Å; T110-A114 PolarHBondContact O-N 3.43Å
115	G	73.8	Confident	79.1	Confident	26 Å²	26	51.6 Å²	51.6	27%	0.268	33%	0.326	S	S	.	.	H	α-helix	trans	-77.3	-19.4	178.4	0	0	0	0	0	114.6	K111 V112 L113 K119	K111-G115 PolarHBondContact O-N 3.02Å; V112-G115 PolarHBondContact O-N 3.02Å; L113-G115 VanDerWaalsContact C-N 3.3Å; L113-G115 PolarHBondContact O-N 3.38Å; G115-K119 WeakPolarHBondContact O-CE 3.41Å; G115-K119 PolarHBondContact O-NZ 3.41Å
116	E	73.4	Confident	79	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.019	34%	0.343	C	S	.	.	H	α-helix	trans	-102.5	-4.8	179.2	-69.5	-65.9	113.5	0	0	113.4	V112 L113 G118 K119 T121 V125	V112-E116 HydrophobicContact CG1-CG 4.49Å; V112-E116 WeakPolarHBondContact O-CB 3.46Å; V112-E116 WeakPolarHBondContact O-CG 3.3Å; V112-E116 PolarHBondContact O-N 3.13Å; L113-E116 PolarHBondContact O-N 3.04Å; E116-G118 PolarHBondContact O-N 2.99Å; E116-G118 VanDerWaalsContact O-N 3.13Å; E116-K119 PolarHBondContact O-N 2.91Å; E116-K119 WeakPolarHBondContact OE1-CD 3.22Å; E116-K119 IonicContact OE1-NZ 3.87Å; E116-K119 PolarHBondContact OE1-NZ 3.06Å; E116-T121 WeakPolarHBondContact OE2-CB 3.16Å; E116-T121 PolarHBondContact OE2-OG1 2.96Å; E116-V125 HydrophobicContact CG-CB 4.34Å; E116-V125 HydrophobicContact CG-CG1 4.17Å; E116-V125 HydrophobicContact CG-CG2 4.13Å
117	E	70	Confident	79	Confident	157 Å²	157	55.6 Å²	55.6	73%	0.734	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	116.4	174.8	-168.3	166.7	-139.8	0	0	110.7	L113	L113-E117 PolarHBondContact O-N 3.22Å
118	G	64.6	Low	79	Confident	76 Å²	76	53.5 Å²	53.5	78%	0.784	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	5.4	179.8	0	0	0	0	0	115.9	E116	E116-G118 PolarHBondContact O-N 2.99Å; E116-G118 VanDerWaalsContact O-N 3.13Å
119	K	76.3	Confident	78.8	Confident	93 Å²	93	53.8 Å²	53.8	40%	0.404	32%	0.324	S	S	.	.	S	Bend	trans	-99.7	149.3	173.8	-66.3	176.7	-173.9	151.6	0	112.2	G115 E116 T121 Q122	G115-K119 WeakPolarHBondContact O-CE 3.41Å; G115-K119 PolarHBondContact O-NZ 3.41Å; E116-K119 PolarHBondContact O-N 2.91Å; E116-K119 WeakPolarHBondContact OE1-CD 3.22Å; E116-K119 IonicContact OE1-NZ 3.87Å; E116-K119 PolarHBondContact OE1-NZ 3.06Å; K119-T121 PolarHBondContact O-N 3.45Å; K119-Q122 VanDerWaalsContact O-CB 3.31Å; K119-Q122 WeakPolarHBondContact O-CB 3.43Å; K119-Q122 PolarHBondContact O-N 3.44Å; K119-Q122 VanDerWaalsContact O-N 3.1Å
120	A	73.1	Confident	78.7	Confident	98 Å²	98	57 Å²	57	81%	0.81	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.6	173.3	0	0	0	0	0	114.2
121	T	76.8	Confident	78.3	Confident	17 Å²	17	55.8 Å²	55.8	10%	0.104	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-6	178.6	43.6	0	0	0	0	113.6	E116 K119 A123 T124 V125 Q159	E116-T121 WeakPolarHBondContact OE2-CB 3.16Å; E116-T121 PolarHBondContact OE2-OG1 2.96Å; K119-T121 PolarHBondContact O-N 3.45Å; T121-A123 PolarHBondContact O-N 3.42Å; T121-T124 PolarHBondContact O-N 2.7Å; T121-V125 WeakPolarHBondContact O-CG2 3.22Å; T121-V125 PolarHBondContact O-N 3.02Å; T121-Q159 HydrophobicContact CG2-CB 3.82Å; T121-Q159 HydrophobicContact CG2-CG 4.01Å
122	Q	79.8	Confident	77.9	Confident	70 Å²	70	53.8 Å²	53.8	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-56.5	-52	-175.1	-175.3	177.2	-9.5	0	0	113.1	K119 T124 V125 E126	K119-Q122 VanDerWaalsContact O-CB 3.31Å; K119-Q122 WeakPolarHBondContact O-CB 3.43Å; K119-Q122 PolarHBondContact O-N 3.44Å; K119-Q122 VanDerWaalsContact O-N 3.1Å; Q122-T124 VanDerWaalsContact C-N 3.28Å; Q122-T124 PolarHBondContact O-N 3.12Å; Q122-V125 PolarHBondContact O-N 2.9Å; Q122-V125 VanDerWaalsContact O-N 3.14Å; Q122-E126 WeakPolarHBondContact O-CB 3.04Å; Q122-E126 PolarHBondContact O-N 3.07Å
123	A	81	Confident	77.4	Confident	71 Å²	71	53.9 Å²	53.9	59%	0.587	32%	0.319	S	S	*	.	H	α-helix	trans	-60.5	-38.1	-177.8	0	0	0	0	0	112.6	T121 K127	T121-A123 PolarHBondContact O-N 3.42Å; A123-K127 WeakPolarHBondContact O-CB 3.45Å; A123-K127 PolarHBondContact O-N 3.38Å; A123-K127 VanDerWaalsContact O-N 3.11Å
124	T	82.6	Confident	76.9	Confident	13 Å²	13	54.2 Å²	54.2	8%	0.08	33%	0.327	C	S	.	.	H	α-helix	trans	-69.1	-40.9	177.7	-52.8	0	0	0	0	111.4	T121 Q122 F128 E156 Q159 L160	T121-T124 PolarHBondContact O-N 2.7Å; Q122-T124 VanDerWaalsContact C-N 3.28Å; Q122-T124 PolarHBondContact O-N 3.12Å; T124-F128 WeakPolarHBondContact O-CB 3.4Å; T124-F128 PolarHBondContact O-N 2.81Å; T124-E156 HydrophobicContact CG2-CB 3.52Å; T124-E156 HydrophobicContact CG2-CG 3.69Å; T124-Q159 HydrophobicContact CG2-CB 4.49Å; T124-Q159 PolarHBondContact OG1-OE1 2.79Å; T124-L160 HydrophobicContact CG2-CD2 4.12Å; T124-L160 HydrophobicContact CG2-CG 4.02Å
125	V	82.4	Confident	76.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-69	-41.5	178.5	173.7	0	0	0	0	111.2	V112 E116 T121 Q122 F128 L129 L160 V165	V112-V125 HydrophobicContact CG1-CG1 3.31Å; E116-V125 HydrophobicContact CG-CB 4.34Å; E116-V125 HydrophobicContact CG-CG1 4.17Å; E116-V125 HydrophobicContact CG-CG2 4.13Å; T121-V125 WeakPolarHBondContact O-CG2 3.22Å; T121-V125 PolarHBondContact O-N 3.02Å; Q122-V125 PolarHBondContact O-N 2.9Å; Q122-V125 VanDerWaalsContact O-N 3.14Å; V125-F128 CarbonylContact O-C 3.57Å; V125-F128 WeakPolarHBondContact O-CA 3.2Å; V125-F128 WeakPolarHBondContact O-CB 3.48Å; V125-F128 PolarHBondContact O-N 2.89Å; V125-F128 VanDerWaalsContact O-N 3.13Å; V125-L129 HydrophobicContact CG1-CD1 4.26Å; V125-L129 HydrophobicContact CG1-CG 4.33Å; V125-L129 WeakPolarHBondContact O-CG 3.24Å; V125-L129 PolarHBondContact O-N 3.24Å; V125-L160 HydrophobicContact CB-CD2 4.4Å; V125-L160 HydrophobicContact CG2-CD2 3.78Å; V125-V165 HydrophobicContact CG1-CG2 4.19Å; V125-V165 HydrophobicContact CG2-CG2 4.35Å
126	E	83.6	Confident	75.6	Confident	87 Å²	87	55.3 Å²	55.3	41%	0.407	33%	0.326	S	S	.	.	H	α-helix	trans	-61	-48.8	176.5	-174.2	170.4	-159.4	0	0	111.3	L113 Q122 F128 L129 E130	L113-E126 HydrophobicContact CD2-CB 4.32Å; L113-E126 HydrophobicContact CD2-CG 4.34Å; Q122-E126 WeakPolarHBondContact O-CB 3.04Å; Q122-E126 PolarHBondContact O-N 3.07Å; E126-F128 PolarHBondContact O-N 2.77Å; E126-L129 PolarHBondContact O-N 3.49Å; E126-L129 VanDerWaalsContact O-N 3.1Å; E126-E130 PolarHBondContact O-N 2.85Å
127	K	83.5	Confident	75.2	Confident	78 Å²	78	56.7 Å²	56.7	34%	0.339	34%	0.335	S	S	.	.	H	α-helix	trans	-57.1	-37.3	172.7	-177.8	-179.9	167.4	-166.3	0	112.1	A123 K131 F152 E156	A123-K127 WeakPolarHBondContact O-CB 3.45Å; A123-K127 PolarHBondContact O-N 3.38Å; A123-K127 VanDerWaalsContact O-N 3.11Å; K127-K131 WeakPolarHBondContact O-CB 3.36Å; K127-K131 PolarHBondContact O-N 3.46Å; K127-F152 HydrophobicContact CD-CE1 4.06Å; K127-F152 HydrophobicContact CG-CE1 4.08Å; K127-F152 HydrophobicContact CG-CZ 4.1Å; K127-E156 IonicContact NZ-OE1 2.65Å; K127-E156 PolarHBondContact NZ-OE1 3.43Å; K127-E156 IonicContact NZ-OE2 3.4Å
128	F	83.3	Confident	75.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-43.4	175.1	179.2	-90.4	0	0	0	112.4	T124 V125 E126 E130 K131 V132 V133 F141 M146 F152 L160 V165 L166 L176	T124-F128 WeakPolarHBondContact O-CB 3.4Å; T124-F128 PolarHBondContact O-N 2.81Å; V125-F128 CarbonylContact O-C 3.57Å; V125-F128 WeakPolarHBondContact O-CA 3.2Å; V125-F128 WeakPolarHBondContact O-CB 3.48Å; V125-F128 PolarHBondContact O-N 2.89Å; V125-F128 VanDerWaalsContact O-N 3.13Å; E126-F128 PolarHBondContact O-N 2.77Å; F128-E130 VanDerWaalsContact C-N 3.32Å; F128-E130 PolarHBondContact O-N 3.25Å; F128-K131 PolarHBondContact O-N 3.42Å; F128-V132 HydrophobicContact CD1-CB 4.45Å; F128-V132 HydrophobicContact CD2-CB 3.92Å; F128-V132 HydrophobicContact CD2-CG1 4.49Å; F128-V132 HydrophobicContact CD2-CG2 3.41Å; F128-V132 VanDerWaalsContact CD2-CG2 3.41Å; F128-V132 HydrophobicContact CE1-CB 4.26Å; F128-V132 HydrophobicContact CE1-CG1 4.39Å; F128-V132 HydrophobicContact CE2-CB 3.73Å; F128-V132 HydrophobicContact CE2-CG1 3.8Å; F128-V132 HydrophobicContact CE2-CG2 3.47Å; F128-V132 VanDerWaalsContact CE2-CG2 3.47Å; F128-V132 HydrophobicContact CG-CB 4.28Å; F128-V132 HydrophobicContact CG-CG2 4.11Å; F128-V132 HydrophobicContact CZ-CB 3.9Å; F128-V132 HydrophobicContact CZ-CG1 3.73Å; F128-V132 HydrophobicContact CZ-CG2 4.17Å; F128-V132 WeakPolarHBondContact O-CA 3.4Å; F128-V132 VanDerWaalsContact O-CB 3.22Å; F128-V132 WeakPolarHBondContact O-CB 3.45Å; F128-V132 PolarHBondContact O-N 3.25Å; F128-V133 HydrophobicContact CE1-CG2 4.33Å; F128-V133 PolarHBondContact O-N 2.85Å; F128-F141 HydrophobicContact CZ-CE2 4.24Å; F128-M146 HydrophobicContact CD2-CE 4.23Å; F128-M146 HydrophobicContact CE2-CE 3.96Å; F128-M146 HydrophobicContact CE2-SD 4.35Å; F128-F152 HydrophobicContact CB-CE1 4.42Å; F128-F152 HydrophobicContact CB-CZ 3.89Å; F128-F152 HydrophobicContact CD2-CE2 4.06Å; F128-F152 HydrophobicContact CD2-CZ 4.16Å; F128-L160 HydrophobicContact CB-CD1 4.12Å; F128-L160 HydrophobicContact CB-CD2 3.79Å; F128-L160 HydrophobicContact CD2-CD1 3.5Å; F128-L160 HydrophobicContact CD2-CD2 4.41Å; F128-L160 HydrophobicContact CE2-CD1 4.14Å; F128-L160 HydrophobicContact CG-CD1 3.94Å; F128-L160 HydrophobicContact CG-CD2 4Å; F128-V165 HydrophobicContact CD1-CG1 3.77Å; F128-V165 HydrophobicContact CE1-CG1 3.56Å; F128-V165 HydrophobicContact CZ-CG1 4.36Å; F128-L166 HydrophobicContact CE2-CD1 4.46Å; F128-L166 HydrophobicContact CE2-CD2 4.33Å; F128-L166 HydrophobicContact CZ-CD2 3.97Å; F128-L176 HydrophobicContact CE1-CD1 3.67Å; F128-L176 HydrophobicContact CZ-CD1 3.8Å
129	L	81.1	Confident	75.3	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-37.7	176.3	-67.8	176.7	0	0	0	112	Y108 K109 V112 L113 V125 E126 V133 S134	Y108-L129 HydrophobicContact CD1-CD2 4Å; Y108-L129 HydrophobicContact CE1-CD2 3.59Å; K109-L129 HydrophobicContact CG-CB 4.46Å; K109-L129 HydrophobicContact CG-CD1 4.46Å; K109-L129 HydrophobicContact CG-CD2 4.26Å; V112-L129 HydrophobicContact CB-CD1 4.13Å; V112-L129 HydrophobicContact CG1-CD1 3.92Å; V112-L129 HydrophobicContact CG1-CD2 4.41Å; V112-L129 HydrophobicContact CG1-CG 4.48Å; L113-L129 HydrophobicContact CD2-CD1 4.02Å; L113-L129 HydrophobicContact CG-CD1 3.91Å; V125-L129 HydrophobicContact CG1-CD1 4.26Å; V125-L129 HydrophobicContact CG1-CG 4.33Å; V125-L129 WeakPolarHBondContact O-CG 3.24Å; V125-L129 PolarHBondContact O-N 3.24Å; E126-L129 PolarHBondContact O-N 3.49Å; E126-L129 VanDerWaalsContact O-N 3.1Å; L129-V133 HydrophobicContact CD2-CB 4.5Å; L129-V133 HydrophobicContact CD2-CG2 3.81Å; L129-V133 WeakPolarHBondContact O-CB 3.28Å; L129-S134 PolarHBondContact O-N 3.44Å
130	E	80.3	Confident	75.2	Confident	137 Å²	137	47 Å²	47	64%	0.64	28%	0.278	S	S	*	.	H	α-helix	trans	-75.8	-32.2	178.3	-74.7	-162.6	156.1	0	0	113.5	E126 F128 S134	E126-E130 PolarHBondContact O-N 2.85Å; F128-E130 VanDerWaalsContact C-N 3.32Å; F128-E130 PolarHBondContact O-N 3.25Å; E130-S134 WeakPolarHBondContact O-CB 3.36Å; E130-S134 PolarHBondContact O-OG 2.81Å
131	K	75.6	Confident	75.5	Confident	67 Å²	67	42.5 Å²	42.5	29%	0.291	24%	0.24	S	C	.	.	H	α-helix	trans	-100.1	-35.1	-173.5	-157.4	177	-175	-179.9	0	113.4	K127 F128 S135 F150	K127-K131 WeakPolarHBondContact O-CB 3.36Å; K127-K131 PolarHBondContact O-N 3.46Å; F128-K131 PolarHBondContact O-N 3.42Å; K131-S135 WeakPolarHBondContact O-CB 3.48Å; K131-S135 PolarHBondContact O-OG 3.17Å; K131-S135 VanDerWaalsContact O-OG 3.08Å; K131-F150 WeakPolarHBondContact CD-O 3.4Å; K131-F150 WeakPolarHBondContact CE-O 3.24Å; K131-F150 HydrophobicContact CG-CD1 4.27Å; K131-F150 PolarHBondContact NZ-O 3.36Å
