A0A087YB73_POEFO Loading...

Neuronal acetylcholine receptor subunit beta-2

AlphaFold DB , UniProt , Accession A0A087YB73, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 499 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	E	33.5	Very low	34	Very low	249 Å²	249	163.5 Å²	163.5	100%	1.164	87%	0.873	S	S	*	*				0	131.2	0	-96.5	164	134.3	0	0	110
2	R	36.3	Very low	33.8	Very low	242 Å²	242	155.8 Å²	155.8	91%	0.913	86%	0.862	S	S	*	*			trans	37.7	121.5	171.9	-79.5	176.6	175.4	172.4	-1.3	117.1
3	S	31	Very low	34.1	Very low	117 Å²	117	162.2 Å²	162.2	82%	0.818	87%	0.865	S	S	*	*				-166.3	130.5	71.8	-63.7	0	0	0	0	111.8
4	R	36.7	Very low	34	Very low	251 Å²	251	162.1 Å²	162.1	95%	0.947	86%	0.864	S	S	*	*			trans	-77.9	135.8	159	-74.9	-179.8	-171.5	-172.2	1.9	108.3
5	C	33.9	Very low	34.7	Very low	134 Å²	134	156.3 Å²	156.3	91%	0.905	86%	0.857	S	S	*	*			trans	-129.8	119.1	148.9	-108.3	0	0	0	0	106.7
6	G	33.8	Very low	34.8	Very low	64 Å²	64	157.8 Å²	157.8	66%	0.66	85%	0.853	S	S	*	*			trans	-83.4	162.2	170.6	0	0	0	0	0	110.6
7	L	32.1	Very low	35.4	Very low	175 Å²	175	153.3 Å²	153.3	92%	0.916	85%	0.852	S	S	*	*				-171.4	144.3	123.6	-113.7	111.3	0	0	0	108.5
8	T	33.7	Very low	35.4	Very low	121 Å²	121	155.7 Å²	155.7	74%	0.742	85%	0.853	S	S	*	*			trans	-62.4	165.8	-179.9	41.3	0	0	0	0	113
9	P	36.5	Very low	35.5	Very low	123 Å²	123	155.8 Å²	155.8	80%	0.799	85%	0.852	S	S	*	*				-143.8	136	106.8	31.4	-13.2	0	0	0	116.1
10	V	32.7	Very low	35.5	Very low	134 Å²	134	153.3 Å²	153.3	81%	0.812	85%	0.846	S	S	*	*			trans	19.1	122.4	133.4	-174.3	0	0	0	0	119.3
11	M	34.3	Very low	35.6	Very low	188 Å²	188	155.3 Å²	155.3	93%	0.926	85%	0.846	S	S	*	*			trans	-54.2	121.6	162.7	-152	105.2	158.9	0	0	112
12	G	31.9	Very low	35.8	Very low	72 Å²	72	147.2 Å²	147.2	74%	0.742	82%	0.817	S	S	*	*			trans	-147.6	97.8	171.6	0	0	0	0	0	110.6	L14	G12-L14 PolarHBondContact O-N 3.14Å
13	R	36.6	Very low	35.9	Very low	239 Å²	239	141 Å²	141	90%	0.902	81%	0.811	S	S	*	*			trans	-70.6	119.2	168.4	-84.3	-179.8	169.3	-172.4	-2.8	109
14	L	33.4	Very low	36.5	Very low	161 Å²	161	143 Å²	143	84%	0.843	81%	0.805	S	S	*	*			trans	-148.3	118.2	152	-106.8	122.2	0	0	0	108.7	G12	G12-L14 PolarHBondContact O-N 3.14Å
15	G	43.8	Very low	36.9	Very low	74 Å²	74	133.7 Å²	133.7	76%	0.763	79%	0.787	S	S	*	*			trans	-70.1	131	176.9	0	0	0	0	0	110.7
16	F	36	Very low	37.8	Very low	180 Å²	180	132.8 Å²	132.8	79%	0.789	77%	0.772	S	S	*	*			trans	-142	121.3	157.3	-102.6	-87.2	0	0	0	107.2	F18	F16-F18 PolarHBondContact O-N 3.16Å; F16-F18 VanDerWaalsContact O-N 3.16Å
17	G	45.6	Very low	38.7	Very low	82 Å²	82	132.3 Å²	132.3	85%	0.845	77%	0.767	S	S	*	*			trans	-62.1	113.2	175.5	0	0	0	0	0	109.8
18	F	35.9	Very low	40	Very low	196 Å²	196	127.3 Å²	127.3	86%	0.86	75%	0.751	S	S	*	*			trans	-100.6	109.8	160.8	-96.3	-89.6	0	0	0	107.3	F16 S20	F16-F18 PolarHBondContact O-N 3.16Å; F16-F18 VanDerWaalsContact O-N 3.16Å; F18-S20 PolarHBondContact O-N 3.29Å
19	L	37.6	Very low	42	Very low	159 Å²	159	126 Å²	126	83%	0.832	74%	0.74	S	S	*	*			trans	-55.6	103.6	160.6	-78.9	157.8	0	0	0	107.1	F21	L19-F21 VanDerWaalsContact C-N 3.28Å; L19-F21 PolarHBondContact O-N 2.86Å
20	S	34.6	Very low	44.4	Very low	105 Å²	105	120.6 Å²	120.6	73%	0.734	70%	0.704	S	S	*	*			trans	-67.5	93.3	166.7	-167.2	0	0	0	0	106.9	F18 S22	F18-S20 PolarHBondContact O-N 3.29Å; S20-S22 PolarHBondContact O-N 3.43Å
21	F	37.9	Very low	47.1	Very low	196 Å²	196	118 Å²	118	86%	0.86	68%	0.683	S	S	*	*			trans	-68	82.2	153.9	-99.4	-91.3	0	0	0	106.4	L19 S23	L19-F21 VanDerWaalsContact C-N 3.28Å; L19-F21 PolarHBondContact O-N 2.86Å; F21-S23 PolarHBondContact O-N 3.05Å
22	S	37.7	Very low	49.8	Very low	79 Å²	79	114.8 Å²	114.8	55%	0.552	67%	0.666	S	S	*	*			trans	-63.8	87.9	155.7	51.9	0	0	0	0	106.6	S20 F24	S20-S22 PolarHBondContact O-N 3.43Å; S22-F24 PolarHBondContact O-N 3.12Å
23	S	39	Very low	52.6	Low	111 Å²	111	117 Å²	117	78%	0.776	65%	0.652	S	S	*	*			trans	-62	90.4	155.8	-178.6	0	0	0	0	105.5	F21 G25	F21-S23 PolarHBondContact O-N 3.05Å; S23-G25 PolarHBondContact O-N 3.26Å; S23-G25 VanDerWaalsContact O-N 3.13Å
24	F	42	Very low	55.3	Low	160 Å²	160	105.6 Å²	105.6	70%	0.702	61%	0.609	S	S	*	*			trans	-51.7	119.2	169	-113.7	-101.8	0	0	0	107	S22 L26	S22-F24 PolarHBondContact O-N 3.12Å; F24-L26 PolarHBondContact O-N 2.81Å
25	G	45.8	Very low	58.1	Low	54 Å²	54	100 Å²	100	56%	0.557	58%	0.581	S	S	*	*			trans	-69.2	78.3	168.7	0	0	0	0	0	109.2	S23 G27 A28	S23-G25 PolarHBondContact O-N 3.26Å; S23-G25 VanDerWaalsContact O-N 3.13Å; G25-G27 PolarHBondContact O-N 3.19Å; G25-A28 PolarHBondContact O-N 3.15Å
26	L	52.3	Low	60.4	Low	116 Å²	116	102.7 Å²	102.7	61%	0.607	57%	0.574	S	S	*	*	H	α-helix	trans	-59.4	-24.3	178	-86.7	138.4	0	0	0	113	F24 T30	F24-L26 PolarHBondContact O-N 2.81Å; L26-T30 PolarHBondContact O-OG1 2.91Å
27	G	54	Low	63	Low	53 Å²	53	99.6 Å²	99.6	55%	0.546	56%	0.562	S	S	.	*	H	α-helix	trans	-72.5	-35.2	-178.8	0	0	0	0	0	115	G25	G25-G27 PolarHBondContact O-N 3.19Å
28	A	59.3	Low	65.2	Low	71 Å²	71	95.9 Å²	95.9	59%	0.587	52%	0.522	S	S	*	.	H	α-helix	trans	-79	-36.9	-175.5	0	0	0	0	0	112.7	G25 T30 E32	G25-A28 PolarHBondContact O-N 3.15Å; A28-T30 VanDerWaalsContact C-N 3.33Å; A28-T30 PolarHBondContact O-N 2.85Å; A28-E32 PolarHBondContact O-N 2.97Å
29	D	75.8	Confident	68	Low	93 Å²	93	88.4 Å²	88.4	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-65.6	-35.4	178	-172.6	47	0	0	0	111.9	R33	D29-R33 VanDerWaalsContact O-CB 3.29Å; D29-R33 WeakPolarHBondContact O-CB 3.45Å; D29-R33 PolarHBondContact O-N 2.85Å
30	T	87.1	Confident	70.6	Confident	9 Å²	9	84.5 Å²	84.5	6%	0.055	47%	0.471	C	S	.	.	H	α-helix	trans	-73.4	-40.1	-178.1	-48.3	0	0	0	0	112.3	L26 A28 R33 L34 F101 D102 M104	L26-T30 PolarHBondContact O-OG1 2.91Å; A28-T30 VanDerWaalsContact C-N 3.33Å; A28-T30 PolarHBondContact O-N 2.85Å; T30-R33 PolarHBondContact O-N 2.9Å; T30-L34 WeakPolarHBondContact O-CB 3.26Å; T30-L34 PolarHBondContact O-N 3.16Å; T30-F101 HydrophobicContact CG2-CB 4.17Å; T30-F101 HydrophobicContact CG2-CD1 4.41Å; T30-D102 HydrophobicContact CG2-CB 4Å; T30-M104 HydrophobicContact CG2-CE 3.64Å
31	E	88.6	Confident	73.1	Confident	80 Å²	80	85.2 Å²	85.2	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-42.6	175.7	-169.1	171.9	-167.6	0	0	110.8	R33 L34 V35 M104 V107	E31-R33 PolarHBondContact O-N 2.95Å; E31-L34 PolarHBondContact O-N 3.29Å; E31-V35 HydrophobicContact CG-CG2 4.48Å; E31-V35 VanDerWaalsContact O-CG2 3.23Å; E31-V35 WeakPolarHBondContact O-CG2 3.29Å; E31-V35 PolarHBondContact O-N 3.42Å; E31-M104 HydrophobicContact CB-SD 4.28Å; E31-V107 HydrophobicContact CG-CG2 4.02Å
32	E	90.5	Very high	75.4	Confident	120 Å²	120	80.5 Å²	80.5	56%	0.561	47%	0.47	S	S	*	.	H	α-helix	trans	-58.6	-48.9	174.2	-174.3	169	-171.6	0	0	111.4	A28 L34 V35 E36	A28-E32 PolarHBondContact O-N 2.97Å; E32-L34 VanDerWaalsContact C-N 3.32Å; E32-L34 PolarHBondContact O-N 3.13Å; E32-V35 PolarHBondContact O-N 2.94Å; E32-E36 WeakPolarHBondContact O-CG 3.37Å; E32-E36 PolarHBondContact O-N 2.82Å
33	R	91.4	Very high	77.7	Confident	119 Å²	119	82.6 Å²	82.6	45%	0.449	47%	0.471	S	S	.	.	H	α-helix	trans	-59.3	-39.8	176.4	-170.5	176.5	73.9	-162	5.5	112.9	D29 T30 E31 H37 E100 F101	D29-R33 VanDerWaalsContact O-CB 3.29Å; D29-R33 WeakPolarHBondContact O-CB 3.45Å; D29-R33 PolarHBondContact O-N 2.85Å; T30-R33 PolarHBondContact O-N 2.9Å; E31-R33 PolarHBondContact O-N 2.95Å; R33-H37 WeakPolarHBondContact O-CB 3.47Å; R33-H37 PolarHBondContact O-N 2.65Å; R33-E100 PolarHBondContact NH2-O 2.95Å; R33-F101 HydrophobicContact CG-CE1 4.36Å