132	V	72.8	Confident	75.7	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-55.2	-177.1	-176	0	0	0	0	109.9	F128 S134 S135 C136 F141 F150 F152	F128-V132 HydrophobicContact CD1-CB 4.45Å; F128-V132 HydrophobicContact CD2-CB 3.92Å; F128-V132 HydrophobicContact CD2-CG1 4.49Å; F128-V132 HydrophobicContact CD2-CG2 3.41Å; F128-V132 VanDerWaalsContact CD2-CG2 3.41Å; F128-V132 HydrophobicContact CE1-CB 4.26Å; F128-V132 HydrophobicContact CE1-CG1 4.39Å; F128-V132 HydrophobicContact CE2-CB 3.73Å; F128-V132 HydrophobicContact CE2-CG1 3.8Å; F128-V132 HydrophobicContact CE2-CG2 3.47Å; F128-V132 VanDerWaalsContact CE2-CG2 3.47Å; F128-V132 HydrophobicContact CG-CB 4.28Å; F128-V132 HydrophobicContact CG-CG2 4.11Å; F128-V132 HydrophobicContact CZ-CB 3.9Å; F128-V132 HydrophobicContact CZ-CG1 3.73Å; F128-V132 HydrophobicContact CZ-CG2 4.17Å; F128-V132 WeakPolarHBondContact O-CA 3.4Å; F128-V132 VanDerWaalsContact O-CB 3.22Å; F128-V132 WeakPolarHBondContact O-CB 3.45Å; F128-V132 PolarHBondContact O-N 3.25Å; V132-S134 VanDerWaalsContact C-N 3.26Å; V132-S134 PolarHBondContact O-N 3.42Å; V132-S135 PolarHBondContact O-N 3.25Å; V132-S135 VanDerWaalsContact O-N 3.17Å; V132-C136 CarbonylContact O-C 3.47Å; V132-C136 PolarHBondContact O-N 2.91Å; V132-F141 HydrophobicContact CG1-CD1 4.15Å; V132-F141 HydrophobicContact CG1-CE1 3.28Å; V132-F141 HydrophobicContact CG1-CE2 4.05Å; V132-F141 HydrophobicContact CG1-CZ 3.22Å; V132-F150 HydrophobicContact CB-CD1 4.48Å; V132-F150 HydrophobicContact CB-CE1 4.28Å; V132-F150 HydrophobicContact CG1-CE1 4.38Å; V132-F150 HydrophobicContact CG1-CZ 4.22Å; V132-F150 HydrophobicContact CG2-CB 4.36Å; V132-F150 HydrophobicContact CG2-CD1 3.62Å; V132-F150 HydrophobicContact CG2-CD2 4.25Å; V132-F150 HydrophobicContact CG2-CE1 3.89Å; V132-F150 HydrophobicContact CG2-CE2 4.49Å; V132-F150 HydrophobicContact CG2-CG 3.81Å; V132-F150 HydrophobicContact CG2-CZ 4.32Å; V132-F152 HydrophobicContact CG2-CE2 3.87Å
133	V	71.8	Confident	75.7	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.03	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.1	-175.6	-179.8	0	0	0	0	112.8	L89 A105 Y108 K109 F128 L129	L89-V133 HydrophobicContact CD1-CG1 3.72Å; L89-V133 HydrophobicContact CD2-CG1 4.09Å; L89-V133 HydrophobicContact CG-CG1 4.42Å; A105-V133 HydrophobicContact CB-CG1 4.46Å; Y108-V133 HydrophobicContact CE1-CG2 4.27Å; K109-V133 HydrophobicContact CG-CG1 4.5Å; F128-V133 HydrophobicContact CE1-CG2 4.33Å; F128-V133 PolarHBondContact O-N 2.85Å; L129-V133 HydrophobicContact CD2-CB 4.5Å; L129-V133 HydrophobicContact CD2-CG2 3.81Å; L129-V133 WeakPolarHBondContact O-CB 3.28Å
134	S	68.5	Low	75.6	Confident	72 Å²	72	45.6 Å²	45.6	50%	0.503	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-30	173.6	73.5	0	0	0	0	113.9	L129 E130 V132	L129-S134 PolarHBondContact O-N 3.44Å; E130-S134 WeakPolarHBondContact O-CB 3.36Å; E130-S134 PolarHBondContact O-OG 2.81Å; V132-S134 VanDerWaalsContact C-N 3.26Å; V132-S134 PolarHBondContact O-N 3.42Å
135	S	64.7	Low	75.5	Confident	83 Å²	83	48.6 Å²	48.6	58%	0.58	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-22.9	-166.1	-55.6	0	0	0	0	112.3	K131 V132	K131-S135 WeakPolarHBondContact O-CB 3.48Å; K131-S135 PolarHBondContact O-OG 3.17Å; K131-S135 VanDerWaalsContact O-OG 3.08Å; V132-S135 PolarHBondContact O-N 3.25Å; V132-S135 VanDerWaalsContact O-N 3.17Å
136	C	61.6	Low	75.2	Confident	27 Å²	27	48.5 Å²	48.5	18%	0.182	26%	0.26	C	S	.	.			trans	-144.8	123.3	-179.1	-79.2	0	0	0	0	111.1	V132 D138 F150	V132-C136 CarbonylContact O-C 3.47Å; V132-C136 PolarHBondContact O-N 2.91Å; C136-D138 HydrophobicContact CB-CB 4.47Å; C136-F150 HydrophobicContact CB-CE1 4.47Å; C136-F150 HydrophobicContact CB-CZ 3.87Å
137	T	65.6	Low	75	Confident	33 Å²	33	47 Å²	47	20%	0.202	26%	0.255	C	S	.	.			trans	-92	18.4	168.8	50.2	0	0	0	0	113	Q83 L89 L139	Q83-T137 HydrophobicContact CG-CG2 4.49Å; Q83-T137 PolarHBondContact NE2-O 3.32Å; Q83-T137 VanDerWaalsContact O-CB 3.25Å; Q83-T137 WeakPolarHBondContact O-CB 3.39Å; Q83-T137 WeakPolarHBondContact O-CG2 3.45Å; Q83-T137 PolarHBondContact O-OG1 3.32Å; L89-T137 HydrophobicContact CD2-CG2 4.15Å; T137-L139 PolarHBondContact O-N 2.84Å
138	D	67.7	Low	74.6	Confident	62 Å²	62	52.5 Å²	52.5	33%	0.332	27%	0.273	S	S	.	.			trans	-59.7	131.3	175.9	-83.2	-17.3	0	0	0	110.9	C136 F141 K145	C136-D138 HydrophobicContact CB-CB 4.47Å; D138-F141 HydrophobicContact CB-CE1 4.1Å; D138-F141 HydrophobicContact CB-CZ 4.43Å; D138-F141 WeakPolarHBondContact O-CE2 3.44Å; D138-F141 WeakPolarHBondContact O-CZ 2.95Å; D138-K145 IonicContact OD2-NZ 2.75Å; D138-K145 PolarHBondContact OD2-NZ 2.87Å
139	L	69.5	Low	74.2	Confident	21 Å²	21	57.8 Å²	57.8	11%	0.11	30%	0.298	C	S	.	.	S	Bend	trans	-72.2	-36.5	179.3	-177.9	67.8	0	0	0	111.5	M90 F100 T137 W175 L176	M90-L139 HydrophobicContact CB-CD1 4.27Å; M90-L139 HydrophobicContact CE-CD2 4.27Å; M90-L139 HydrophobicContact CG-CD1 4.3Å; M90-L139 WeakPolarHBondContact O-CD1 3.15Å; F100-L139 HydrophobicContact CD1-CD2 3.94Å; F100-L139 HydrophobicContact CE1-CD2 3.63Å; T137-L139 PolarHBondContact O-N 2.84Å; L139-W175 HydrophobicContact CB-CE3 4.26Å; L139-W175 HydrophobicContact CB-CZ3 3.93Å; L139-W175 HydrophobicContact CD1-CE3 4.48Å; L139-W175 HydrophobicContact CD2-CE3 3.97Å; L139-W175 HydrophobicContact CD2-CH2 4.1Å; L139-W175 HydrophobicContact CD2-CZ3 3.44Å; L139-W175 VanDerWaalsContact CD2-CZ3 3.44Å; L139-W175 HydrophobicContact CG-CE3 3.53Å; L139-W175 HydrophobicContact CG-CH2 4.48Å; L139-W175 HydrophobicContact CG-CZ3 3.4Å; L139-W175 VanDerWaalsContact O-CE3 3.31Å; L139-L176 PolarHBondContact O-N 3.1Å
140	S	74.8	Confident	73.8	Confident	41 Å²	41	57.9 Å²	57.9	29%	0.287	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.9	-178.6	53.9	0	0	0	0	113	W174	S140-W174 CarbonylContact C-O 3.55Å; S140-W174 WeakPolarHBondContact CA-O 3.39Å
141	F	79.1	Confident	73.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.6	175.7	-57.2	-75.3	0	0	0	110.9	F128 V132 D138 M146 F150 L166 S173 W174 L176	F128-F141 HydrophobicContact CZ-CE2 4.24Å; V132-F141 HydrophobicContact CG1-CD1 4.15Å; V132-F141 HydrophobicContact CG1-CE1 3.28Å; V132-F141 HydrophobicContact CG1-CE2 4.05Å; V132-F141 HydrophobicContact CG1-CZ 3.22Å; D138-F141 HydrophobicContact CB-CE1 4.1Å; D138-F141 HydrophobicContact CB-CZ 4.43Å; D138-F141 WeakPolarHBondContact O-CE2 3.44Å; D138-F141 WeakPolarHBondContact O-CZ 2.95Å; F141-M146 HydrophobicContact CB-CG 3.83Å; F141-M146 HydrophobicContact CB-SD 3.77Å; F141-M146 HydrophobicContact CD1-SD 4.3Å; F141-M146 HydrophobicContact CG-SD 4.05Å; F141-F150 HydrophobicContact CD1-CE2 4.01Å; F141-F150 HydrophobicContact CE1-CE2 4.18Å; F141-F150 HydrophobicContact CE1-CZ 4.39Å; F141-L166 HydrophobicContact CD2-CD2 4.08Å; F141-S173 WeakPolarHBondContact O-CA 3.25Å; F141-W174 PolarHBondContact N-O 3.25Å; F141-W174 PolarHBondContact O-N 3.1Å; F141-L176 HydrophobicContact CE2-CB 4.06Å; F141-L176 HydrophobicContact CE2-CD1 4.21Å
142	S	81.4	Confident	74	Confident	49 Å²	49	53.7 Å²	53.7	34%	0.343	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	156.5	171.6	-55	0	0	0	0	110.9	D144 K145 M146 G172	S142-D144 VanDerWaalsContact C-N 3.29Å; S142-D144 PolarHBondContact O-N 3.36Å; S142-K145 PolarHBondContact O-N 3.18Å; S142-M146 PolarHBondContact O-N 3.21Å; S142-G172 CarbonylContact C-O 3.57Å
143	K	79.4	Confident	74.5	Confident	83 Å²	83	57 Å²	57	36%	0.361	30%	0.303	S	S	.	.	H	α-helix	trans	-53.9	-43	176.5	-173.2	168.9	-177.3	160.8	0	112.7	K145 M146 L147 D154 G172 W174	K143-K145 PolarHBondContact O-N 3.14Å; K143-M146 PolarHBondContact O-N 3.24Å; K143-L147 HydrophobicContact CD-CD1 4.3Å; K143-L147 VanDerWaalsContact CE-CD1 3.47Å; K143-L147 HydrophobicContact CG-CD1 3.77Å; K143-L147 HydrophobicContact CG-CG 4.11Å; K143-L147 WeakPolarHBondContact O-CB 3.5Å; K143-L147 VanDerWaalsContact O-CG 3.32Å; K143-L147 WeakPolarHBondContact O-CG 3.44Å; K143-L147 PolarHBondContact O-N 3.37Å; K143-D154 VanDerWaalsContact CE-OD1 3.23Å; K143-D154 WeakPolarHBondContact CE-OD1 3.47Å; K143-D154 IonicContact NZ-OD1 2.84Å; K143-D154 PolarHBondContact NZ-OD1 3.1Å; K143-D154 IonicContact NZ-OD2 3.93Å; K143-G172 WeakPolarHBondContact CB-O 3.11Å; K143-G172 PolarHBondContact N-O 3.35Å; K143-W174 HydrophobicContact CB-CH2 4.08Å; K143-W174 HydrophobicContact CB-CZ3 3.95Å; K143-W174 HydrophobicContact CG-CH2 4.26Å; K143-W174 HydrophobicContact CG-CZ3 4.47Å
144	D	78.5	Confident	75.1	Confident	91 Å²	91	60.6 Å²	60.6	49%	0.487	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-40.1	176.3	-70.7	-79.9	0	0	0	112.9	S142 R148	S142-D144 VanDerWaalsContact C-N 3.29Å; S142-D144 PolarHBondContact O-N 3.36Å; D144-R148 WeakPolarHBondContact O-CA 3.47Å; D144-R148 WeakPolarHBondContact O-CB 3.3Å; D144-R148 VanDerWaalsContact O-CG 3.31Å; D144-R148 WeakPolarHBondContact O-CG 3.49Å; D144-R148 PolarHBondContact O-N 3.12Å; D144-R148 IonicContact OD1-CZ 2.68Å; D144-R148 IonicContact OD1-NE 3.71Å; D144-R148 PolarHBondContact OD1-NE 3.36Å; D144-R148 IonicContact OD1-NH2 3.55Å; D144-R148 PolarHBondContact OD1-NH2 3.29Å
145	K	79.6	Confident	75.9	Confident	76 Å²	76	60.9 Å²	60.9	33%	0.33	32%	0.323	S	S	.	.	I	π-helix	trans	-63.9	-47.8	174.9	-74	-169.5	168.2	-174.5	0	110.8	D138 S142 K143 L147 E149 F150	D138-K145 IonicContact OD2-NZ 2.75Å; D138-K145 PolarHBondContact OD2-NZ 2.87Å; S142-K145 PolarHBondContact O-N 3.18Å; K143-K145 PolarHBondContact O-N 3.14Å; K145-L147 PolarHBondContact O-N 3.19Å; K145-E149 WeakPolarHBondContact O-CA 3.5Å; K145-E149 WeakPolarHBondContact O-CB 3.28Å; K145-E149 PolarHBondContact O-N 3.02Å; K145-F150 HydrophobicContact CB-CE2 4.41Å; K145-F150 WeakPolarHBondContact O-CD2 3.44Å; K145-F150 PolarHBondContact O-N 2.9Å
146	M	78	Confident	76.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-61.8	-42.5	-179.5	-69.2	-64.3	-72.8	0	0	113	F128 F141 S142 K143 F150 L151 F152 I157 L160 L166 W174	F128-M146 HydrophobicContact CD2-CE 4.23Å; F128-M146 HydrophobicContact CE2-CE 3.96Å; F128-M146 HydrophobicContact CE2-SD 4.35Å; F141-M146 HydrophobicContact CB-CG 3.83Å; F141-M146 HydrophobicContact CB-SD 3.77Å; F141-M146 HydrophobicContact CD1-SD 4.3Å; F141-M146 HydrophobicContact CG-SD 4.05Å; S142-M146 PolarHBondContact O-N 3.21Å; K143-M146 PolarHBondContact O-N 3.24Å; M146-F150 CarbonylContact O-C 3.54Å; M146-F150 HydrophobicContact SD-CD2 4.16Å; M146-L151 PolarHBondContact O-N 2.76Å; M146-F152 HydrophobicContact CE-CB 4.49Å; M146-F152 HydrophobicContact CE-CD2 3.93Å; M146-F152 HydrophobicContact CE-CG 4.33Å; M146-F152 PolarHBondContact O-N 3.43Å; M146-I157 HydrophobicContact CB-CD1 3.82Å; M146-I157 HydrophobicContact CB-CG1 4.48Å; M146-I157 HydrophobicContact CE-CG1 4.02Å; M146-L160 HydrophobicContact CE-CD1 4.12Å; M146-L166 HydrophobicContact CE-CD1 4Å; M146-W174 HydrophobicContact CG-CE3 4.33Å; M146-W174 HydrophobicContact CG-CZ3 4.32Å
147	L	78	Confident	78	Confident	56 Å²	56	57.2 Å²	57.2	29%	0.293	30%	0.295	S	S	.	.	I	π-helix	trans	-81.8	-42	-177.5	-65.1	-176.1	0	0	0	113.1	K143 K145 L151 F152 I157	K143-L147 HydrophobicContact CD-CD1 4.3Å; K143-L147 VanDerWaalsContact CE-CD1 3.47Å; K143-L147 HydrophobicContact CG-CD1 3.77Å; K143-L147 HydrophobicContact CG-CG 4.11Å; K143-L147 WeakPolarHBondContact O-CB 3.5Å; K143-L147 VanDerWaalsContact O-CG 3.32Å; K143-L147 WeakPolarHBondContact O-CG 3.44Å; K143-L147 PolarHBondContact O-N 3.37Å; K145-L147 PolarHBondContact O-N 3.19Å; L147-L151 WeakPolarHBondContact O-CA 3.23Å; L147-F152 WeakPolarHBondContact CD2-O 3.44Å; L147-I157 HydrophobicContact CD2-CD1 4.04Å
148	R	75.1	Confident	78.9	Confident	192 Å²	192	60.1 Å²	60.1	73%	0.725	31%	0.313	S	S	*	.	I	π-helix	trans	-90.9	-40.1	-172.2	-56.7	-177.9	-169.5	-143.4	3.7	113.2	D144	D144-R148 WeakPolarHBondContact O-CA 3.47Å; D144-R148 WeakPolarHBondContact O-CB 3.3Å; D144-R148 VanDerWaalsContact O-CG 3.31Å; D144-R148 WeakPolarHBondContact O-CG 3.49Å; D144-R148 PolarHBondContact O-N 3.12Å; D144-R148 IonicContact OD1-CZ 2.68Å; D144-R148 IonicContact OD1-NE 3.71Å; D144-R148 PolarHBondContact OD1-NE 3.36Å; D144-R148 IonicContact OD1-NH2 3.55Å; D144-R148 PolarHBondContact OD1-NH2 3.29Å