34	L	92.1	Very high	80.4	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-66.8	-45.3	176.7	178.8	62.1	0	0	0	111.1	T30 E31 E32 E36 H37 L38 W96 F101 M104 V107	T30-L34 WeakPolarHBondContact O-CB 3.26Å; T30-L34 PolarHBondContact O-N 3.16Å; E31-L34 PolarHBondContact O-N 3.29Å; E32-L34 VanDerWaalsContact C-N 3.32Å; E32-L34 PolarHBondContact O-N 3.13Å; L34-E36 PolarHBondContact O-N 3.12Å; L34-H37 WeakPolarHBondContact O-CB 3.35Å; L34-H37 PolarHBondContact O-N 3.44Å; L34-L38 HydrophobicContact CD1-CD1 3.85Å; L34-L38 HydrophobicContact CD1-CD2 4.4Å; L34-L38 HydrophobicContact CD1-CG 3.89Å; L34-L38 HydrophobicContact CD2-CD1 4.41Å; L34-L38 HydrophobicContact CG-CD1 3.84Å; L34-L38 HydrophobicContact CG-CG 4.25Å; L34-L38 WeakPolarHBondContact O-CB 3.26Å; L34-L38 VanDerWaalsContact O-CG 3.3Å; L34-L38 WeakPolarHBondContact O-CG 3.21Å; L34-L38 PolarHBondContact O-N 2.87Å; L34-W96 HydrophobicContact CD1-CB 3.93Å; L34-W96 HydrophobicContact CD1-CD2 4Å; L34-W96 HydrophobicContact CD1-CG 3.71Å; L34-W96 HydrophobicContact CD2-CD2 4.06Å; L34-W96 HydrophobicContact CD2-CG 4.38Å; L34-W96 HydrophobicContact CD2-CZ2 4.1Å; L34-F101 HydrophobicContact CB-CD1 3.72Å; L34-F101 HydrophobicContact CB-CE1 3.94Å; L34-F101 HydrophobicContact CB-CG 4.35Å; L34-F101 HydrophobicContact CD1-CD1 3.9Å; L34-F101 HydrophobicContact CD1-CD2 3.88Å; L34-F101 HydrophobicContact CD1-CE1 3.87Å; L34-F101 HydrophobicContact CD1-CE2 3.86Å; L34-F101 HydrophobicContact CD1-CG 3.9Å; L34-F101 HydrophobicContact CD1-CZ 3.85Å; L34-F101 HydrophobicContact CG-CD1 4.35Å; L34-M104 HydrophobicContact CB-CE 3.94Å; L34-M104 HydrophobicContact CD2-CE 3.7Å; L34-M104 HydrophobicContact CG-CE 4.45Å; L34-V107 HydrophobicContact CD2-CB 4.24Å; L34-V107 HydrophobicContact CD2-CG1 4.44Å
35	V	92.9	Very high	82.8	Confident	42 Å²	42	74 Å²	74	26%	0.255	42%	0.423	S	S	.	.	H	α-helix	trans	-62.7	-43.3	179.4	174.2	0	0	0	0	110.9	E31 E32 H37 L38 L39 V107 L109	E31-V35 HydrophobicContact CG-CG2 4.48Å; E31-V35 VanDerWaalsContact O-CG2 3.23Å; E31-V35 WeakPolarHBondContact O-CG2 3.29Å; E31-V35 PolarHBondContact O-N 3.42Å; E32-V35 PolarHBondContact O-N 2.94Å; V35-H37 VanDerWaalsContact C-N 3.32Å; V35-H37 PolarHBondContact O-N 3.33Å; V35-L38 PolarHBondContact O-N 3.1Å; V35-L39 HydrophobicContact CG1-CD1 3.95Å; V35-L39 WeakPolarHBondContact O-CB 3.37Å; V35-L39 PolarHBondContact O-N 3.28Å; V35-V107 HydrophobicContact CG2-CG2 3.98Å; V35-L109 HydrophobicContact CB-CD2 4.48Å; V35-L109 HydrophobicContact CG1-CD2 4.12Å; V35-L109 HydrophobicContact CG2-CD2 3.75Å
36	E	91.5	Very high	85.1	Confident	132 Å²	132	76.1 Å²	76.1	62%	0.617	42%	0.417	S	S	*	.	H	α-helix	trans	-63	-38.1	174.9	-73.6	-168.8	158.5	0	0	112.5	E32 L34 N40	E32-E36 WeakPolarHBondContact O-CG 3.37Å; E32-E36 PolarHBondContact O-N 2.82Å; L34-E36 PolarHBondContact O-N 3.12Å; E36-N40 WeakPolarHBondContact O-CB 3.46Å; E36-N40 PolarHBondContact O-N 2.96Å
37	H	91.4	Very high	87	Confident	114 Å²	114	77 Å²	77	53%	0.528	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-48.1	176.3	-175	69	0	0	0	111.9	R33 L34 V35 F101	R33-H37 WeakPolarHBondContact O-CB 3.47Å; R33-H37 PolarHBondContact O-N 2.65Å; L34-H37 WeakPolarHBondContact O-CB 3.35Å; L34-H37 PolarHBondContact O-N 3.44Å; V35-H37 VanDerWaalsContact C-N 3.32Å; V35-H37 PolarHBondContact O-N 3.33Å; H37-F101 HydrophobicContact CB-CZ 4.28Å
38	L	92.6	Very high	88.8	Confident	4 Å²	4	79.1 Å²	79.1	2%	0.021	42%	0.419	C	S	.	.	H	α-helix	trans	-71.7	-42.6	-176.5	-68	177.3	0	0	0	113	L34 V35 N40 Y44 L94 W96 V107	L34-L38 HydrophobicContact CD1-CD1 3.85Å; L34-L38 HydrophobicContact CD1-CD2 4.4Å; L34-L38 HydrophobicContact CD1-CG 3.89Å; L34-L38 HydrophobicContact CD2-CD1 4.41Å; L34-L38 HydrophobicContact CG-CD1 3.84Å; L34-L38 HydrophobicContact CG-CG 4.25Å; L34-L38 WeakPolarHBondContact O-CB 3.26Å; L34-L38 VanDerWaalsContact O-CG 3.3Å; L34-L38 WeakPolarHBondContact O-CG 3.21Å; L34-L38 PolarHBondContact O-N 2.87Å; V35-L38 PolarHBondContact O-N 3.1Å; L38-N40 VanDerWaalsContact C-N 3.33Å; L38-Y44 WeakPolarHBondContact O-CB 3.23Å; L38-L94 HydrophobicContact CB-CD2 4.14Å; L38-W96 HydrophobicContact CD1-CE3 3.84Å; L38-W96 HydrophobicContact CD1-CZ3 4.04Å; L38-W96 HydrophobicContact CD2-CE3 4.21Å; L38-V107 HydrophobicContact CD1-CG1 4.34Å
39	L	93.4	Very high	90.4	Very high	40 Å²	40	77.1 Å²	77.1	21%	0.209	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	17.2	-175.3	-62.1	-178.7	0	0	0	113.2	V35 P41 Y44 L94 L109 H113 I114	V35-L39 HydrophobicContact CG1-CD1 3.95Å; V35-L39 WeakPolarHBondContact O-CB 3.37Å; V35-L39 PolarHBondContact O-N 3.28Å; L39-P41 WeakPolarHBondContact O-CD 3.41Å; L39-Y44 HydrophobicContact CD2-CD1 4.04Å; L39-Y44 HydrophobicContact CD2-CE1 4.32Å; L39-Y44 HydrophobicContact CD2-CG 4.42Å; L39-L94 HydrophobicContact CD2-CD2 4.42Å; L39-L109 HydrophobicContact CD1-CD2 4.24Å; L39-L109 HydrophobicContact CD2-CD1 4.33Å; L39-H113 HydrophobicContact CD1-CB 4.22Å; L39-I114 HydrophobicContact CD2-CG2 4.13Å
40	N	91.9	Very high	91.3	Very high	76 Å²	76	73.1 Å²	73.1	41%	0.406	38%	0.375	S	S	.	.			trans	-57	123.1	177.5	-169.2	-27.7	0	0	0	110	E36 L38 A42 H43 Y44	E36-N40 WeakPolarHBondContact O-CB 3.46Å; E36-N40 PolarHBondContact O-N 2.96Å; L38-N40 VanDerWaalsContact C-N 3.33Å; N40-A42 PolarHBondContact O-N 2.89Å; N40-A42 PolarHBondContact OD1-N 3.48Å; N40-H43 PolarHBondContact O-N 2.87Å; N40-Y44 PolarHBondContact O-N 3.48Å
41	P	87.3	Confident	91.6	Very high	121 Å²	121	73.4 Å²	73.4	79%	0.786	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.7	-177.6	-25.7	33.8	0	0	0	114.5	L39 H43	L39-P41 WeakPolarHBondContact O-CD 3.41Å; P41-H43 VanDerWaalsContact C-N 3.31Å
42	A	86.3	Confident	91.6	Very high	96 Å²	96	73.6 Å²	73.6	79%	0.793	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.9	175.4	0	0	0	0	0	113.2	N40	N40-A42 PolarHBondContact O-N 2.89Å; N40-A42 PolarHBondContact OD1-N 3.48Å
43	H	87.5	Confident	91.6	Very high	124 Å²	124	73 Å²	73	57%	0.574	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-38.4	-174.2	-169.4	67.3	0	0	0	112.8	N40 P41	N40-H43 PolarHBondContact O-N 2.87Å; P41-H43 VanDerWaalsContact C-N 3.31Å
44	Y	94.5	Very high	91.3	Very high	17 Å²	17	70.9 Å²	70.9	7%	0.067	40%	0.402	C	S	.	.			trans	-108.5	120.1	-172.4	-165.4	-95.1	0	0	0	112.6	L38 L39 N40 K46 D91 R93 L94 H113 I114 W115	L38-Y44 WeakPolarHBondContact O-CB 3.23Å; L39-Y44 HydrophobicContact CD2-CD1 4.04Å; L39-Y44 HydrophobicContact CD2-CE1 4.32Å; L39-Y44 HydrophobicContact CD2-CG 4.42Å; N40-Y44 PolarHBondContact O-N 3.48Å; Y44-K46 HydrophobicContact CE1-CB 4Å; Y44-D91 PolarHBondContact OH-OD2 2.85Å; Y44-R93 HydrophobicContact CD2-CB 4.16Å; Y44-R93 HydrophobicContact CE2-CB 4.31Å; Y44-L94 HydrophobicContact CD2-CD2 3.8Å; Y44-L94 HydrophobicContact CD2-CG 4.34Å; Y44-L94 HydrophobicContact CE2-CD1 4.08Å; Y44-L94 HydrophobicContact CE2-CD2 3.65Å; Y44-L94 HydrophobicContact CE2-CG 3.74Å; Y44-H113 WeakPolarHBondContact CE1-O 3.35Å; Y44-I114 WeakPolarHBondContact OH-CA 3.47Å; Y44-W115 PolarHBondContact OH-N 2.97Å
45	N	93.1	Very high	91.2	Very high	72 Å²	72	76 Å²	76	39%	0.385	44%	0.437	S	S	.	.			trans	-121.6	110.9	170.9	-173.1	-14	0	0	0	110.4	L47 I48 R93	N45-L47 PolarHBondContact O-N 3.43Å; N45-L47 WeakPolarHBondContact OD1-CB 3.29Å; N45-L47 PolarHBondContact OD1-N 3.21Å; N45-I48 HydrophobicContact CB-CD1 4.01Å; N45-I48 HydrophobicContact CB-CG1 4.28Å; N45-I48 PolarHBondContact O-N 3.13Å; N45-R93 PolarHBondContact O-NH1 3.04Å