149	E	75	Confident	79.8	Confident	112 Å²	112	60.2 Å²	60.2	52%	0.523	31%	0.311	S	S	.	.	I	π-helix	trans	-91.7	-47.9	-173.8	-166.2	170.1	-173.8	0	0	110.4	K145	K145-E149 WeakPolarHBondContact O-CA 3.5Å; K145-E149 WeakPolarHBondContact O-CB 3.28Å; K145-E149 PolarHBondContact O-N 3.02Å
150	F	73.5	Confident	80.5	Confident	7 Å²	7	59.2 Å²	59.2	3%	0.031	31%	0.306	C	S	.	.	S	Bend	trans	-91	-8.7	-179.2	-59.5	-66.9	0	0	0	114.1	K131 V132 C136 F141 K145 M146 F152	K131-F150 WeakPolarHBondContact CD-O 3.4Å; K131-F150 WeakPolarHBondContact CE-O 3.24Å; K131-F150 HydrophobicContact CG-CD1 4.27Å; K131-F150 PolarHBondContact NZ-O 3.36Å; V132-F150 HydrophobicContact CB-CD1 4.48Å; V132-F150 HydrophobicContact CB-CE1 4.28Å; V132-F150 HydrophobicContact CG1-CE1 4.38Å; V132-F150 HydrophobicContact CG1-CZ 4.22Å; V132-F150 HydrophobicContact CG2-CB 4.36Å; V132-F150 HydrophobicContact CG2-CD1 3.62Å; V132-F150 HydrophobicContact CG2-CD2 4.25Å; V132-F150 HydrophobicContact CG2-CE1 3.89Å; V132-F150 HydrophobicContact CG2-CE2 4.49Å; V132-F150 HydrophobicContact CG2-CG 3.81Å; V132-F150 HydrophobicContact CG2-CZ 4.32Å; C136-F150 HydrophobicContact CB-CE1 4.47Å; C136-F150 HydrophobicContact CB-CZ 3.87Å; F141-F150 HydrophobicContact CD1-CE2 4.01Å; F141-F150 HydrophobicContact CE1-CE2 4.18Å; F141-F150 HydrophobicContact CE1-CZ 4.39Å; K145-F150 HydrophobicContact CB-CE2 4.41Å; K145-F150 WeakPolarHBondContact O-CD2 3.44Å; K145-F150 PolarHBondContact O-N 2.9Å; M146-F150 CarbonylContact O-C 3.54Å; M146-F150 HydrophobicContact SD-CD2 4.16Å; F150-F152 HydrophobicContact CB-CD2 3.49Å; F150-F152 VanDerWaalsContact CB-CD2 3.49Å; F150-F152 HydrophobicContact CB-CE2 3.71Å; F150-F152 PolarHBondContact O-N 2.65Å
151	L	78.6	Confident	81	Confident	111 Å²	111	59.5 Å²	59.5	58%	0.581	31%	0.306	S	S	*	.			trans	53.2	39.5	177.7	-54.7	172.7	0	0	0	113	M146 L147	M146-L151 PolarHBondContact O-N 2.76Å; L147-L151 WeakPolarHBondContact O-CA 3.23Å
152	F	81.5	Confident	81.2	Confident	5 Å²	5	68.1 Å²	68.1	2%	0.022	34%	0.343	C	S	.	.			trans	-84.5	151.7	170.1	-76.6	-75.7	0	0	0	110.8	K127 F128 V132 M146 L147 F150 E156 I157	K127-F152 HydrophobicContact CD-CE1 4.06Å; K127-F152 HydrophobicContact CG-CE1 4.08Å; K127-F152 HydrophobicContact CG-CZ 4.1Å; F128-F152 HydrophobicContact CB-CE1 4.42Å; F128-F152 HydrophobicContact CB-CZ 3.89Å; F128-F152 HydrophobicContact CD2-CE2 4.06Å; F128-F152 HydrophobicContact CD2-CZ 4.16Å; V132-F152 HydrophobicContact CG2-CE2 3.87Å; M146-F152 HydrophobicContact CE-CB 4.49Å; M146-F152 HydrophobicContact CE-CD2 3.93Å; M146-F152 HydrophobicContact CE-CG 4.33Å; M146-F152 PolarHBondContact O-N 3.43Å; L147-F152 WeakPolarHBondContact CD2-O 3.44Å; F150-F152 HydrophobicContact CB-CD2 3.49Å; F150-F152 VanDerWaalsContact CB-CD2 3.49Å; F150-F152 HydrophobicContact CB-CE2 3.71Å; F150-F152 PolarHBondContact O-N 2.65Å; F152-E156 WeakPolarHBondContact CA-OE2 3.34Å; F152-E156 HydrophobicContact CD1-CB 3.88Å; F152-E156 HydrophobicContact CD1-CG 4.39Å; F152-I157 HydrophobicContact CB-CG1 4.13Å
153	T	83.8	Confident	81.2	Confident	69 Å²	69	66.4 Å²	66.4	42%	0.423	33%	0.331	S	S	.	.			trans	-90.4	154.6	171.3	53.2	0	0	0	0	111	S155 E156 I157	T153-S155 PolarHBondContact O-N 2.87Å; T153-S155 VanDerWaalsContact O-N 3.14Å; T153-S155 PolarHBondContact OG1-OG 3.01Å; T153-S155 VanDerWaalsContact OG1-OG 3.06Å; T153-E156 PolarHBondContact N-OE2 2.68Å; T153-E156 PolarHBondContact O-N 3.35Å; T153-E156 WeakPolarHBondContact OG1-CB 3.34Å; T153-E156 VanDerWaalsContact OG1-CD 3.3Å; T153-E156 WeakPolarHBondContact OG1-CG 3.39Å; T153-E156 PolarHBondContact OG1-N 3.47Å; T153-E156 PolarHBondContact OG1-OE2 2.82Å; T153-I157 WeakPolarHBondContact O-CG1 3.44Å; T153-I157 PolarHBondContact O-N 3.16Å
154	D	84.2	Confident	81.2	Confident	81 Å²	81	63.6 Å²	63.6	43%	0.433	33%	0.326	S	S	.	.	H	α-helix	trans	-56.9	-30.1	176.4	-69.6	-74.2	0	0	0	112.2	K143 T158	K143-D154 VanDerWaalsContact CE-OD1 3.23Å; K143-D154 WeakPolarHBondContact CE-OD1 3.47Å; K143-D154 IonicContact NZ-OD1 2.84Å; K143-D154 PolarHBondContact NZ-OD1 3.1Å; K143-D154 IonicContact NZ-OD2 3.93Å; D154-T158 WeakPolarHBondContact O-CB 3.28Å; D154-T158 PolarHBondContact O-N 3.01Å; D154-T158 PolarHBondContact O-OG1 2.69Å
155	S	85.3	Confident	81.5	Confident	77 Å²	77	59.2 Å²	59.2	54%	0.538	30%	0.302	S	S	.	.	H	α-helix	trans	-67.8	-43.6	173.8	47.8	0	0	0	0	113	T153 T158 Q159	T153-S155 PolarHBondContact O-N 2.87Å; T153-S155 VanDerWaalsContact O-N 3.14Å; T153-S155 PolarHBondContact OG1-OG 3.01Å; T153-S155 VanDerWaalsContact OG1-OG 3.06Å; S155-T158 WeakPolarHBondContact O-CB 3.37Å; S155-T158 PolarHBondContact O-N 2.83Å; S155-Q159 WeakPolarHBondContact O-CG 3.43Å; S155-Q159 PolarHBondContact O-N 3.2Å
156	E	84.6	Confident	81.7	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.136	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-41.2	175.7	-75.7	168.1	132.8	0	0	110.5	T124 K127 F152 T153 T158 Q159 L160	T124-E156 HydrophobicContact CG2-CB 3.52Å; T124-E156 HydrophobicContact CG2-CG 3.69Å; K127-E156 IonicContact NZ-OE1 2.65Å; K127-E156 PolarHBondContact NZ-OE1 3.43Å; K127-E156 IonicContact NZ-OE2 3.4Å; F152-E156 WeakPolarHBondContact CA-OE2 3.34Å; F152-E156 HydrophobicContact CD1-CB 3.88Å; F152-E156 HydrophobicContact CD1-CG 4.39Å; T153-E156 PolarHBondContact N-OE2 2.68Å; T153-E156 PolarHBondContact O-N 3.35Å; T153-E156 WeakPolarHBondContact OG1-CB 3.34Å; T153-E156 VanDerWaalsContact OG1-CD 3.3Å; T153-E156 WeakPolarHBondContact OG1-CG 3.39Å; T153-E156 PolarHBondContact OG1-N 3.47Å; T153-E156 PolarHBondContact OG1-OE2 2.82Å; E156-T158 VanDerWaalsContact C-N 3.3Å; E156-T158 PolarHBondContact O-N 2.68Å; E156-Q159 WeakPolarHBondContact O-CB 3.32Å; E156-Q159 PolarHBondContact O-N 3.04Å; E156-Q159 VanDerWaalsContact O-N 3.12Å; E156-L160 WeakPolarHBondContact O-CG 3.46Å; E156-L160 PolarHBondContact O-N 2.79Å
157	I	84.1	Confident	82	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-42.9	175.2	-62.2	169.5	0	0	0	110.5	M146 L147 F152 T153 Q159 L160 V161 W174	M146-I157 HydrophobicContact CB-CD1 3.82Å; M146-I157 HydrophobicContact CB-CG1 4.48Å; M146-I157 HydrophobicContact CE-CG1 4.02Å; L147-I157 HydrophobicContact CD2-CD1 4.04Å; F152-I157 HydrophobicContact CB-CG1 4.13Å; T153-I157 WeakPolarHBondContact O-CG1 3.44Å; T153-I157 PolarHBondContact O-N 3.16Å; I157-Q159 VanDerWaalsContact C-N 3.3Å; I157-Q159 PolarHBondContact O-N 2.92Å; I157-L160 PolarHBondContact O-N 3.47Å; I157-V161 WeakPolarHBondContact O-CG2 3.44Å; I157-V161 PolarHBondContact O-N 3.13Å; I157-W174 HydrophobicContact CD1-CH2 4.27Å; I157-W174 HydrophobicContact CD1-CZ3 4.4Å; I157-W174 HydrophobicContact CG2-CD2 4.18Å; I157-W174 HydrophobicContact CG2-CE3 4.39Å; I157-W174 HydrophobicContact CG2-CH2 3.91Å; I157-W174 HydrophobicContact CG2-CZ2 3.67Å; I157-W174 HydrophobicContact CG2-CZ3 4.25Å
158	T	85.5	Confident	82.3	Confident	95 Å²	95	60.5 Å²	60.5	58%	0.583	32%	0.319	S	S	*	.	H	α-helix	trans	-62.6	-38.3	176.2	-56.1	0	0	0	0	111.6	D154 S155 E156 V161 K162	D154-T158 WeakPolarHBondContact O-CB 3.28Å; D154-T158 PolarHBondContact O-N 3.01Å; D154-T158 PolarHBondContact O-OG1 2.69Å; S155-T158 WeakPolarHBondContact O-CB 3.37Å; S155-T158 PolarHBondContact O-N 2.83Å; E156-T158 VanDerWaalsContact C-N 3.3Å; E156-T158 PolarHBondContact O-N 2.68Å; T158-V161 PolarHBondContact O-N 3.21Å; T158-K162 WeakPolarHBondContact O-CB 3.27Å; T158-K162 PolarHBondContact O-N 3.15Å
159	Q	85.5	Confident	82.5	Confident	63 Å²	63	57.3 Å²	57.3	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-41.5	173.7	-76.1	-179	-30.6	0	0	112.5	T121 T124 S155 E156 I157 K162 S163	T121-Q159 HydrophobicContact CG2-CB 3.82Å; T121-Q159 HydrophobicContact CG2-CG 4.01Å; T124-Q159 HydrophobicContact CG2-CB 4.49Å; T124-Q159 PolarHBondContact OG1-OE1 2.79Å; S155-Q159 WeakPolarHBondContact O-CG 3.43Å; S155-Q159 PolarHBondContact O-N 3.2Å; E156-Q159 WeakPolarHBondContact O-CB 3.32Å; E156-Q159 PolarHBondContact O-N 3.04Å; E156-Q159 VanDerWaalsContact O-N 3.12Å; I157-Q159 VanDerWaalsContact C-N 3.3Å; I157-Q159 PolarHBondContact O-N 2.92Å; Q159-K162 WeakPolarHBondContact O-CB 3.35Å; Q159-K162 PolarHBondContact O-N 3.33Å; Q159-S163 PolarHBondContact O-N 3.4Å; Q159-S163 PolarHBondContact O-OG 3.16Å
160	L	84.5	Confident	82.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.8	-36.3	176.8	-68.3	172.4	0	0	0	112.7	T124 V125 F128 M146 E156 I157 S163 G164 V165 L166	T124-L160 HydrophobicContact CG2-CD2 4.12Å; T124-L160 HydrophobicContact CG2-CG 4.02Å; V125-L160 HydrophobicContact CB-CD2 4.4Å; V125-L160 HydrophobicContact CG2-CD2 3.78Å; F128-L160 HydrophobicContact CB-CD1 4.12Å; F128-L160 HydrophobicContact CB-CD2 3.79Å; F128-L160 HydrophobicContact CD2-CD1 3.5Å; F128-L160 HydrophobicContact CD2-CD2 4.41Å; F128-L160 HydrophobicContact CE2-CD1 4.14Å; F128-L160 HydrophobicContact CG-CD1 3.94Å; F128-L160 HydrophobicContact CG-CD2 4Å; M146-L160 HydrophobicContact CE-CD1 4.12Å; E156-L160 WeakPolarHBondContact O-CG 3.46Å; E156-L160 PolarHBondContact O-N 2.79Å; I157-L160 PolarHBondContact O-N 3.47Å; L160-S163 WeakPolarHBondContact CA-OG 3.34Å; L160-S163 PolarHBondContact O-OG 3.14Å; L160-G164 PolarHBondContact O-N 3.47Å; L160-V165 PolarHBondContact O-N 3.34Å; L160-V165 VanDerWaalsContact O-N 3.14Å; L160-L166 HydrophobicContact CB-CD1 3.72Å; L160-L166 HydrophobicContact CB-CG 4.08Å; L160-L166 HydrophobicContact CD1-CD1 3.96Å; L160-L166 PolarHBondContact O-N 3.45Å
161	V	85.3	Confident	82.9	Confident	48 Å²	48	61.3 Å²	61.3	29%	0.291	35%	0.347	S	S	.	.	H	α-helix	trans	-67.5	-41.5	171.8	174.6	0	0	0	0	110.4	I157 T158 S163 G164 L166 V168	I157-V161 WeakPolarHBondContact O-CG2 3.44Å; I157-V161 PolarHBondContact O-N 3.13Å; T158-V161 PolarHBondContact O-N 3.21Å; V161-S163 VanDerWaalsContact C-N 3.35Å; V161-S163 PolarHBondContact O-N 3.06Å; V161-G164 PolarHBondContact O-N 3.4Å; V161-G164 VanDerWaalsContact O-N 3.09Å; V161-L166 WeakPolarHBondContact CA-O 3.41Å; V161-L166 HydrophobicContact CG2-CB 3.9Å; V161-V168 HydrophobicContact CG1-CG2 4.39Å
162	K	84.3	Confident	82.8	Confident	182 Å²	182	57.1 Å²	57.1	79%	0.791	33%	0.331	S	S	*	.	H	α-helix	trans	-66	-34.4	178	-172.2	178	179.5	-178.7	0	112.9	T158 Q159 G164	T158-K162 WeakPolarHBondContact O-CB 3.27Å; T158-K162 PolarHBondContact O-N 3.15Å; Q159-K162 WeakPolarHBondContact O-CB 3.35Å; Q159-K162 PolarHBondContact O-N 3.33Å; K162-G164 PolarHBondContact O-N 3.42Å
163	S	80.6	Confident	82.9	Confident	14 Å²	14	58.2 Å²	58.2	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-74.7	-13	173.9	63.4	0	0	0	0	112.8	Q159 L160 V161 V165 P179	Q159-S163 PolarHBondContact O-N 3.4Å; Q159-S163 PolarHBondContact O-OG 3.16Å; L160-S163 WeakPolarHBondContact CA-OG 3.34Å; L160-S163 PolarHBondContact O-OG 3.14Å; V161-S163 VanDerWaalsContact C-N 3.35Å; V161-S163 PolarHBondContact O-N 3.06Å; S163-V165 VanDerWaalsContact C-N 3.34Å; S163-P179 WeakPolarHBondContact O-CB 3.39Å
164	G	80.7	Confident	83	Confident	23 Å²	23	56.3 Å²	56.3	24%	0.237	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	15.1	178.9	0	0	0	0	0	114	L160 V161 K162 S177 I178 P179	L160-G164 PolarHBondContact O-N 3.47Å; V161-G164 PolarHBondContact O-N 3.4Å; V161-G164 VanDerWaalsContact O-N 3.09Å; K162-G164 PolarHBondContact O-N 3.42Å; G164-S177 PolarHBondContact O-OG 3.44Å; G164-I178 CarbonylContact O-C 3.56Å; G164-P179 WeakPolarHBondContact O-CA 3.39Å