46	K	92.9	Very high	91.2	Very high	100 Å²	100	77.9 Å²	77.9	44%	0.435	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.8	-178.1	72.7	-179.8	-171.3	178.2	0	115.1	Y44 I48 K112 W115	Y44-K46 HydrophobicContact CE1-CB 4Å; K46-I48 VanDerWaalsContact C-N 3.28Å; K46-K112 WeakPolarHBondContact CD-O 3.42Å; K46-K112 PolarHBondContact NZ-O 2.96Å; K46-W115 WeakPolarHBondContact O-CB 3.44Å; K46-W115 VanDerWaalsContact O-CD1 3.25Å
47	L	92.2	Very high	91.2	Very high	135 Å²	135	75.5 Å²	75.5	71%	0.707	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-14.3	-179.9	-60.8	177.6	0	0	0	112.4	N45	N45-L47 PolarHBondContact O-N 3.43Å; N45-L47 WeakPolarHBondContact OD1-CB 3.29Å; N45-L47 PolarHBondContact OD1-N 3.21Å
48	I	92.2	Very high	91.4	Very high	96 Å²	96	70.5 Å²	70.5	49%	0.492	41%	0.411	S	S	.	.	S	Bend	trans	-102.9	126.9	-175.9	-52.4	175.4	0	0	0	108.5	N45 K46 R93	N45-I48 HydrophobicContact CB-CD1 4.01Å; N45-I48 HydrophobicContact CB-CG1 4.28Å; N45-I48 PolarHBondContact O-N 3.13Å; K46-I48 VanDerWaalsContact C-N 3.28Å; I48-R93 PolarHBondContact O-NH1 2.73Å; I48-R93 PolarHBondContact O-NH2 3.47Å; I48-R93 VanDerWaalsContact O-NH2 3.14Å
49	R	93.9	Very high	91.5	Very high	30 Å²	30	73.9 Å²	73.9	11%	0.113	43%	0.433	C	S	.	.			trans	-60	144.3	176.2	73	-172	-170.9	91.1	4.8	111.5	A51 G54 E56 W115 Y180 E184	R49-A51 VanDerWaalsContact C-N 3.25Å; R49-A51 HydrophobicContact CG-CB 4.27Å; R49-A51 PolarHBondContact O-N 2.59Å; R49-G54 PolarHBondContact NH2-O 2.8Å; R49-E56 PolarHBondContact NH1-O 2.69Å; R49-E56 PolarHBondContact NH2-O 3.48Å; R49-W115 HydrophobicContact CB-CZ2 3.87Å; R49-Y180 HydrophobicContact CB-CE1 4.31Å; R49-E184 PolarHBondContact NH1-O 3.08Å
50	P	94.4	Very high	91.6	Very high	8 Å²	8	72 Å²	72	5%	0.052	42%	0.423	C	S	.	.	S	Bend	trans	-79.5	70	-176.4	33.7	-37.6	0	0	0	111.7	V58 D91 W115	P50-V58 HydrophobicContact CG-CG1 4.23Å; P50-V58 HydrophobicContact CG-CG2 4.2Å; P50-D91 HydrophobicContact CB-CB 3.87Å; P50-D91 WeakPolarHBondContact CB-OD1 3.41Å; P50-D91 HydrophobicContact CG-CB 4.35Å; P50-W115 HydrophobicContact CG-CD2 4.21Å; P50-W115 HydrophobicContact CG-CE3 3.7Å; P50-W115 HydrophobicContact CG-CH2 4.38Å; P50-W115 HydrophobicContact CG-CZ3 3.8Å
51	A	92.4	Very high	91.8	Very high	16 Å²	16	72.2 Å²	72.2	13%	0.132	42%	0.421	C	S	.	.			trans	-119.9	133.4	175.8	0	0	0	0	0	109.7	R49 N53 E56 V58	R49-A51 VanDerWaalsContact C-N 3.25Å; R49-A51 HydrophobicContact CG-CB 4.27Å; R49-A51 PolarHBondContact O-N 2.59Å; A51-N53 VanDerWaalsContact C-N 3.32Å; A51-N53 WeakPolarHBondContact CB-O 3.38Å; A51-E56 HydrophobicContact CB-CB 4.3Å; A51-V58 HydrophobicContact CB-CG2 4.37Å
52	T	89.5	Confident	92.2	Very high	84 Å²	84	66.5 Å²	66.5	52%	0.515	38%	0.384	S	S	.	.	S	Bend	trans	-71	-34.9	177.5	64.7	0	0	0	0	111	E56 Y92	T52-E56 WeakPolarHBondContact CB-OE2 3.3Å; T52-E56 PolarHBondContact N-OE2 3.17Å; T52-E56 PolarHBondContact OG1-OE2 2.86Å; T52-Y92 HydrophobicContact CG2-CD1 3.93Å; T52-Y92 HydrophobicContact CG2-CE1 4.03Å; T52-Y92 HydrophobicContact CG2-CG 4.2Å
53	N	90.8	Very high	92.6	Very high	107 Å²	107	63.9 Å²	63.9	57%	0.572	36%	0.356	S	S	*	.	S	Bend	trans	-122.9	149.7	176.9	-70.7	-41.1	0	0	0	111	A51 S55 E56	A51-N53 VanDerWaalsContact C-N 3.32Å; A51-N53 WeakPolarHBondContact CB-O 3.38Å; N53-S55 PolarHBondContact O-N 3.49Å; N53-S55 VanDerWaalsContact O-N 3.11Å; N53-E56 HydrophobicContact CB-CB 4.34Å; N53-E56 WeakPolarHBondContact O-CB 3.31Å; N53-E56 PolarHBondContact O-N 3.04Å
54	G	85.1	Confident	92.9	Very high	75 Å²	75	58 Å²	58	77%	0.773	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.8	178.3	0	0	0	0	0	114.7	R49	R49-G54 PolarHBondContact NH2-O 2.8Å
55	S	88.4	Confident	93	Very high	106 Å²	106	57.8 Å²	57.8	74%	0.741	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-5.3	177.1	60.4	0	0	0	0	114.3	N53	N53-S55 PolarHBondContact O-N 3.49Å; N53-S55 VanDerWaalsContact O-N 3.11Å
56	E	92.9	Very high	93.1	Very high	83 Å²	83	54.3 Å²	54.3	39%	0.388	31%	0.311	S	S	.	.			trans	-76.4	139.5	179.7	-177.2	176.8	-160.8	0	0	110.1	R49 A51 T52 N53	R49-E56 PolarHBondContact NH1-O 2.69Å; R49-E56 PolarHBondContact NH2-O 3.48Å; A51-E56 HydrophobicContact CB-CB 4.3Å; T52-E56 WeakPolarHBondContact CB-OE2 3.3Å; T52-E56 PolarHBondContact N-OE2 3.17Å; T52-E56 PolarHBondContact OG1-OE2 2.86Å; N53-E56 HydrophobicContact CB-CB 4.34Å; N53-E56 WeakPolarHBondContact O-CB 3.31Å; N53-E56 PolarHBondContact O-N 3.04Å
57	L	92.7	Very high	93.2	Very high	81 Å²	81	50.1 Å²	50.1	42%	0.424	30%	0.295	S	S	.	.			trans	-92.5	131.1	178.8	-65.8	171	0	0	0	109.8	T59 R182 T183	L57-T59 PolarHBondContact O-N 3.5Å; L57-R182 WeakPolarHBondContact CD2-O 3.4Å; L57-T183 WeakPolarHBondContact CD2-O 3.31Å
58	V	94.8	Very high	93.3	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.5	170.7	-178.5	0	0	0	0	108	P50 A51 V60 W115 E184 I185 D186	P50-V58 HydrophobicContact CG-CG1 4.23Å; P50-V58 HydrophobicContact CG-CG2 4.2Å; A51-V58 HydrophobicContact CB-CG2 4.37Å; V58-V60 HydrophobicContact CG1-CG2 4.35Å; V58-W115 HydrophobicContact CG1-CH2 4Å; V58-W115 HydrophobicContact CG1-CZ3 4.19Å; V58-E184 PolarHBondContact N-O 3.43Å; V58-I185 HydrophobicContact CB-CG1 4.44Å; V58-I185 WeakPolarHBondContact O-CA 3.3Å; V58-I185 WeakPolarHBondContact O-CG2 3.48Å; V58-D186 PolarHBondContact O-N 2.79Å
59	T	95	Very high	93.5	Very high	76 Å²	76	43.2 Å²	43.2	47%	0.466	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	120	176.8	55.6	0	0	0	0	110.2	L57 D186	L57-T59 PolarHBondContact O-N 3.5Å; T59-D186 CarbonylContact C-O 3.54Å; T59-D186 WeakPolarHBondContact CA-O 3.23Å; T59-D186 HydrophobicContact CG2-CB 4.4Å
60	V	96.2	Very high	93.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116	176.6	-178.5	0	0	0	0	108.5	V58 L62 W89 P117 I185 D186 L187 V188	V58-V60 HydrophobicContact CG1-CG2 4.35Å; V60-L62 HydrophobicContact CG1-CD1 4.45Å; V60-L62 HydrophobicContact CG1-CG 4.38Å; V60-W89 HydrophobicContact CG2-CB 4.16Å; V60-P117 HydrophobicContact CG1-CB 4.45Å; V60-P117 HydrophobicContact CG1-CG 3.96Å; V60-P117 HydrophobicContact CG2-CB 3.96Å; V60-P117 HydrophobicContact CG2-CG 4.06Å; V60-I185 HydrophobicContact CB-CG2 4.44Å; V60-I185 HydrophobicContact CG2-CG2 3.81Å; V60-D186 PolarHBondContact N-O 2.66Å; V60-L187 HydrophobicContact CB-CD2 3.98Å; V60-L187 HydrophobicContact CG1-CD2 4.49Å; V60-V188 PolarHBondContact O-N 2.76Å
61	Q	96.3	Very high	93.5	Very high	80 Å²	80	46.5 Å²	46.5	37%	0.374	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	126.1	175.3	-64.1	-175.7	-0.3	0	0	110	Q87 E88 V188	Q61-Q87 WeakPolarHBondContact O-CA 3.5Å; Q61-E88 HydrophobicContact CB-CB 4.33Å; Q61-E88 PolarHBondContact N-O 2.81Å; Q61-E88 PolarHBondContact O-N 3Å; Q61-V188 CarbonylContact C-O 3.59Å; Q61-V188 WeakPolarHBondContact CA-O 3.45Å
62	L	95	Very high	93.6	Very high	2 Å²	2	46 Å²	46	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.4	-177.9	-79.7	143.5	0	0	0	110.6	V60 L85 T86 Q87 V119 L187 V188 R190 I226	V60-L62 HydrophobicContact CG1-CD1 4.45Å; V60-L62 HydrophobicContact CG1-CG 4.38Å; L62-L85 HydrophobicContact CD2-CD1 3.79Å; L62-L85 HydrophobicContact CD2-CG 4.28Å; L62-T86 WeakPolarHBondContact CA-O 3.38Å; L62-Q87 HydrophobicContact CD2-CG 3.89Å; L62-V119 HydrophobicContact CD1-CG1 4.35Å; L62-V119 HydrophobicContact CD1-CG2 4.28Å; L62-V119 HydrophobicContact CD2-CB 4.48Å; L62-V119 HydrophobicContact CD2-CG1 3.91Å; L62-V119 HydrophobicContact CD2-CG2 4.33Å; L62-L187 HydrophobicContact CD1-CB 3.98Å; L62-L187 HydrophobicContact CD1-CD1 4.19Å; L62-L187 HydrophobicContact CD1-CD2 3.72Å; L62-L187 HydrophobicContact CD1-CG 4.16Å; L62-V188 PolarHBondContact N-O 3.26Å; L62-R190 PolarHBondContact O-N 3.47Å; L62-I226 HydrophobicContact CB-CD1 3.92Å; L62-I226 HydrophobicContact CD1-CD1 3.75Å; L62-I226 HydrophobicContact CG-CD1 4.48Å