165	V	83.9	Confident	83.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-78.4	-25.8	171.9	172.6	0	0	0	0	111.1	V112 V125 F128 L160 S163 L176 S177	V112-V165 HydrophobicContact CG1-CG2 4.04Å; V125-V165 HydrophobicContact CG1-CG2 4.19Å; V125-V165 HydrophobicContact CG2-CG2 4.35Å; F128-V165 HydrophobicContact CD1-CG1 3.77Å; F128-V165 HydrophobicContact CE1-CG1 3.56Å; F128-V165 HydrophobicContact CZ-CG1 4.36Å; L160-V165 PolarHBondContact O-N 3.34Å; L160-V165 VanDerWaalsContact O-N 3.14Å; S163-V165 VanDerWaalsContact C-N 3.34Å; V165-L176 HydrophobicContact CG1-CD1 4.4Å; V165-S177 CarbonylContact C-O 3.58Å; V165-S177 WeakPolarHBondContact CA-O 3.46Å; V165-S177 PolarHBondContact O-N 2.79Å; V165-S177 VanDerWaalsContact O-O 3.14Å; V165-S177 PolarHBondContact O-OG 3.43Å
166	L	84.4	Confident	83	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.8	173.4	-67.2	178	0	0	0	111.4	F128 F141 M146 L160 V161 W174 W175 S177	F128-L166 HydrophobicContact CE2-CD1 4.46Å; F128-L166 HydrophobicContact CE2-CD2 4.33Å; F128-L166 HydrophobicContact CZ-CD2 3.97Å; F141-L166 HydrophobicContact CD2-CD2 4.08Å; M146-L166 HydrophobicContact CE-CD1 4Å; L160-L166 HydrophobicContact CB-CD1 3.72Å; L160-L166 HydrophobicContact CB-CG 4.08Å; L160-L166 HydrophobicContact CD1-CD1 3.96Å; L160-L166 PolarHBondContact O-N 3.45Å; V161-L166 WeakPolarHBondContact CA-O 3.41Å; V161-L166 HydrophobicContact CG2-CB 3.9Å; L166-W174 HydrophobicContact CB-CB 4.28Å; L166-W174 HydrophobicContact CD1-CB 4.48Å; L166-W174 HydrophobicContact CD2-CB 4.31Å; L166-W175 WeakPolarHBondContact CA-O 3.36Å; L166-S177 VanDerWaalsContact C-OG 3.29Å; L166-S177 PolarHBondContact N-OG 3Å
167	T	84.1	Confident	83	Confident	59 Å²	59	49.9 Å²	49.9	36%	0.362	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141.2	169.9	46.2	0	0	0	0	110.8	R169 W174 W175 S177	T167-R169 PolarHBondContact O-N 3.14Å; T167-W174 CarbonylContact O-C 3.58Å; T167-W174 WeakPolarHBondContact O-CA 3.46Å; T167-W174 WeakPolarHBondContact O-CB 3.42Å; T167-W175 PolarHBondContact N-O 2.65Å; T167-W175 PolarHBondContact O-N 3.37Å; T167-S177 WeakPolarHBondContact CG2-OG 3.3Å; T167-S177 PolarHBondContact N-OG 3.04Å
168	V	83	Confident	83	Confident	98 Å²	98	49.9 Å²	49.9	59%	0.594	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	126.5	179.6	-177.5	0	0	0	0	109.4	V161	V161-V168 HydrophobicContact CG1-CG2 4.39Å
169	R	80.4	Confident	82.8	Confident	124 Å²	124	45.9 Å²	45.9	47%	0.468	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-62.9	171.5	-178.4	-167.1	171.2	161.6	-3.2	110.3	T167 S173 W175	T167-R169 PolarHBondContact O-N 3.14Å; R169-S173 WeakPolarHBondContact CB-O 3.06Å; R169-S173 PolarHBondContact N-O 2.95Å; R169-W175 HydrophobicContact CB-CG 4.25Å; R169-W175 VanDerWaalsContact CD-CE2 3.43Å; R169-W175 HydrophobicContact CG-CZ2 4.31Å; R169-W175 VanDerWaalsContact CZ-CZ2 3.49Å
170	D	79.1	Confident	82.4	Confident	93 Å²	93	47.4 Å²	47.4	50%	0.497	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	171.5	-175.1	-68.7	-55.5	0	0	0	109.1	G172 S173	D170-G172 PolarHBondContact O-N 2.98Å; D170-S173 PolarHBondContact N-O 3.12Å; D170-S173 PolarHBondContact O-N 3.37Å; D170-S173 VanDerWaalsContact O-O 3.06Å
171	A	76.8	Confident	82.2	Confident	111 Å²	111	48.6 Å²	48.6	92%	0.917	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	107.6	177.1	0	0	0	0	0	110.8
172	G	76.4	Confident	82	Confident	22 Å²	22	48.8 Å²	48.8	23%	0.227	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	22.8	-176.7	0	0	0	0	0	114.4	S142 K143 D170	S142-G172 CarbonylContact C-O 3.57Å; K143-G172 WeakPolarHBondContact CB-O 3.11Å; K143-G172 PolarHBondContact N-O 3.35Å; D170-G172 PolarHBondContact O-N 2.98Å
173	S	84.6	Confident	81.9	Confident	28 Å²	28	46.8 Å²	46.8	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.2	170.8	-64.4	0	0	0	0	111.1	F141 R169 D170	F141-S173 WeakPolarHBondContact O-CA 3.25Å; R169-S173 WeakPolarHBondContact CB-O 3.06Å; R169-S173 PolarHBondContact N-O 2.95Å; D170-S173 PolarHBondContact N-O 3.12Å; D170-S173 PolarHBondContact O-N 3.37Å; D170-S173 VanDerWaalsContact O-O 3.06Å
174	W	85.8	Confident	82.1	Confident	29 Å²	29	46.1 Å²	46.1	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.8	-177	-57	-88.8	0	0	0	111	S140 F141 K143 M146 I157 L166 T167	S140-W174 CarbonylContact C-O 3.55Å; S140-W174 WeakPolarHBondContact CA-O 3.39Å; F141-W174 PolarHBondContact N-O 3.25Å; F141-W174 PolarHBondContact O-N 3.1Å; K143-W174 HydrophobicContact CB-CH2 4.08Å; K143-W174 HydrophobicContact CB-CZ3 3.95Å; K143-W174 HydrophobicContact CG-CH2 4.26Å; K143-W174 HydrophobicContact CG-CZ3 4.47Å; M146-W174 HydrophobicContact CG-CE3 4.33Å; M146-W174 HydrophobicContact CG-CZ3 4.32Å; I157-W174 HydrophobicContact CD1-CH2 4.27Å; I157-W174 HydrophobicContact CD1-CZ3 4.4Å; I157-W174 HydrophobicContact CG2-CD2 4.18Å; I157-W174 HydrophobicContact CG2-CE3 4.39Å; I157-W174 HydrophobicContact CG2-CH2 3.91Å; I157-W174 HydrophobicContact CG2-CZ2 3.67Å; I157-W174 HydrophobicContact CG2-CZ3 4.25Å; L166-W174 HydrophobicContact CB-CB 4.28Å; L166-W174 HydrophobicContact CD1-CB 4.48Å; L166-W174 HydrophobicContact CD2-CB 4.31Å; T167-W174 CarbonylContact O-C 3.58Å; T167-W174 WeakPolarHBondContact O-CA 3.46Å; T167-W174 WeakPolarHBondContact O-CB 3.42Å
175	W	85.6	Confident	82.3	Confident	39 Å²	39	46 Å²	46	15%	0.148	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	148.1	167.7	-67.5	120.6	0	0	0	110.2	L139 L166 T167 R169	L139-W175 HydrophobicContact CB-CE3 4.26Å; L139-W175 HydrophobicContact CB-CZ3 3.93Å; L139-W175 HydrophobicContact CD1-CE3 4.48Å; L139-W175 HydrophobicContact CD2-CE3 3.97Å; L139-W175 HydrophobicContact CD2-CH2 4.1Å; L139-W175 HydrophobicContact CD2-CZ3 3.44Å; L139-W175 VanDerWaalsContact CD2-CZ3 3.44Å; L139-W175 HydrophobicContact CG-CE3 3.53Å; L139-W175 HydrophobicContact CG-CH2 4.48Å; L139-W175 HydrophobicContact CG-CZ3 3.4Å; L139-W175 VanDerWaalsContact O-CE3 3.31Å; L166-W175 WeakPolarHBondContact CA-O 3.36Å; T167-W175 PolarHBondContact N-O 2.65Å; T167-W175 PolarHBondContact O-N 3.37Å; R169-W175 HydrophobicContact CB-CG 4.25Å; R169-W175 VanDerWaalsContact CD-CE2 3.43Å; R169-W175 HydrophobicContact CG-CZ2 4.31Å; R169-W175 VanDerWaalsContact CZ-CZ2 3.49Å
176	L	84.8	Confident	82.4	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	130.9	162.4	-166	66.1	0	0	0	109.3	F91 F128 L139 F141 V165	F91-L176 HydrophobicContact CD1-CB 4.33Å; F91-L176 HydrophobicContact CD1-CD2 4.18Å; F91-L176 HydrophobicContact CD1-CG 3.97Å; F91-L176 HydrophobicContact CE1-CB 4.38Å; F91-L176 HydrophobicContact CE1-CD2 3.57Å; F91-L176 HydrophobicContact CE1-CG 3.53Å; F91-L176 HydrophobicContact CZ-CD2 3.9Å; F91-L176 HydrophobicContact CZ-CG 4.35Å; F128-L176 HydrophobicContact CE1-CD1 3.67Å; F128-L176 HydrophobicContact CZ-CD1 3.8Å; L139-L176 PolarHBondContact O-N 3.1Å; F141-L176 HydrophobicContact CE2-CB 4.06Å; F141-L176 HydrophobicContact CE2-CD1 4.21Å; V165-L176 HydrophobicContact CG1-CD1 4.4Å
177	S	84.3	Confident	82.4	Confident	7 Å²	7	56.4 Å²	56.4	5%	0.049	31%	0.313	C	S	.	.			trans	-133	153.1	-179.7	61.8	0	0	0	0	112.3	Y108 G164 V165 L166 T167	Y108-S177 PolarHBondContact OH-O 3.16Å; G164-S177 PolarHBondContact O-OG 3.44Å; V165-S177 CarbonylContact C-O 3.58Å; V165-S177 WeakPolarHBondContact CA-O 3.46Å; V165-S177 PolarHBondContact O-N 2.79Å; V165-S177 VanDerWaalsContact O-O 3.14Å; V165-S177 PolarHBondContact O-OG 3.43Å; L166-S177 VanDerWaalsContact C-OG 3.29Å; L166-S177 PolarHBondContact N-OG 3Å; T167-S177 WeakPolarHBondContact CG2-OG 3.3Å; T167-S177 PolarHBondContact N-OG 3.04Å
178	I	83.7	Confident	82.5	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	30%	0.296	C	S	.	.			trans	-86.4	125.1	174	-56.5	168.5	0	0	0	108.1	L56 P57 I59 F91 V103 Y108 G164 S181	L56-I178 HydrophobicContact CD2-CG2 3.83Å; P57-I178 HydrophobicContact CG-CD1 4.49Å; P57-I178 HydrophobicContact CG-CG2 4Å; I59-I178 HydrophobicContact CD1-CD1 3.55Å; I59-I178 HydrophobicContact CG1-CD1 3.68Å; F91-I178 HydrophobicContact CB-CD1 4.4Å; F91-I178 HydrophobicContact CB-CG1 4.42Å; F91-I178 HydrophobicContact CD1-CD1 4.31Å; F91-I178 HydrophobicContact CD1-CG1 3.55Å; F91-I178 HydrophobicContact CD2-CD1 3.89Å; F91-I178 HydrophobicContact CD2-CG1 3.95Å; F91-I178 HydrophobicContact CE1-CG1 3.6Å; F91-I178 HydrophobicContact CE2-CD1 4.23Å; F91-I178 HydrophobicContact CE2-CG1 4.06Å; F91-I178 HydrophobicContact CG-CD1 3.95Å; F91-I178 HydrophobicContact CG-CG1 3.71Å; F91-I178 HydrophobicContact CZ-CG1 3.89Å; V103-I178 HydrophobicContact CG2-CD1 3.65Å; Y108-I178 HydrophobicContact CD2-CG1 4.49Å; Y108-I178 HydrophobicContact CE2-CG1 4.23Å; G164-I178 CarbonylContact O-C 3.56Å; I178-S181 WeakPolarHBondContact O-CB 3.42Å; I178-S181 PolarHBondContact O-N 3.07Å; I178-S181 PolarHBondContact O-OG 3.4Å
179	P	80.3	Confident	82.7	Confident	11 Å²	11	51.6 Å²	51.6	7%	0.071	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	144.3	177.8	26	-34.6	0	0	0	110.3	L56 V112 S163 G164 S181	L56-P179 WeakPolarHBondContact CD2-O 3.3Å; V112-P179 HydrophobicContact CG2-CG 3.99Å; S163-P179 WeakPolarHBondContact O-CB 3.39Å; G164-P179 WeakPolarHBondContact O-CA 3.39Å; P179-S181 PolarHBondContact O-N 3.48Å; P179-S181 VanDerWaalsContact O-N 3.07Å
180	N	77.4	Confident	83	Confident	95 Å²	95	49.2 Å²	49.2	51%	0.508	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	10.6	-177.6	-59.4	-51	0	0	0	116.3	L56 G182	L56-N180 HydrophobicContact CD2-CB 4.22Å; N180-G182 PolarHBondContact O-N 2.64Å; N180-G182 VanDerWaalsContact O-N 3.14Å
181	S	80.6	Confident	83.4	Confident	25 Å²	25	44.8 Å²	44.8	18%	0.175	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-16.7	-180	55.2	0	0	0	0	114.6	I178 P179 K183 F184 T185	I178-S181 WeakPolarHBondContact O-CB 3.42Å; I178-S181 PolarHBondContact O-N 3.07Å; I178-S181 PolarHBondContact O-OG 3.4Å; P179-S181 PolarHBondContact O-N 3.48Å; P179-S181 VanDerWaalsContact O-N 3.07Å; S181-K183 VanDerWaalsContact C-N 3.28Å; S181-K183 PolarHBondContact O-N 3.39Å; S181-F184 WeakPolarHBondContact O-CA 3.42Å; S181-F184 VanDerWaalsContact O-CB 3.3Å; S181-F184 WeakPolarHBondContact O-CB 3.27Å; S181-F184 PolarHBondContact O-N 2.95Å; S181-T185 PolarHBondContact O-N 2.88Å; S181-T185 PolarHBondContact O-OG1 3.43Å
182	G	80.5	Confident	83.9	Confident	52 Å²	52	40.9 Å²	40.9	54%	0.536	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-36	178.8	0	0	0	0	0	114.1	N180 T185 K186	N180-G182 PolarHBondContact O-N 2.64Å; N180-G182 VanDerWaalsContact O-N 3.14Å; G182-T185 PolarHBondContact O-N 3.43Å; G182-K186 WeakPolarHBondContact O-CB 3.25Å; G182-K186 PolarHBondContact O-N 3.06Å
183	K	82.6	Confident	84.4	Confident	140 Å²	140	47 Å²	47	61%	0.609	23%	0.234	S	C	*	.	H	α-helix	trans	-65.5	-41.2	174.5	-71	-179.5	-177.3	172.5	0	111.3	F52 S181 Y187	F52-K183 HydrophobicContact CE1-CB 4.38Å; S181-K183 VanDerWaalsContact C-N 3.28Å; S181-K183 PolarHBondContact O-N 3.39Å; K183-Y187 PolarHBondContact O-N 3.43Å; K183-Y187 VanDerWaalsContact O-N 3.1Å