63	M	94.6	Very high	93.8	Very high	40 Å²	40	46 Å²	46	20%	0.197	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	131.8	171.1	-172.4	-178.4	171.6	0	0	109.5	T86 R190 S195	M63-T86 PolarHBondContact N-O 3.19Å; M63-T86 WeakPolarHBondContact O-CB 3.32Å; M63-T86 PolarHBondContact O-N 3.19Å; M63-R190 HydrophobicContact CB-CB 4Å; M63-S195 VanDerWaalsContact CE-CB 3.46Å
64	V	94.5	Very high	93.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.2	173.9	175	0	0	0	0	108.7	V83 L85 F175 A194 S195 Y228	V64-V83 HydrophobicContact CG1-CB 4.03Å; V64-V83 HydrophobicContact CG1-CG1 4.05Å; V64-L85 HydrophobicContact CG2-CD1 3.8Å; V64-F175 HydrophobicContact CG2-CD2 4.35Å; V64-F175 HydrophobicContact CG2-CE2 3.71Å; V64-F175 HydrophobicContact CG2-CZ 4.22Å; V64-A194 WeakPolarHBondContact O-CA 3.47Å; V64-A194 WeakPolarHBondContact O-CB 3.35Å; V64-S195 PolarHBondContact O-N 3.43Å; V64-S195 VanDerWaalsContact O-N 3.09Å; V64-Y228 HydrophobicContact CB-CD1 4.44Å; V64-Y228 HydrophobicContact CB-CD2 4.17Å; V64-Y228 HydrophobicContact CB-CE1 4.15Å; V64-Y228 HydrophobicContact CB-CE2 3.88Å; V64-Y228 HydrophobicContact CB-CG 4.43Å; V64-Y228 HydrophobicContact CG2-CD2 3.65Å; V64-Y228 HydrophobicContact CG2-CE2 3.33Å; V64-Y228 HydrophobicContact CG2-CG 4.36Å; V64-Y228 PolarHBondContact N-OH 2.86Å
65	S	95.1	Very high	94.1	Very high	13 Å²	13	46.1 Å²	46.1	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.9	167.1	179.6	0	0	0	0	109.6	V83 W84 S195	S65-V83 CarbonylContact O-C 3.4Å; S65-V83 WeakPolarHBondContact O-CA 3.49Å; S65-W84 PolarHBondContact N-O 2.85Å; S65-W84 PolarHBondContact O-N 2.98Å; S65-S195 WeakPolarHBondContact CA-O 3.45Å
66	L	95.8	Very high	94.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117.1	-177.7	-179.2	67.7	0	0	0	110.5	T81 V83 S195 F199 I207 L210 F230	L66-T81 HydrophobicContact CD1-CG2 4.28Å; L66-V83 HydrophobicContact CD1-CG1 3.83Å; L66-S195 PolarHBondContact N-O 3.36Å; L66-F199 HydrophobicContact CD2-CD2 3.92Å; L66-F199 HydrophobicContact CD2-CE2 3.91Å; L66-F199 HydrophobicContact CG-CD2 4.07Å; L66-F199 HydrophobicContact CG-CE2 4.4Å; L66-I207 HydrophobicContact CD2-CD1 3.19Å; L66-L210 HydrophobicContact CB-CD1 4.16Å; L66-L210 HydrophobicContact CD2-CD1 3.77Å; L66-F230 HydrophobicContact CD1-CE1 4.01Å; L66-F230 HydrophobicContact CD2-CE1 4.04Å
67	A	94.6	Very high	94.3	Very high	11 Å²	11	46.7 Å²	46.7	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-46.1	174.2	0	0	0	0	0	111.8	N82 T200	A67-N82 HydrophobicContact CB-CB 4.47Å; A67-N82 WeakPolarHBondContact CB-O 3.09Å; A67-N82 PolarHBondContact N-O 3.21Å; A67-T200 PolarHBondContact O-N 3.35Å; A67-T200 PolarHBondContact O-OG1 2.89Å
68	Q	95.3	Very high	94.4	Very high	84 Å²	84	43.7 Å²	43.7	39%	0.393	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	137.3	-177.6	-167.2	177.1	19.7	0	0	112	I70 N82 T200	Q68-I70 HydrophobicContact CG-CG1 4.5Å; Q68-I70 PolarHBondContact O-N 3.43Å; Q68-N82 HydrophobicContact CB-CB 4.26Å; Q68-N82 PolarHBondContact N-O 3.5Å; Q68-N82 PolarHBondContact O-N 2.97Å; Q68-T200 WeakPolarHBondContact CB-OG1 3.38Å; Q68-T200 WeakPolarHBondContact CG-OG1 3.43Å
69	L	95.6	Very high	94.5	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	102.4	161.1	-179.7	63.5	0	0	0	108.1	V72 M79 T81 W205 I232	L69-V72 HydrophobicContact CD1-CG2 4.06Å; L69-V72 HydrophobicContact CD2-CG2 4.3Å; L69-V72 HydrophobicContact CG-CG2 4.45Å; L69-M79 HydrophobicContact CD1-CG 3.93Å; L69-M79 HydrophobicContact CD1-SD 4.12Å; L69-T81 HydrophobicContact CD1-CG2 3.69Å; L69-W205 HydrophobicContact CD2-CB 3.73Å; L69-W205 HydrophobicContact CD2-CG 4.18Å; L69-I232 HydrophobicContact CD2-CD1 4.42Å; L69-I232 HydrophobicContact CD2-CG2 4.34Å