184	F	85.1	Confident	84.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.3	-54.3	174.8	164.5	-92.1	0	0	0	110.5	F47 F52 L56 I59 L93 S181 K186 Y187 F188 F223	F47-F184 HydrophobicContact CD2-CE2 4.36Å; F47-F184 AromaticContact CE2-CD2 3.71Å; F47-F184 HydrophobicContact CE2-CD2 3.71Å; F47-F184 AromaticContact CE2-CE2 3.54Å; F47-F184 HydrophobicContact CE2-CE2 3.54Å; F47-F184 HydrophobicContact CZ-CD2 4.12Å; F47-F184 HydrophobicContact CZ-CE2 4.39Å; F52-F184 HydrophobicContact CE1-CB 3.96Å; F52-F184 HydrophobicContact CE2-CD2 4.16Å; F52-F184 HydrophobicContact CZ-CB 3.86Å; F52-F184 AromaticContact CZ-CD2 3.97Å; F52-F184 HydrophobicContact CZ-CD2 3.97Å; F52-F184 HydrophobicContact CZ-CG 4.43Å; L56-F184 HydrophobicContact CD1-CB 3.66Å; I59-F184 HydrophobicContact CB-CE2 4.46Å; I59-F184 HydrophobicContact CB-CZ 4.17Å; I59-F184 HydrophobicContact CD1-CD1 3.88Å; I59-F184 HydrophobicContact CD1-CD2 4.33Å; I59-F184 HydrophobicContact CD1-CE1 4.04Å; I59-F184 HydrophobicContact CD1-CE2 4.49Å; I59-F184 HydrophobicContact CD1-CG 4.05Å; I59-F184 HydrophobicContact CD1-CZ 4.34Å; I59-F184 HydrophobicContact CG2-CE1 4.25Å; I59-F184 HydrophobicContact CG2-CZ 4.15Å; L93-F184 HydrophobicContact CD1-CE1 4.15Å; L93-F184 HydrophobicContact CD2-CE1 4.36Å; S181-F184 WeakPolarHBondContact O-CA 3.42Å; S181-F184 VanDerWaalsContact O-CB 3.3Å; S181-F184 WeakPolarHBondContact O-CB 3.27Å; S181-F184 PolarHBondContact O-N 2.95Å; F184-K186 VanDerWaalsContact C-N 3.29Å; F184-K186 PolarHBondContact O-N 3.43Å; F184-Y187 PolarHBondContact O-N 2.96Å; F184-F188 HydrophobicContact CE1-CB 4.49Å; F184-F188 HydrophobicContact CZ-CB 4.37Å; F184-F188 HydrophobicContact CZ-CD2 4.33Å; F184-F188 HydrophobicContact CZ-CG 4.31Å; F184-F188 WeakPolarHBondContact O-CB 3.41Å; F184-F188 PolarHBondContact O-N 2.94Å; F184-F223 AromaticContact CD2-CE1 3.68Å; F184-F223 HydrophobicContact CD2-CE1 3.68Å; F184-F223 AromaticContact CD2-CZ 3.45Å; F184-F223 HydrophobicContact CD2-CZ 3.45Å; F184-F223 VanDerWaalsContact CD2-CZ 3.45Å; F184-F223 AromaticContact CE2-CE1 3.57Å; F184-F223 HydrophobicContact CE2-CE1 3.57Å; F184-F223 AromaticContact CE2-CZ 3.62Å; F184-F223 HydrophobicContact CE2-CZ 3.62Å; F184-F223 HydrophobicContact CG-CZ 4.43Å
185	T	84.4	Confident	84.6	Confident	22 Å²	22	45.6 Å²	45.6	14%	0.135	23%	0.23	C	C	.	.	H	α-helix	trans	-55.8	-43.5	180	-60.5	0	0	0	0	111.8	F95 S181 G182 F188 I189	F95-T185 HydrophobicContact CB-CG2 4.05Å; F95-T185 HydrophobicContact CD1-CG2 3.67Å; F95-T185 HydrophobicContact CG-CG2 4.27Å; S181-T185 PolarHBondContact O-N 2.88Å; S181-T185 PolarHBondContact O-OG1 3.43Å; G182-T185 PolarHBondContact O-N 3.43Å; T185-F188 PolarHBondContact O-N 3.32Å; T185-I189 HydrophobicContact CG2-CD1 3.63Å; T185-I189 HydrophobicContact CG2-CG1 4.33Å; T185-I189 WeakPolarHBondContact O-CB 3.5Å; T185-I189 WeakPolarHBondContact O-CD1 3.42Å; T185-I189 WeakPolarHBondContact O-CG1 3.27Å; T185-I189 PolarHBondContact O-N 3.36Å
186	K	85.5	Confident	84.7	Confident	142 Å²	142	45 Å²	45	62%	0.617	23%	0.229	S	C	*	.	H	α-helix	trans	-60.2	-53.7	177.2	-177.9	179.4	179.1	178	0	112.5	G182 F184 F188 Q190	G182-K186 WeakPolarHBondContact O-CB 3.25Å; G182-K186 PolarHBondContact O-N 3.06Å; F184-K186 VanDerWaalsContact C-N 3.29Å; F184-K186 PolarHBondContact O-N 3.43Å; K186-F188 VanDerWaalsContact C-N 3.25Å; K186-F188 PolarHBondContact O-N 3.09Å; K186-Q190 WeakPolarHBondContact O-CB 3.4Å; K186-Q190 PolarHBondContact O-N 3.25Å; K186-Q190 VanDerWaalsContact O-N 3.08Å
187	Y	85.4	Confident	84.8	Confident	78 Å²	78	46 Å²	46	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-34.6	-179.6	-67.5	-22.2	0	0	0	111.9	F52 K183 F184 G191 K222	F52-Y187 HydrophobicContact CE1-CD2 4.06Å; F52-Y187 HydrophobicContact CE1-CE2 4.45Å; F52-Y187 HydrophobicContact CZ-CD2 4.24Å; K183-Y187 PolarHBondContact O-N 3.43Å; K183-Y187 VanDerWaalsContact O-N 3.1Å; F184-Y187 PolarHBondContact O-N 2.96Å; Y187-G191 PolarHBondContact O-N 3.13Å; Y187-K222 HydrophobicContact CD1-CG 4.4Å; Y187-K222 HydrophobicContact CD2-CG 4.41Å; Y187-K222 HydrophobicContact CG-CB 4.5Å; Y187-K222 HydrophobicContact CG-CG 4.22Å
188	F	85.6	Confident	84.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-49.1	-179.1	178.3	-101.1	0	0	0	111.3	L61 F95 F184 T185 K186 Q190 G191 R192 F223 Y227 H228 D231	L61-F188 HydrophobicContact CD1-CE1 3.68Å; L61-F188 HydrophobicContact CD1-CE2 3.67Å; L61-F188 HydrophobicContact CD1-CZ 3.09Å; F95-F188 HydrophobicContact CE1-CD1 4.14Å; F95-F188 HydrophobicContact CE1-CE1 4.24Å; F95-F188 HydrophobicContact CE2-CD1 4.42Å; F95-F188 AromaticContact CE2-CE1 3.93Å; F95-F188 HydrophobicContact CE2-CE1 3.93Å; F95-F188 AromaticContact CZ-CD1 3.92Å; F95-F188 HydrophobicContact CZ-CD1 3.92Å; F95-F188 AromaticContact CZ-CE1 3.56Å; F95-F188 HydrophobicContact CZ-CE1 3.56Å; F184-F188 HydrophobicContact CE1-CB 4.49Å; F184-F188 HydrophobicContact CZ-CB 4.37Å; F184-F188 HydrophobicContact CZ-CD2 4.33Å; F184-F188 HydrophobicContact CZ-CG 4.31Å; F184-F188 WeakPolarHBondContact O-CB 3.41Å; F184-F188 PolarHBondContact O-N 2.94Å; T185-F188 PolarHBondContact O-N 3.32Å; K186-F188 VanDerWaalsContact C-N 3.25Å; K186-F188 PolarHBondContact O-N 3.09Å; F188-Q190 VanDerWaalsContact C-N 3.33Å; F188-Q190 PolarHBondContact O-N 3.23Å; F188-G191 PolarHBondContact O-N 2.72Å; F188-R192 VanDerWaalsContact CE1-NH2 3.34Å; F188-R192 WeakPolarHBondContact O-CB 3.22Å; F188-R192 PolarHBondContact O-N 3.5Å; F188-F223 HydrophobicContact CB-CE2 4.03Å; F188-F223 HydrophobicContact CB-CZ 4.31Å; F188-Y227 HydrophobicContact CD2-CD1 4.46Å; F188-Y227 AromaticContact CD2-CE1 3.84Å; F188-Y227 HydrophobicContact CD2-CE1 3.84Å; F188-Y227 HydrophobicContact CE2-CD1 4.19Å; F188-Y227 AromaticContact CE2-CE1 3.61Å; F188-Y227 HydrophobicContact CE2-CE1 3.61Å; F188-H228 AromaticContact CD2-CE1 3.94Å; F188-D231 HydrophobicContact CE2-CB 4.3Å; F188-D231 HydrophobicContact CZ-CB 4.17Å; F188-D231 VanDerWaalsContact CZ-OD1 3.27Å; F188-D231 WeakPolarHBondContact CZ-OD1 3.4Å; F188-D231 VanDerWaalsContact CZ-OD2 3.28Å; F188-D231 WeakPolarHBondContact CZ-OD2 3.24Å
189	I	86.9	Confident	85	Confident	55 Å²	55	47.5 Å²	47.5	28%	0.282	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-43.1	175.8	-66.1	165.5	0	0	0	110.9	F95 T185 G191 R192 K193	F95-I189 HydrophobicContact CB-CD1 3.64Å; F95-I189 HydrophobicContact CB-CG1 4.17Å; F95-I189 HydrophobicContact CG-CD1 4.28Å; F95-I189 HydrophobicContact CG-CG1 4.33Å; T185-I189 HydrophobicContact CG2-CD1 3.63Å; T185-I189 HydrophobicContact CG2-CG1 4.33Å; T185-I189 WeakPolarHBondContact O-CB 3.5Å; T185-I189 WeakPolarHBondContact O-CD1 3.42Å; T185-I189 WeakPolarHBondContact O-CG1 3.27Å; T185-I189 PolarHBondContact O-N 3.36Å; I189-G191 VanDerWaalsContact C-N 3.35Å; I189-R192 PolarHBondContact O-N 3.47Å; I189-K193 HydrophobicContact CG2-CD 4.21Å; I189-K193 WeakPolarHBondContact O-CB 3.33Å; I189-K193 WeakPolarHBondContact O-CG 3.36Å; I189-K193 PolarHBondContact O-N 3.27Å
190	Q	87.4	Confident	85.3	Confident	74 Å²	74	52.5 Å²	52.5	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-42.9	178.3	-175	173.1	6.7	0	0	111.5	K186 F188 A194 H220	K186-Q190 WeakPolarHBondContact O-CB 3.4Å; K186-Q190 PolarHBondContact O-N 3.25Å; K186-Q190 VanDerWaalsContact O-N 3.08Å; F188-Q190 VanDerWaalsContact C-N 3.33Å; F188-Q190 PolarHBondContact O-N 3.23Å; Q190-A194 WeakPolarHBondContact O-CB 3.39Å; Q190-A194 PolarHBondContact O-N 3.03Å; Q190-H220 HydrophobicContact CG-CB 4.32Å; Q190-H220 PolarHBondContact NE2-ND1 2.63Å
191	G	86.7	Confident	85.7	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-49.1	176	0	0	0	0	0	112.5	Y187 F188 I189 K193 A194 V195	Y187-G191 PolarHBondContact O-N 3.13Å; F188-G191 PolarHBondContact O-N 2.72Å; I189-G191 VanDerWaalsContact C-N 3.35Å; G191-K193 VanDerWaalsContact C-N 3.35Å; G191-K193 PolarHBondContact O-N 3.29Å; G191-A194 PolarHBondContact O-N 3.27Å; G191-A194 VanDerWaalsContact O-N 3.12Å; G191-V195 WeakPolarHBondContact O-CG2 3.49Å; G191-V195 PolarHBondContact O-N 3.31Å
192	R	87.5	Confident	86	Confident	30 Å²	30	57 Å²	57	11%	0.113	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-48.7	176.7	-176.3	-170.9	-75.6	-173.9	-6	111.2	F188 I189 A194 V195 L196 H228 D231 I232 L237	F188-R192 VanDerWaalsContact CE1-NH2 3.34Å; F188-R192 WeakPolarHBondContact O-CB 3.22Å; F188-R192 PolarHBondContact O-N 3.5Å; I189-R192 PolarHBondContact O-N 3.47Å; R192-A194 VanDerWaalsContact C-N 3.34Å; R192-A194 PolarHBondContact O-N 3.48Å; R192-V195 PolarHBondContact O-N 3.18Å; R192-L196 HydrophobicContact CG-CD1 3.88Å; R192-L196 HydrophobicContact CG-CG 4.46Å; R192-L196 WeakPolarHBondContact O-CB 3.48Å; R192-L196 WeakPolarHBondContact O-CG 3.4Å; R192-L196 PolarHBondContact O-N 3.48Å; R192-H228 PolarHBondContact N-CE1 3.1Å; R192-D231 WeakPolarHBondContact CG-OD2 3.4Å; R192-D231 IonicContact CZ-OD1 2.76Å; R192-D231 IonicContact CZ-OD2 2.72Å; R192-D231 IonicContact NE-OD1 3.36Å; R192-D231 PolarHBondContact NE-OD1 3.04Å; R192-D231 IonicContact NE-OD2 3.83Å; R192-D231 PolarHBondContact NE-OD2 3.27Å; R192-D231 IonicContact NH2-OD1 3.57Å; R192-D231 PolarHBondContact NH2-OD1 2.96Å; R192-D231 IonicContact NH2-OD2 3.53Å; R192-I232 HydrophobicContact CG-CG2 4.26Å; R192-L237 HydrophobicContact CG-CD1 4.4Å
193	K	87.8	Confident	86.2	Confident	150 Å²	150	62 Å²	62	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-60.6	-41.4	177.4	-74.8	-179.3	179.5	-177	0	112.6	I189 G191 G197	I189-K193 HydrophobicContact CG2-CD 4.21Å; I189-K193 WeakPolarHBondContact O-CB 3.33Å; I189-K193 WeakPolarHBondContact O-CG 3.36Å; I189-K193 PolarHBondContact O-N 3.27Å; G191-K193 VanDerWaalsContact C-N 3.35Å; G191-K193 PolarHBondContact O-N 3.29Å; K193-G197 PolarHBondContact O-N 2.82Å
194	A	88.1	Confident	86.2	Confident	28 Å²	28	63.4 Å²	63.4	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-44	178.9	0	0	0	0	0	111.9	Q190 G191 R192 G197 M198 V221	Q190-A194 WeakPolarHBondContact O-CB 3.39Å; Q190-A194 PolarHBondContact O-N 3.03Å; G191-A194 PolarHBondContact O-N 3.27Å; G191-A194 VanDerWaalsContact O-N 3.12Å; R192-A194 VanDerWaalsContact C-N 3.34Å; R192-A194 PolarHBondContact O-N 3.48Å; A194-G197 PolarHBondContact O-N 3.49Å; A194-M198 WeakPolarHBondContact O-CG 3Å; A194-M198 PolarHBondContact O-N 2.6Å; A194-V221 HydrophobicContact CB-CG2 3.65Å
195	V	87	Confident	86.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.6	-46.1	178.5	176.5	0	0	0	0	111	G191 R192 G197 M198 V199 L212 V221 M225 H228 I232	G191-V195 WeakPolarHBondContact O-CG2 3.49Å; G191-V195 PolarHBondContact O-N 3.31Å; R192-V195 PolarHBondContact O-N 3.18Å; V195-G197 VanDerWaalsContact C-N 3.27Å; V195-G197 PolarHBondContact O-N 3.38Å; V195-M198 WeakPolarHBondContact O-CB 3.36Å; V195-M198 PolarHBondContact O-N 2.78Å; V195-V199 PolarHBondContact O-N 3.4Å; V195-V199 VanDerWaalsContact O-N 3.12Å; V195-L212 HydrophobicContact CG1-CD1 4.43Å; V195-L212 HydrophobicContact CG1-CD2 4.09Å; V195-V221 HydrophobicContact CG2-CG1 4.27Å; V195-V221 HydrophobicContact CG2-CG2 4.2Å; V195-M225 HydrophobicContact CG2-CE 4.28Å; V195-M225 HydrophobicContact CG2-SD 4.02Å; V195-H228 HydrophobicContact CB-CB 4.4Å; V195-H228 HydrophobicContact CG1-CB 4.42Å; V195-H228 HydrophobicContact CG2-CB 3.87Å; V195-I232 HydrophobicContact CG1-CD1 3.94Å
196	L	86.9	Confident	86.4	Confident	26 Å²	26	66.6 Å²	66.6	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-40	173.1	-72.5	171	0	0	0	111.9	R192 M198 V199 K200 I232 L237 V238 F251	R192-L196 HydrophobicContact CG-CD1 3.88Å; R192-L196 HydrophobicContact CG-CG 4.46Å; R192-L196 WeakPolarHBondContact O-CB 3.48Å; R192-L196 WeakPolarHBondContact O-CG 3.4Å; R192-L196 PolarHBondContact O-N 3.48Å; L196-M198 VanDerWaalsContact C-N 3.27Å; L196-M198 PolarHBondContact O-N 2.96Å; L196-V199 PolarHBondContact O-N 3.16Å; L196-K200 WeakPolarHBondContact O-CB 3.21Å; L196-K200 PolarHBondContact O-N 3.45Å; L196-I232 HydrophobicContact CD1-CG2 4.45Å; L196-I232 HydrophobicContact CD2-CB 4.02Å; L196-I232 HydrophobicContact CD2-CG2 3.67Å; L196-I232 HydrophobicContact CG-CG2 3.83Å; L196-L237 HydrophobicContact CD1-CB 4.44Å; L196-L237 HydrophobicContact CD1-CD1 3.77Å; L196-L237 HydrophobicContact CD2-CB 3.87Å; L196-V238 HydrophobicContact CD2-CG1 4.03Å; L196-F251 HydrophobicContact CB-CE2 4.38Å; L196-F251 HydrophobicContact CD2-CD2 4.39Å; L196-F251 HydrophobicContact CD2-CE2 4.21Å
197	G	86.2	Confident	86.5	Confident	26 Å²	26	60.4 Å²	60.4	27%	0.268	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-33.1	173.6	0	0	0	0	0	113.3	K193 A194 V195 K201	K193-G197 PolarHBondContact O-N 2.82Å; A194-G197 PolarHBondContact O-N 3.49Å; V195-G197 VanDerWaalsContact C-N 3.27Å; V195-G197 PolarHBondContact O-N 3.38Å; G197-K201 WeakPolarHBondContact O-CB 3.45Å; G197-K201 VanDerWaalsContact O-CG 3.23Å; G197-K201 WeakPolarHBondContact O-CG 3.39Å; G197-K201 PolarHBondContact O-N 2.96Å; G197-K201 VanDerWaalsContact O-N 3.1Å
198	M	86.3	Confident	86.6	Confident	44 Å²	44	58.9 Å²	58.9	22%	0.217	28%	0.282	C	S	.	.	H	α-helix	trans	-68.8	-39.5	174.2	-72	176.2	144.2	0	0	112.4	A194 V195 L196 S202 T218	A194-M198 WeakPolarHBondContact O-CG 3Å; A194-M198 PolarHBondContact O-N 2.6Å; V195-M198 WeakPolarHBondContact O-CB 3.36Å; V195-M198 PolarHBondContact O-N 2.78Å; L196-M198 VanDerWaalsContact C-N 3.27Å; L196-M198 PolarHBondContact O-N 2.96Å; M198-S202 PolarHBondContact O-N 3.09Å; M198-T218 HydrophobicContact CE-CG2 3.77Å
199	V	86.1	Confident	86.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-47.8	174.9	-176.4	0	0	0	0	109.8	V195 L196 K201 S202 S205 V207 L212 I232 V238 F251	V195-V199 PolarHBondContact O-N 3.4Å; V195-V199 VanDerWaalsContact O-N 3.12Å; L196-V199 PolarHBondContact O-N 3.16Å; V199-K201 VanDerWaalsContact C-N 3.27Å; V199-K201 PolarHBondContact O-N 3.17Å; V199-S202 WeakPolarHBondContact O-CB 2.87Å; V199-S202 PolarHBondContact O-N 3.44Å; V199-S202 VanDerWaalsContact O-N 3.1Å; V199-S202 PolarHBondContact O-OG 3.46Å; V199-S205 CarbonylContact O-C 3.49Å; V199-S205 WeakPolarHBondContact O-CA 3.34Å; V199-V207 HydrophobicContact CB-CG1 4.45Å; V199-V207 HydrophobicContact CG1-CG1 4.22Å; V199-V207 HydrophobicContact CG2-CG1 3.88Å; V199-L212 HydrophobicContact CG2-CD2 3.96Å; V199-I232 HydrophobicContact CG2-CD1 4.49Å; V199-V238 HydrophobicContact CG1-CG1 4.42Å; V199-F251 HydrophobicContact CG1-CB 4.17Å
200	K	87	Confident	86.4	Confident	116 Å²	116	62.7 Å²	62.7	50%	0.504	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-30.3	-179.3	-174	166.6	-175.7	155	0	113.9	L196 F251	L196-K200 WeakPolarHBondContact O-CB 3.21Å; L196-K200 PolarHBondContact O-N 3.45Å; K200-F251 HydrophobicContact CB-CD2 4.27Å; K200-F251 HydrophobicContact CB-CG 4.43Å; K200-F251 HydrophobicContact CD-CE1 4.26Å; K200-F251 HydrophobicContact CD-CZ 4.29Å
201	K	87.1	Confident	86.3	Confident	190 Å²	190	62.9 Å²	62.9	83%	0.826	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-5.8	178.4	-71	177.1	-178.3	-176.4	0	113.6	G197 V199	G197-K201 WeakPolarHBondContact O-CB 3.45Å; G197-K201 VanDerWaalsContact O-CG 3.23Å; G197-K201 WeakPolarHBondContact O-CG 3.39Å; G197-K201 PolarHBondContact O-N 2.96Å; G197-K201 VanDerWaalsContact O-N 3.1Å; V199-K201 VanDerWaalsContact C-N 3.27Å; V199-K201 PolarHBondContact O-N 3.17Å
202	S	85.5	Confident	86.2	Confident	24 Å²	24	62.9 Å²	62.9	17%	0.168	30%	0.304	C	S	.	.	S	Bend	trans	-74.8	168	177.9	73.1	0	0	0	0	111	M198 V199 Y204 S205 E206	M198-S202 PolarHBondContact O-N 3.09Å; V199-S202 WeakPolarHBondContact O-CB 2.87Å; V199-S202 PolarHBondContact O-N 3.44Å; V199-S202 VanDerWaalsContact O-N 3.1Å; V199-S202 PolarHBondContact O-OG 3.46Å; S202-Y204 PolarHBondContact O-N 2.86Å; S202-S205 PolarHBondContact O-N 3.22Å; S202-S205 VanDerWaalsContact O-N 3.1Å; S202-E206 WeakPolarHBondContact CB-O 3.29Å; S202-E206 PolarHBondContact OG-N 3.38Å; S202-E206 PolarHBondContact OG-O 2.9Å
203	K	84.1	Confident	86	Confident	156 Å²	156	63.7 Å²	63.7	68%	0.678	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-61.8	126.5	176.9	-159.8	-172.6	-177.5	-173	0	108.7	S205 E206	K203-S205 PolarHBondContact O-N 3.22Å; K203-E206 PolarHBondContact O-N 2.96Å
204	Y	83.7	Confident	85.7	Confident	170 Å²	170	63.3 Å²	63.3	67%	0.667	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	61.6	15.8	-176.3	-49.1	-68.9	0	0	0	115.5	S202 E206	S202-Y204 PolarHBondContact O-N 2.86Å; Y204-E206 WeakPolarHBondContact O-CG 3.2Å; Y204-E206 PolarHBondContact O-N 3.05Å
205	S	86.2	Confident	85.2	Confident	38 Å²	38	67 Å²	67	27%	0.266	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	58.6	31.2	-173	-52.9	0	0	0	0	113.1	V199 S202 K203 R250 F251	V199-S205 CarbonylContact O-C 3.49Å; V199-S205 WeakPolarHBondContact O-CA 3.34Å; S202-S205 PolarHBondContact O-N 3.22Å; S202-S205 VanDerWaalsContact O-N 3.1Å; K203-S205 PolarHBondContact O-N 3.22Å; S205-R250 WeakPolarHBondContact O-CA 3.43Å; S205-F251 PolarHBondContact O-N 3.15Å
206	E	87	Confident	84.2	Confident	51 Å²	51	78 Å²	78	24%	0.238	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.3	-175.7	-70.8	174	-178.4	0	0	111.4	S202 K203 Y204 L248 L249 R250	S202-E206 WeakPolarHBondContact CB-O 3.29Å; S202-E206 PolarHBondContact OG-N 3.38Å; S202-E206 PolarHBondContact OG-O 2.9Å; K203-E206 PolarHBondContact O-N 2.96Å; Y204-E206 WeakPolarHBondContact O-CG 3.2Å; Y204-E206 PolarHBondContact O-N 3.05Å; E206-L248 HydrophobicContact CB-CD1 4.39Å; E206-L248 HydrophobicContact CB-CD2 3.87Å; E206-L248 HydrophobicContact CB-CG 4.33Å; E206-L248 HydrophobicContact CG-CD2 3.75Å; E206-L249 CarbonylContact C-O 3.57Å; E206-L249 WeakPolarHBondContact CA-O 3.4Å; E206-R250 HydrophobicContact CG-CB 4.01Å; E206-R250 HydrophobicContact CG-CG 3.93Å; E206-R250 IonicContact OE1-CZ 2.76Å; E206-R250 IonicContact OE1-NE 3.43Å; E206-R250 PolarHBondContact OE1-NE 3.1Å; E206-R250 IonicContact OE1-NH2 3.56Å; E206-R250 PolarHBondContact OE1-NH2 3.48Å
207	V	88.4	Confident	83.2	Confident	12 Å²	12	80.5 Å²	80.5	7%	0.073	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	139.4	174.8	70.3	0	0	0	0	110.9	V199 R209 N211 L212 L249	V199-V207 HydrophobicContact CB-CG1 4.45Å; V199-V207 HydrophobicContact CG1-CG1 4.22Å; V199-V207 HydrophobicContact CG2-CG1 3.88Å; V207-R209 PolarHBondContact O-N 2.96Å; V207-N211 HydrophobicContact CG2-CB 4.4Å; V207-L212 HydrophobicContact CG1-CB 4.18Å; V207-L212 HydrophobicContact CG1-CD1 4.47Å; V207-L212 HydrophobicContact CG1-CD2 4.02Å; V207-L212 HydrophobicContact CG1-CG 4.47Å; V207-L212 HydrophobicContact CG2-CB 4.37Å; V207-L249 HydrophobicContact CG1-CB 4.29Å; V207-L249 PolarHBondContact N-O 2.98Å; V207-L249 PolarHBondContact O-N 2.95Å
208	L	86.8	Confident	82.3	Confident	47 Å²	47	81.8 Å²	81.8	25%	0.246	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	136.1	170.6	-72.4	170.5	0	0	0	110	V210 N211 L212 L248	L208-V210 VanDerWaalsContact C-N 3.29Å; L208-V210 PolarHBondContact O-N 3.47Å; L208-N211 HydrophobicContact CB-CB 4.17Å; L208-N211 WeakPolarHBondContact O-CB 3.3Å; L208-N211 PolarHBondContact O-N 2.88Å; L208-N211 VanDerWaalsContact O-N 3.15Å; L208-L212 PolarHBondContact O-N 3.33Å; L208-L248 HydrophobicContact CD2-CB 4.3Å
209	R	84.8	Confident	81.3	Confident	58 Å²	58	83.9 Å²	83.9	22%	0.219	40%	0.397	C	S	.	.	H	α-helix	trans	-53.6	-46.9	178.9	179	175.4	172.5	170.8	0	111.7	V207 N211 L212 E213 V229 H230 T247 L249	V207-R209 PolarHBondContact O-N 2.96Å; R209-N211 PolarHBondContact O-N 2.82Å; R209-L212 PolarHBondContact O-N 3.27Å; R209-L212 VanDerWaalsContact O-N 3.1Å; R209-E213 HydrophobicContact CG-CG 4.46Å; R209-E213 WeakPolarHBondContact CG-OE1 3.4Å; R209-E213 IonicContact CZ-OE1 2.7Å; R209-E213 IonicContact NE-OE1 3.43Å; R209-E213 PolarHBondContact NE-OE1 2.76Å; R209-E213 IonicContact NH2-OE1 3.27Å; R209-E213 WeakPolarHBondContact O-CG 3.48Å; R209-E213 PolarHBondContact O-N 3.46Å; R209-V229 HydrophobicContact CG-CG1 3.93Å; R209-H230 PolarHBondContact NH2-CE1 2.97Å; R209-H230 VanDerWaalsContact NH2-CE1 3.27Å; R209-T247 WeakPolarHBondContact CB-O 3.35Å; R209-T247 PolarHBondContact N-O 3.43Å; R209-L249 HydrophobicContact CB-CD1 4.2Å; R209-L249 HydrophobicContact CB-CG 4.23Å; R209-L249 HydrophobicContact CG-CD1 4.42Å
210	V	84.6	Confident	80.4	Confident	77 Å²	77	88.7 Å²	88.7	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-58.5	-47.3	178.8	-177.5	0	0	0	0	111	L208 L212 E213 E214	L208-V210 VanDerWaalsContact C-N 3.29Å; L208-V210 PolarHBondContact O-N 3.47Å; V210-L212 VanDerWaalsContact C-N 3.25Å; V210-L212 PolarHBondContact O-N 2.98Å; V210-E213 PolarHBondContact O-N 2.92Å; V210-E213 VanDerWaalsContact O-N 3.17Å; V210-E214 HydrophobicContact CG1-CG 4.43Å; V210-E214 WeakPolarHBondContact O-CG 3.36Å; V210-E214 PolarHBondContact O-N 3.32Å
211	N	84.8	Confident	79.9	Confident	78 Å²	78	83.3 Å²	83.3	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-63.3	-31.2	178	-67.9	-8.5	0	0	0	112.7	V207 L208 R209 R215	V207-N211 HydrophobicContact CG2-CB 4.4Å; L208-N211 HydrophobicContact CB-CB 4.17Å; L208-N211 WeakPolarHBondContact O-CB 3.3Å; L208-N211 PolarHBondContact O-N 2.88Å; L208-N211 VanDerWaalsContact O-N 3.15Å; R209-N211 PolarHBondContact O-N 2.82Å; N211-R215 WeakPolarHBondContact O-CG 3.33Å
212	L	84	Confident	79.4	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-76	-37.4	177	-171.7	61.7	0	0	0	111.4	V195 V199 V207 L208 R209 V210 R215 V229 I232 L249	V195-L212 HydrophobicContact CG1-CD1 4.43Å; V195-L212 HydrophobicContact CG1-CD2 4.09Å; V199-L212 HydrophobicContact CG2-CD2 3.96Å; V207-L212 HydrophobicContact CG1-CB 4.18Å; V207-L212 HydrophobicContact CG1-CD1 4.47Å; V207-L212 HydrophobicContact CG1-CD2 4.02Å; V207-L212 HydrophobicContact CG1-CG 4.47Å; V207-L212 HydrophobicContact CG2-CB 4.37Å; L208-L212 PolarHBondContact O-N 3.33Å; R209-L212 PolarHBondContact O-N 3.27Å; R209-L212 VanDerWaalsContact O-N 3.1Å; V210-L212 VanDerWaalsContact C-N 3.25Å; V210-L212 PolarHBondContact O-N 2.98Å; L212-R215 PolarHBondContact O-N 3.22Å; L212-V229 HydrophobicContact CD2-CG2 3.93Å; L212-V229 HydrophobicContact CG-CG2 4.16Å; L212-I232 HydrophobicContact CD2-CD1 4.15Å; L212-L249 HydrophobicContact CD2-CD1 3.99Å
213	E	83.5	Confident	79.1	Confident	46 Å²	46	77.8 Å²	77.8	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-69.1	-33.1	176.5	-70.5	-178.2	-167.2	0	0	112.8	R209 V210 R215 K226 V229	R209-E213 HydrophobicContact CG-CG 4.46Å; R209-E213 WeakPolarHBondContact CG-OE1 3.4Å; R209-E213 IonicContact CZ-OE1 2.7Å; R209-E213 IonicContact NE-OE1 3.43Å; R209-E213 PolarHBondContact NE-OE1 2.76Å; R209-E213 IonicContact NH2-OE1 3.27Å; R209-E213 WeakPolarHBondContact O-CG 3.48Å; R209-E213 PolarHBondContact O-N 3.46Å; V210-E213 PolarHBondContact O-N 2.92Å; V210-E213 VanDerWaalsContact O-N 3.17Å; E213-R215 VanDerWaalsContact C-N 3.34Å; E213-K226 HydrophobicContact CB-CG 4.38Å; E213-K226 HydrophobicContact CG-CG 4.05Å; E213-K226 VanDerWaalsContact OE2-CE 3.3Å; E213-K226 WeakPolarHBondContact OE2-CE 3.43Å; E213-V229 HydrophobicContact CG-CB 4.46Å; E213-V229 HydrophobicContact CG-CG2 3.95Å
214	E	81.8	Confident	79	Confident	143 Å²	143	72.7 Å²	72.7	67%	0.668	35%	0.352	S	S	*	.	S	Bend	trans	-78.1	-15.5	178	-72.5	178.9	176.5	0	0	114	V210 R216	V210-E214 HydrophobicContact CG1-CG 4.43Å; V210-E214 WeakPolarHBondContact O-CG 3.36Å; V210-E214 PolarHBondContact O-N 3.32Å; E214-R216 PolarHBondContact O-N 2.77Å
215	R	77	Confident	79	Confident	104 Å²	104	65.1 Å²	65.1	39%	0.392	32%	0.323	S	S	.	.	S	Bend	trans	-64.6	137.3	178.2	-83.5	172.9	-173.8	-154.9	2.7	110.7	N211 L212 E213 T217 M225	N211-R215 WeakPolarHBondContact O-CG 3.33Å; L212-R215 PolarHBondContact O-N 3.22Å; E213-R215 VanDerWaalsContact C-N 3.34Å; R215-T217 PolarHBondContact O-N 2.88Å; R215-M225 WeakPolarHBondContact O-CG 3.49Å
216	R	65.6	Low	78.9	Confident	232 Å²	232	68.2 Å²	68.2	88%	0.875	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-61.6	134.4	174.3	-70.4	-173.9	178.6	-171.9	-0.2	110.4	E214 T218	E214-R216 PolarHBondContact O-N 2.77Å; R216-T218 PolarHBondContact O-N 2.64Å
217	T	67.3	Low	78.8	Confident	78 Å²	78	65.8 Å²	65.8	48%	0.479	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-56.2	122	170.2	41.1	0	0	0	0	109.4	R215 V221 F223 M225	R215-T217 PolarHBondContact O-N 2.88Å; T217-V221 WeakPolarHBondContact CB-O 3.45Å; T217-F223 WeakPolarHBondContact CG2-O 3.31Å; T217-M225 HydrophobicContact CG2-CE 3.55Å
218	T	67.1	Low	78.7	Confident	54 Å²	54	65.2 Å²	65.2	33%	0.331	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-75.3	166.3	174.2	62.3	0	0	0	0	110	M198 R216 H220 V221	M198-T218 HydrophobicContact CE-CG2 3.77Å; R216-T218 PolarHBondContact O-N 2.64Å; T218-H220 PolarHBondContact O-N 3.5Å; T218-V221 PolarHBondContact O-N 2.89Å; T218-V221 WeakPolarHBondContact OG1-CG2 3.49Å
219	S	64.8	Low	78.7	Confident	88 Å²	88	63 Å²	63	62%	0.615	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.5	178.2	64.3	0	0	0	0	113.5	K222	S219-K222 VanDerWaalsContact O-CE 3.28Å; S219-K222 WeakPolarHBondContact O-CE 3.45Å; S219-K222 PolarHBondContact O-NZ 2.78Å
220	H	68.5	Low	78.7	Confident	100 Å²	100	61.3 Å²	61.3	46%	0.463	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-24.1	178.4	-60.6	-40.1	0	0	0	114	Q190 T218	Q190-H220 HydrophobicContact CG-CB 4.32Å; Q190-H220 PolarHBondContact NE2-ND1 2.63Å; T218-H220 PolarHBondContact O-N 3.5Å
221	V	75.9	Confident	78.8	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.024	28%	0.278	C	S	.	.			trans	-101.1	95.1	179.2	-165.5	0	0	0	0	109	A194 V195 T217 T218 M225 H228	A194-V221 HydrophobicContact CB-CG2 3.65Å; V195-V221 HydrophobicContact CG2-CG1 4.27Å; V195-V221 HydrophobicContact CG2-CG2 4.2Å; T217-V221 WeakPolarHBondContact CB-O 3.45Å; T218-V221 PolarHBondContact O-N 2.89Å; T218-V221 WeakPolarHBondContact OG1-CG2 3.49Å; V221-M225 HydrophobicContact CB-CE 3.84Å; V221-M225 HydrophobicContact CG1-CE 3.13Å; V221-M225 HydrophobicContact CG2-CE 4.42Å; V221-H228 WeakPolarHBondContact CG1-CD2 3.33Å; V221-H228 WeakPolarHBondContact CG1-NE2 3.35Å
222	K	76.6	Confident	78.9	Confident	98 Å²	98	54 Å²	54	43%	0.426	26%	0.258	S	S	.	.			trans	-76.4	-29.3	-178.8	-63.6	-60.9	-173.6	-173.3	0	112.3	L51 Y187 S219	L51-K222 HydrophobicContact CD1-CB 4.1Å; L51-K222 WeakPolarHBondContact CD1-O 3.44Å; Y187-K222 HydrophobicContact CD1-CG 4.4Å; Y187-K222 HydrophobicContact CD2-CG 4.41Å; Y187-K222 HydrophobicContact CG-CB 4.5Å; Y187-K222 HydrophobicContact CG-CG 4.22Å; S219-K222 VanDerWaalsContact O-CE 3.28Å; S219-K222 WeakPolarHBondContact O-CE 3.45Å; S219-K222 PolarHBondContact O-NZ 2.78Å
223	F	79	Confident	79	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-86.1	156.3	-179.5	-60	-99.1	0	0	0	112.5	F47 P48 F52 F184 F188 T217 M225 Y227 H228	F47-F223 HydrophobicContact CE2-CE1 4.41Å; P48-F223 VanDerWaalsContact CD-CD1 3.47Å; P48-F223 HydrophobicContact CG-CB 4.45Å; P48-F223 HydrophobicContact CG-CD1 3.33Å; P48-F223 HydrophobicContact CG-CE1 3.78Å; P48-F223 HydrophobicContact CG-CG 4.12Å; F52-F223 AromaticContact CE2-CE1 3.87Å; F52-F223 HydrophobicContact CE2-CE1 3.87Å; F52-F223 AromaticContact CE2-CZ 3.94Å; F52-F223 HydrophobicContact CE2-CZ 3.94Å; F52-F223 HydrophobicContact CZ-CE1 4.1Å; F52-F223 AromaticContact CZ-CZ 3.67Å; F52-F223 HydrophobicContact CZ-CZ 3.67Å; F184-F223 AromaticContact CD2-CE1 3.68Å; F184-F223 HydrophobicContact CD2-CE1 3.68Å; F184-F223 AromaticContact CD2-CZ 3.45Å; F184-F223 HydrophobicContact CD2-CZ 3.45Å; F184-F223 VanDerWaalsContact CD2-CZ 3.45Å; F184-F223 AromaticContact CE2-CE1 3.57Å; F184-F223 HydrophobicContact CE2-CE1 3.57Å; F184-F223 AromaticContact CE2-CZ 3.62Å; F184-F223 HydrophobicContact CE2-CZ 3.62Å; F184-F223 HydrophobicContact CG-CZ 4.43Å; F188-F223 HydrophobicContact CB-CE2 4.03Å; F188-F223 HydrophobicContact CB-CZ 4.31Å; T217-F223 WeakPolarHBondContact CG2-O 3.31Å; F223-M225 WeakPolarHBondContact O-CE 3.43Å; F223-Y227 HydrophobicContact CB-CD1 4.33Å; F223-Y227 HydrophobicContact CD1-CD1 4.19Å; F223-Y227 HydrophobicContact CD1-CE1 4.29Å; F223-Y227 HydrophobicContact CG-CD1 4.42Å; F223-H228 AromaticContact CD2-NE2 3.74Å; F223-H228 AromaticContact CG-NE2 3.99Å
224	P	82.6	Confident	79	Confident	49 Å²	49	53.1 Å²	53.1	32%	0.318	26%	0.257	S	S	.	.			trans	-56.1	146.2	171.9	-25.3	35.9	0	0	0	112.5	K226 Y227 H228	P224-K226 VanDerWaalsContact C-N 3.3Å; P224-K226 PolarHBondContact O-N 3.33Å; P224-Y227 WeakPolarHBondContact O-CB 3.34Å; P224-Y227 PolarHBondContact O-N 3.08Å; P224-Y227 VanDerWaalsContact O-N 3.13Å; P224-H228 PolarHBondContact O-N 3.44Å
225	M	83.8	Confident	79.1	Confident	10 Å²	10	47.7 Å²	47.7	5%	0.049	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-41.9	-179.1	-73.6	-51.9	83.2	0	0	112.1	V195 R215 T217 V221 F223 Y227 H228 V229	V195-M225 HydrophobicContact CG2-CE 4.28Å; V195-M225 HydrophobicContact CG2-SD 4.02Å; R215-M225 WeakPolarHBondContact O-CG 3.49Å; T217-M225 HydrophobicContact CG2-CE 3.55Å; V221-M225 HydrophobicContact CB-CE 3.84Å; V221-M225 HydrophobicContact CG1-CE 3.13Å; V221-M225 HydrophobicContact CG2-CE 4.42Å; F223-M225 WeakPolarHBondContact O-CE 3.43Å; M225-Y227 PolarHBondContact O-N 2.95Å; M225-H228 CarbonylContact O-C 3.59Å; M225-H228 PolarHBondContact O-N 3.36Å; M225-V229 WeakPolarHBondContact O-CG2 3.46Å; M225-V229 PolarHBondContact O-N 3.46Å
226	K	84.1	Confident	79.4	Confident	104 Å²	104	48.4 Å²	48.4	45%	0.452	24%	0.244	S	C	.	.	H	α-helix	trans	-52.9	-41.6	177	-64.4	-169.2	174.7	-170.7	0	112.5	L46 E213 P224 H228 V229 H230	L46-K226 HydrophobicContact CD1-CB 4.23Å; L46-K226 HydrophobicContact CD2-CB 4.47Å; E213-K226 HydrophobicContact CB-CG 4.38Å; E213-K226 HydrophobicContact CG-CG 4.05Å; E213-K226 VanDerWaalsContact OE2-CE 3.3Å; E213-K226 WeakPolarHBondContact OE2-CE 3.43Å; P224-K226 VanDerWaalsContact C-N 3.3Å; P224-K226 PolarHBondContact O-N 3.33Å; K226-H228 PolarHBondContact O-N 2.93Å; K226-V229 PolarHBondContact O-N 3.15Å; K226-H230 PolarHBondContact O-CD2 3.08Å; K226-H230 PolarHBondContact O-N 3.33Å
227	Y	85	Confident	80.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-42	178.4	-170.2	-91.5	0	0	0	112	L46 F47 I59 Q64 F188 F223 P224 M225 D231	L46-Y227 HydrophobicContact CB-CD2 4.3Å; F47-Y227 HydrophobicContact CD2-CE2 4.48Å; I59-Y227 PolarHBondContact O-OH 2.97Å; Q64-Y227 PolarHBondContact NE2-O 3.04Å; F188-Y227 HydrophobicContact CD2-CD1 4.46Å; F188-Y227 AromaticContact CD2-CE1 3.84Å; F188-Y227 HydrophobicContact CD2-CE1 3.84Å; F188-Y227 HydrophobicContact CE2-CD1 4.19Å; F188-Y227 AromaticContact CE2-CE1 3.61Å; F188-Y227 HydrophobicContact CE2-CE1 3.61Å; F223-Y227 HydrophobicContact CB-CD1 4.33Å; F223-Y227 HydrophobicContact CD1-CD1 4.19Å; F223-Y227 HydrophobicContact CD1-CE1 4.29Å; F223-Y227 HydrophobicContact CG-CD1 4.42Å; P224-Y227 WeakPolarHBondContact O-CB 3.34Å; P224-Y227 PolarHBondContact O-N 3.08Å; P224-Y227 VanDerWaalsContact O-N 3.13Å; M225-Y227 PolarHBondContact O-N 2.95Å; Y227-D231 WeakPolarHBondContact O-CB 3.14Å; Y227-D231 PolarHBondContact O-N 3.39Å; Y227-D231 VanDerWaalsContact O-N 3.16Å
228	H	85.4	Confident	81.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-73.6	-29.4	175.8	-77.7	-57.5	0	0	0	113.7	F188 R192 V195 V221 F223 P224 M225 K226 D231 I232	F188-H228 AromaticContact CD2-CE1 3.94Å; R192-H228 PolarHBondContact N-CE1 3.1Å; V195-H228 HydrophobicContact CB-CB 4.4Å; V195-H228 HydrophobicContact CG1-CB 4.42Å; V195-H228 HydrophobicContact CG2-CB 3.87Å; V221-H228 WeakPolarHBondContact CG1-CD2 3.33Å; V221-H228 WeakPolarHBondContact CG1-NE2 3.35Å; F223-H228 AromaticContact CD2-NE2 3.74Å; F223-H228 AromaticContact CG-NE2 3.99Å; P224-H228 PolarHBondContact O-N 3.44Å; M225-H228 CarbonylContact O-C 3.59Å; M225-H228 PolarHBondContact O-N 3.36Å; K226-H228 PolarHBondContact O-N 2.93Å; H228-D231 WeakPolarHBondContact O-CB 3.43Å; H228-D231 PolarHBondContact O-N 2.87Å; H228-I232 WeakPolarHBondContact O-CG1 3.47Å; H228-I232 WeakPolarHBondContact O-CG2 3.5Å; H228-I232 PolarHBondContact O-N 3.14Å
229	V	85.8	Confident	82	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-48.7	175.1	169.7	0	0	0	0	110.4	R209 L212 E213 M225 K226 D231 I232 V233 L249	R209-V229 HydrophobicContact CG-CG1 3.93Å; L212-V229 HydrophobicContact CD2-CG2 3.93Å; L212-V229 HydrophobicContact CG-CG2 4.16Å; E213-V229 HydrophobicContact CG-CB 4.46Å; E213-V229 HydrophobicContact CG-CG2 3.95Å; M225-V229 WeakPolarHBondContact O-CG2 3.46Å; M225-V229 PolarHBondContact O-N 3.46Å; K226-V229 PolarHBondContact O-N 3.15Å; V229-D231 PolarHBondContact O-N 2.93Å; V229-I232 WeakPolarHBondContact O-CG1 3.31Å; V229-I232 PolarHBondContact O-N 3.34Å; V229-V233 HydrophobicContact CG1-CG2 4.39Å; V229-V233 WeakPolarHBondContact O-CB 3.41Å; V229-V233 VanDerWaalsContact O-CG2 3.24Å; V229-V233 WeakPolarHBondContact O-CG2 3.4Å; V229-V233 PolarHBondContact O-N 3.05Å; V229-L249 HydrophobicContact CG1-CD1 4.25Å
230	H	85.9	Confident	82.9	Confident	23 Å²	23	37.5 Å²	37.5	11%	0.106	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-34.8	173.8	-75.4	-68	0	0	0	112.1	L43 Q64 S67 R209 K226 G234	L43-H230 HydrophobicContact CD2-CB 4.46Å; Q64-H230 HydrophobicContact CB-CB 4.3Å; Q64-H230 HydrophobicContact CG-CB 4.21Å; S67-H230 WeakPolarHBondContact CB-O 3.31Å; S67-H230 PolarHBondContact OG-ND1 3.23Å; S67-H230 PolarHBondContact OG-O 2.82Å; R209-H230 PolarHBondContact NH2-CE1 2.97Å; R209-H230 VanDerWaalsContact NH2-CE1 3.27Å; K226-H230 PolarHBondContact O-CD2 3.08Å; K226-H230 PolarHBondContact O-N 3.33Å; H230-G234 WeakPolarHBondContact O-CA 3.37Å; H230-G234 PolarHBondContact O-N 3.16Å
231	D	86.2	Confident	83.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-56.1	176	171.1	52.9	0	0	0	112.8	H63 Q64 F188 R192 Y227 H228 V229 V233 G234 A235	H63-D231 PolarHBondContact CD2-O 3.45Å; H63-D231 IonicContact CD2-OD1 3.63Å; H63-D231 IonicContact CE1-OD1 2.82Å; H63-D231 IonicContact NE2-OD1 2.64Å; H63-D231 PolarHBondContact NE2-OD1 2.96Å; Q64-D231 HydrophobicContact CG-CB 4.25Å; F188-D231 HydrophobicContact CE2-CB 4.3Å; F188-D231 HydrophobicContact CZ-CB 4.17Å; F188-D231 VanDerWaalsContact CZ-OD1 3.27Å; F188-D231 WeakPolarHBondContact CZ-OD1 3.4Å; F188-D231 VanDerWaalsContact CZ-OD2 3.28Å; F188-D231 WeakPolarHBondContact CZ-OD2 3.24Å; R192-D231 WeakPolarHBondContact CG-OD2 3.4Å; R192-D231 IonicContact CZ-OD1 2.76Å; R192-D231 IonicContact CZ-OD2 2.72Å; R192-D231 IonicContact NE-OD1 3.36Å; R192-D231 PolarHBondContact NE-OD1 3.04Å; R192-D231 IonicContact NE-OD2 3.83Å; R192-D231 PolarHBondContact NE-OD2 3.27Å; R192-D231 IonicContact NH2-OD1 3.57Å; R192-D231 PolarHBondContact NH2-OD1 2.96Å; R192-D231 IonicContact NH2-OD2 3.53Å; Y227-D231 WeakPolarHBondContact O-CB 3.14Å; Y227-D231 PolarHBondContact O-N 3.39Å; Y227-D231 VanDerWaalsContact O-N 3.16Å; H228-D231 WeakPolarHBondContact O-CB 3.43Å; H228-D231 PolarHBondContact O-N 2.87Å; V229-D231 PolarHBondContact O-N 2.93Å; D231-V233 VanDerWaalsContact C-N 3.33Å; D231-V233 PolarHBondContact O-N 3.27Å; D231-G234 PolarHBondContact O-N 2.89Å; D231-A235 VanDerWaalsContact O-CB 3.22Å; D231-A235 WeakPolarHBondContact O-CB 3.4Å; D231-A235 PolarHBondContact O-N 3.2Å
232	I	87.2	Confident	84.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.4	-34.4	-175.9	63.6	-178.4	0	0	0	112.5	R192 V195 L196 V199 L212 H228 V229 E236 L237 V238	R192-I232 HydrophobicContact CG-CG2 4.26Å; V195-I232 HydrophobicContact CG1-CD1 3.94Å; L196-I232 HydrophobicContact CD1-CG2 4.45Å; L196-I232 HydrophobicContact CD2-CB 4.02Å; L196-I232 HydrophobicContact CD2-CG2 3.67Å; L196-I232 HydrophobicContact CG-CG2 3.83Å; V199-I232 HydrophobicContact CG2-CD1 4.49Å; L212-I232 HydrophobicContact CD2-CD1 4.15Å; H228-I232 WeakPolarHBondContact O-CG1 3.47Å; H228-I232 WeakPolarHBondContact O-CG2 3.5Å; H228-I232 PolarHBondContact O-N 3.14Å; V229-I232 WeakPolarHBondContact O-CG1 3.31Å; V229-I232 PolarHBondContact O-N 3.34Å; I232-E236 PolarHBondContact O-N 2.62Å; I232-L237 HydrophobicContact CB-CB 4.47Å; I232-L237 PolarHBondContact O-N 3.42Å; I232-V238 HydrophobicContact CB-CG1 4.42Å; I232-V238 HydrophobicContact CB-CG2 4.24Å; I232-V238 HydrophobicContact CD1-CG1 4.11Å; I232-V238 HydrophobicContact CD1-CG2 4.16Å; I232-V238 HydrophobicContact CG1-CG1 4.37Å; I232-V238 HydrophobicContact CG1-CG2 3.81Å; I232-V238 PolarHBondContact O-N 2.74Å
233	V	86.4	Confident	84.6	Confident	23 Å²	23	38 Å²	38	14%	0.139	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-47.6	176.1	173.6	0	0	0	0	109.6	V229 D231 A235 E236 V238 L249	V229-V233 HydrophobicContact CG1-CG2 4.39Å; V229-V233 WeakPolarHBondContact O-CB 3.41Å; V229-V233 VanDerWaalsContact O-CG2 3.24Å; V229-V233 WeakPolarHBondContact O-CG2 3.4Å; V229-V233 PolarHBondContact O-N 3.05Å; D231-V233 VanDerWaalsContact C-N 3.33Å; D231-V233 PolarHBondContact O-N 3.27Å; V233-A235 VanDerWaalsContact C-N 3.32Å; V233-A235 PolarHBondContact O-N 3.46Å; V233-E236 PolarHBondContact O-N 2.76Å; V233-V238 HydrophobicContact CB-CG2 4.41Å; V233-V238 HydrophobicContact CG2-CG2 3.74Å; V233-L249 HydrophobicContact CG2-CD1 4.37Å; V233-L249 HydrophobicContact CG2-CD2 3.69Å
234	G	82.7	Confident	84.6	Confident	5 Å²	5	45.3 Å²	45.3	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-34.7	-178.5	0	0	0	0	0	113.9	H63 H230 D231 E236	H63-G234 CarbonylContact O-C 3.41Å; H63-G234 WeakPolarHBondContact O-CA 3.4Å; H230-G234 WeakPolarHBondContact O-CA 3.37Å; H230-G234 PolarHBondContact O-N 3.16Å; D231-G234 PolarHBondContact O-N 2.89Å; G234-E236 PolarHBondContact O-N 3.41Å
235	A	83.7	Confident	84.3	Confident	29 Å²	29	47.5 Å²	47.5	24%	0.24	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6	175.2	0	0	0	0	0	113.1	H63 D231 V233 L237	H63-A235 PolarHBondContact CD2-N 3.08Å; D231-A235 VanDerWaalsContact O-CB 3.22Å; D231-A235 WeakPolarHBondContact O-CB 3.4Å; D231-A235 PolarHBondContact O-N 3.2Å; V233-A235 VanDerWaalsContact C-N 3.32Å; V233-A235 PolarHBondContact O-N 3.46Å; A235-L237 HydrophobicContact CB-CD1 4Å; A235-L237 HydrophobicContact CB-CG 3.84Å; A235-L237 PolarHBondContact O-N 3.23Å
236	E	83.9	Confident	84.2	Confident	120 Å²	120	48.5 Å²	48.5	56%	0.561	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	24.2	-179.8	-55.8	-173	149.5	0	0	114	K72 I232 V233 G234 V238	K72-E236 WeakPolarHBondContact CE-OE1 3.48Å; K72-E236 VanDerWaalsContact NZ-CD 3.35Å; K72-E236 IonicContact NZ-OE1 3.67Å; K72-E236 PolarHBondContact NZ-OE1 2.99Å; K72-E236 IonicContact NZ-OE2 2.66Å; I232-E236 PolarHBondContact O-N 2.62Å; V233-E236 PolarHBondContact O-N 2.76Å; G234-E236 PolarHBondContact O-N 3.41Å; E236-V238 PolarHBondContact O-N 2.81Å
237	L	83.3	Confident	84.3	Confident	51 Å²	51	45.8 Å²	45.8	27%	0.267	28%	0.277	S	S	.	.	S	Bend	trans	-76.4	-15.5	175.7	-57.4	176.8	0	0	0	111.7	R192 L196 I232 A235 A252	R192-L237 HydrophobicContact CG-CD1 4.4Å; L196-L237 HydrophobicContact CD1-CB 4.44Å; L196-L237 HydrophobicContact CD1-CD1 3.77Å; L196-L237 HydrophobicContact CD2-CB 3.87Å; I232-L237 HydrophobicContact CB-CB 4.47Å; I232-L237 PolarHBondContact O-N 3.42Å; A235-L237 HydrophobicContact CB-CD1 4Å; A235-L237 HydrophobicContact CB-CG 3.84Å; A235-L237 PolarHBondContact O-N 3.23Å; L237-A252 PolarHBondContact O-N 2.66Å; L237-A252 VanDerWaalsContact O-N 3.16Å
238	V	86	Confident	84.4	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.3	173.2	-60.9	0	0	0	0	110.2	L196 V199 I232 V233 E236 L249 R250	L196-V238 HydrophobicContact CD2-CG1 4.03Å; V199-V238 HydrophobicContact CG1-CG1 4.42Å; I232-V238 HydrophobicContact CB-CG1 4.42Å; I232-V238 HydrophobicContact CB-CG2 4.24Å; I232-V238 HydrophobicContact CD1-CG1 4.11Å; I232-V238 HydrophobicContact CD1-CG2 4.16Å; I232-V238 HydrophobicContact CG1-CG1 4.37Å; I232-V238 HydrophobicContact CG1-CG2 3.81Å; I232-V238 PolarHBondContact O-N 2.74Å; V233-V238 HydrophobicContact CB-CG2 4.41Å; V233-V238 HydrophobicContact CG2-CG2 3.74Å; E236-V238 PolarHBondContact O-N 2.81Å; V238-L249 HydrophobicContact CB-CB 4.48Å; V238-L249 HydrophobicContact CG2-CB 4.39Å; V238-L249 HydrophobicContact CG2-CD2 4.18Å; V238-R250 CarbonylContact C-O 3.57Å; V238-R250 WeakPolarHBondContact CA-O 3.46Å; V238-R250 VanDerWaalsContact CB-O 3.31Å; V238-R250 WeakPolarHBondContact CB-O 3.22Å
239	E	85.3	Confident	84.5	Confident	105 Å²	105	47.2 Å²	47.2	49%	0.491	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.8	171.3	-172	-178.8	-160.3	0	0	109.5	I241 L249 R250	E239-I241 HydrophobicContact CG-CD1 4.49Å; E239-I241 HydrophobicContact CG-CG1 4.07Å; E239-L249 WeakPolarHBondContact O-CA 3.39Å; E239-R250 HydrophobicContact CB-CB 4.39Å; E239-R250 PolarHBondContact N-O 2.86Å; E239-R250 PolarHBondContact O-N 2.66Å; E239-R250 IonicContact OE2-NH1 3.54Å
240	S	84.5	Confident	84.5	Confident	60 Å²	60	51.6 Å²	51.6	42%	0.42	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	110.2	179.4	174.3	0	0	0	0	110.3	T247	S240-T247 WeakPolarHBondContact OG-CG2 3.35Å
241	I	85.8	Confident	84.6	Confident	42 Å²	42	52.5 Å²	52.5	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.3	-176.2	-55.1	173.5	0	0	0	108.9	E239 T243 L248 R250	E239-I241 HydrophobicContact CG-CD1 4.49Å; E239-I241 HydrophobicContact CG-CG1 4.07Å; I241-T243 HydrophobicContact CG2-CG2 4.4Å; I241-T243 PolarHBondContact O-N 3.42Å; I241-L248 HydrophobicContact CD1-CD2 4.43Å; I241-L248 PolarHBondContact N-O 2.62Å; I241-L248 PolarHBondContact O-N 2.83Å; I241-R250 HydrophobicContact CD1-CB 4.45Å
242	P	84.6	Confident	84.3	Confident	112 Å²	112	54 Å²	54	73%	0.727	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.3	174.9	28.4	-32.1	0	0	0	110.1
243	T	86.3	Confident	83	Confident	57 Å²	57	60.3 Å²	60.3	35%	0.35	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	165.3	175.1	75.6	0	0	0	0	110.4	I241 S245 G246 L248	I241-T243 HydrophobicContact CG2-CG2 4.4Å; I241-T243 PolarHBondContact O-N 3.42Å; T243-S245 PolarHBondContact O-N 3.21Å; T243-S245 VanDerWaalsContact O-N 3.15Å; T243-S245 PolarHBondContact OG1-N 3.37Å; T243-G246 WeakPolarHBondContact CA-O 3.37Å; T243-G246 WeakPolarHBondContact CB-O 3.01Å; T243-G246 PolarHBondContact N-O 3.15Å; T243-G246 PolarHBondContact O-N 3.08Å; T243-G246 PolarHBondContact OG1-O 3.09Å; T243-L248 HydrophobicContact CG2-CB 3.91Å; T243-L248 HydrophobicContact CG2-CD1 4.48Å
244	T	79	Confident	81.4	Confident	154 Å²	154	67.7 Å²	67.7	95%	0.945	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.4	177.4	45.3	0	0	0	0	113.7
245	S	75.1	Confident	81.3	Confident	96 Å²	96	70.8 Å²	70.8	67%	0.671	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	8	176.1	-54	0	0	0	0	113.5	T243	T243-S245 PolarHBondContact O-N 3.21Å; T243-S245 VanDerWaalsContact O-N 3.15Å; T243-S245 PolarHBondContact OG1-N 3.37Å
246	G	83.1	Confident	81.2	Confident	30 Å²	30	73 Å²	73	31%	0.309	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.7	-173.9	-178.8	0	0	0	0	0	113.5	T243 L248	T243-G246 WeakPolarHBondContact CA-O 3.37Å; T243-G246 WeakPolarHBondContact CB-O 3.01Å; T243-G246 PolarHBondContact N-O 3.15Å; T243-G246 PolarHBondContact O-N 3.08Å; T243-G246 PolarHBondContact OG1-O 3.09Å; G246-L248 PolarHBondContact O-N 3.48Å
247	T	85.4	Confident	81.1	Confident	47 Å²	47	70.4 Å²	70.4	29%	0.288	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	124	-178.1	-48.7	0	0	0	0	111.3	R209 S240	R209-T247 WeakPolarHBondContact CB-O 3.35Å; R209-T247 PolarHBondContact N-O 3.43Å; S240-T247 WeakPolarHBondContact OG-CG2 3.35Å
248	L	87.2	Confident	80.9	Confident	29 Å²	29	71.5 Å²	71.5	15%	0.152	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132.8	176.9	-173.8	143.6	0	0	0	109.8	E206 L208 I241 T243 G246 R250	E206-L248 HydrophobicContact CB-CD1 4.39Å; E206-L248 HydrophobicContact CB-CD2 3.87Å; E206-L248 HydrophobicContact CB-CG 4.33Å; E206-L248 HydrophobicContact CG-CD2 3.75Å; L208-L248 HydrophobicContact CD2-CB 4.3Å; I241-L248 HydrophobicContact CD1-CD2 4.43Å; I241-L248 PolarHBondContact N-O 2.62Å; I241-L248 PolarHBondContact O-N 2.83Å; T243-L248 HydrophobicContact CG2-CB 3.91Å; T243-L248 HydrophobicContact CG2-CD1 4.48Å; G246-L248 PolarHBondContact O-N 3.48Å; L248-R250 HydrophobicContact CD2-CB 4.42Å
249	L	86.9	Confident	80.6	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.005	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.1	177.9	-57.1	179.9	0	0	0	108.7	E206 V207 R209 L212 V229 V233 V238 E239	E206-L249 CarbonylContact C-O 3.57Å; E206-L249 WeakPolarHBondContact CA-O 3.4Å; V207-L249 HydrophobicContact CG1-CB 4.29Å; V207-L249 PolarHBondContact N-O 2.98Å; V207-L249 PolarHBondContact O-N 2.95Å; R209-L249 HydrophobicContact CB-CD1 4.2Å; R209-L249 HydrophobicContact CB-CG 4.23Å; R209-L249 HydrophobicContact CG-CD1 4.42Å; L212-L249 HydrophobicContact CD2-CD1 3.99Å; V229-L249 HydrophobicContact CG1-CD1 4.25Å; V233-L249 HydrophobicContact CG2-CD1 4.37Å; V233-L249 HydrophobicContact CG2-CD2 3.69Å; V238-L249 HydrophobicContact CB-CB 4.48Å; V238-L249 HydrophobicContact CG2-CB 4.39Å; V238-L249 HydrophobicContact CG2-CD2 4.18Å; E239-L249 WeakPolarHBondContact O-CA 3.39Å
250	R	87	Confident	80.3	Confident	93 Å²	93	73.6 Å²	73.6	35%	0.351	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	136.1	175.1	-178.4	-176.9	-71.7	155	-3.4	109.6	S205 E206 V238 E239 I241 L248 A252	S205-R250 WeakPolarHBondContact O-CA 3.43Å; E206-R250 HydrophobicContact CG-CB 4.01Å; E206-R250 HydrophobicContact CG-CG 3.93Å; E206-R250 IonicContact OE1-CZ 2.76Å; E206-R250 IonicContact OE1-NE 3.43Å; E206-R250 PolarHBondContact OE1-NE 3.1Å; E206-R250 IonicContact OE1-NH2 3.56Å; E206-R250 PolarHBondContact OE1-NH2 3.48Å; V238-R250 CarbonylContact C-O 3.57Å; V238-R250 WeakPolarHBondContact CA-O 3.46Å; V238-R250 VanDerWaalsContact CB-O 3.31Å; V238-R250 WeakPolarHBondContact CB-O 3.22Å; E239-R250 HydrophobicContact CB-CB 4.39Å; E239-R250 PolarHBondContact N-O 2.86Å; E239-R250 PolarHBondContact O-N 2.66Å; E239-R250 IonicContact OE2-NH1 3.54Å; I241-R250 HydrophobicContact CD1-CB 4.45Å; L248-R250 HydrophobicContact CD2-CB 4.42Å; R250-A252 PolarHBondContact O-N 2.78Å
251	F	87.1	Confident	80	Confident	42 Å²	42	74.6 Å²	74.6	18%	0.184	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	127	173.8	-171.5	-99.2	0	0	0	110.8	L196 V199 K200 S205 D253	L196-F251 HydrophobicContact CB-CE2 4.38Å; L196-F251 HydrophobicContact CD2-CD2 4.39Å; L196-F251 HydrophobicContact CD2-CE2 4.21Å; V199-F251 HydrophobicContact CG1-CB 4.17Å; K200-F251 HydrophobicContact CB-CD2 4.27Å; K200-F251 HydrophobicContact CB-CG 4.43Å; K200-F251 HydrophobicContact CD-CE1 4.26Å; K200-F251 HydrophobicContact CD-CZ 4.29Å; S205-F251 PolarHBondContact O-N 3.15Å; F251-D253 WeakPolarHBondContact CD1-OD1 3.44Å; F251-D253 VanDerWaalsContact CE1-OD1 3.27Å; F251-D253 WeakPolarHBondContact CE1-OD1 3.5Å; F251-D253 PolarHBondContact O-N 3.46Å
252	A	80.1	Confident	79.6	Confident	30 Å²	30	77.1 Å²	77.1	25%	0.248	48%	0.476	C	S	.	.			trans	-83.2	103.5	173.1	0	0	0	0	0	108.4	L237 R250 S254	L237-A252 PolarHBondContact O-N 2.66Å; L237-A252 VanDerWaalsContact O-N 3.16Å; R250-A252 PolarHBondContact O-N 2.78Å; A252-S254 PolarHBondContact O-N 3.47Å
253	D	60.4	Low	79.2	Confident	133 Å²	133	74.2 Å²	74.2	71%	0.711	46%	0.455	S	S	*	.			trans	-68.6	98.1	168.3	-86.9	-30.1	0	0	0	107.7	F251	F251-D253 WeakPolarHBondContact CD1-OD1 3.44Å; F251-D253 VanDerWaalsContact CE1-OD1 3.27Å; F251-D253 WeakPolarHBondContact CE1-OD1 3.5Å; F251-D253 PolarHBondContact O-N 3.46Å
254	S	52.2	Low	78.5	Confident	178 Å²	178	75.7 Å²	75.7	100%	1.245	47%	0.465	S	S	*	.			trans	-86.6	0	166.1	-56.9	0	0	0	0	110.7	A252	A252-S254 PolarHBondContact O-N 3.47Å

Retrieved 254 of 254 residues in 149.8 ms (Link to these results)

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