70	I	94.3	Very high	94.5	Very high	74 Å²	74	40.1 Å²	40.1	38%	0.379	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-55.2	-173.1	-66.6	169.4	0	0	0	110	Q68 T80 N82 I152	Q68-I70 HydrophobicContact CG-CG1 4.5Å; Q68-I70 PolarHBondContact O-N 3.43Å; I70-T80 HydrophobicContact CB-CG2 4.17Å; I70-T80 HydrophobicContact CD1-CG2 4.09Å; I70-T80 HydrophobicContact CG2-CG2 4.41Å; I70-T80 PolarHBondContact N-O 2.9Å; I70-N82 HydrophobicContact CD1-CB 4.06Å; I70-N82 HydrophobicContact CG1-CB 4.43Å; I70-I152 HydrophobicContact CD1-CG2 4.07Å
71	S	94.1	Very high	94.4	Very high	32 Å²	32	40.1 Å²	40.1	22%	0.224	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	153.1	179.9	58.8	0	0	0	0	111.8	H73 T80	S71-H73 PolarHBondContact OG-CE1 3.21Å; S71-H73 PolarHBondContact OG-ND1 3.21Å; S71-T80 PolarHBondContact N-O 2.66Å; S71-T80 PolarHBondContact O-N 3.19Å
72	V	95.1	Very high	94.4	Very high	6 Å²	6	38.3 Å²	38.3	4%	0.036	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	104	169.2	-178	0	0	0	0	106.2	L69 E74 M79 I159 W205 I232	L69-V72 HydrophobicContact CD1-CG2 4.06Å; L69-V72 HydrophobicContact CD2-CG2 4.3Å; L69-V72 HydrophobicContact CG-CG2 4.45Å; V72-E74 PolarHBondContact O-N 3.48Å; V72-M79 HydrophobicContact CG2-CG 4.18Å; V72-I159 HydrophobicContact CG1-CD1 3.98Å; V72-W205 HydrophobicContact CB-CZ2 4.16Å; V72-W205 HydrophobicContact CG1-CZ2 4.31Å; V72-I232 HydrophobicContact CG2-CD1 3.84Å
73	H	93.8	Very high	94.3	Very high	84 Å²	84	38.2 Å²	38.2	39%	0.389	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	101.7	178.6	-62.2	102	0	0	0	108.9	S71 R75 E76 Q77 V78	S71-H73 PolarHBondContact OG-CE1 3.21Å; S71-H73 PolarHBondContact OG-ND1 3.21Å; H73-R75 PolarHBondContact O-N 2.9Å; H73-E76 HydrophobicContact CB-CB 4.24Å; H73-Q77 WeakPolarHBondContact O-CA 3.49Å; H73-Q77 PolarHBondContact O-N 2.91Å; H73-V78 PolarHBondContact N-O 2.92Å; H73-V78 PolarHBondContact O-N 3.48Å; H73-V78 VanDerWaalsContact O-N 3.13Å
74	E	91.5	Very high	94.3	Very high	26 Å²	26	40.3 Å²	40.3	12%	0.121	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-38.6	-171.9	-55.3	92.1	152.9	0	0	112.4	V72 Q77 I159 R234 P290	V72-E74 PolarHBondContact O-N 3.48Å; E74-Q77 PolarHBondContact O-N 3.03Å; E74-I159 HydrophobicContact CB-CG2 4.35Å; E74-I159 HydrophobicContact CG-CG2 4.34Å; E74-R234 IonicContact OE1-CZ 3.18Å; E74-R234 IonicContact OE1-NH1 2.81Å; E74-R234 PolarHBondContact OE1-NH1 2.84Å; E74-R234 IonicContact OE1-NH2 3.01Å; E74-R234 PolarHBondContact OE1-NH2 2.71Å; E74-P290 VanDerWaalsContact O-CB 3.25Å; E74-P290 WeakPolarHBondContact O-CB 3.38Å; E74-P290 WeakPolarHBondContact O-CD 3.26Å; E74-P290 WeakPolarHBondContact O-CG 3.43Å
75	R	90.6	Very high	94.3	Very high	158 Å²	158	40.3 Å²	40.3	60%	0.596	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-41.7	-179.7	-175.9	-179.3	177.4	-169.2	-4.4	112.6	H73 Q77 K287	H73-R75 PolarHBondContact O-N 2.9Å; R75-Q77 VanDerWaalsContact C-N 3.34Å; R75-K287 WeakPolarHBondContact CD-O 3.45Å
76	E	92.2	Very high	94.3	Very high	143 Å²	143	40.5 Å²	40.5	67%	0.668	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.2	178.9	-66.1	178.8	-173	0	0	112.3	H73 V78	H73-E76 HydrophobicContact CB-CB 4.24Å; E76-V78 VanDerWaalsContact C-N 3.33Å; E76-V78 HydrophobicContact CB-CG2 4.17Å
77	Q	93.5	Very high	94.2	Very high	58 Å²	58	40.5 Å²	40.5	27%	0.271	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	40.4	-176.8	-58.9	-168.1	-38.3	0	0	112.8	H73 E74 R75 C157 P290 T292	H73-Q77 WeakPolarHBondContact O-CA 3.49Å; H73-Q77 PolarHBondContact O-N 2.91Å; E74-Q77 PolarHBondContact O-N 3.03Å; R75-Q77 VanDerWaalsContact C-N 3.34Å; Q77-C157 CarbonylContact C-O 3.57Å; Q77-C157 WeakPolarHBondContact CB-O 3.21Å; Q77-C157 PolarHBondContact O-N 3.09Å; Q77-P290 HydrophobicContact CG-CB 4.14Å; Q77-T292 VanDerWaalsContact NE2-CG2 3.3Å
78	V	95.3	Very high	94.3	Very high	19 Å²	19	42.4 Å²	42.4	12%	0.115	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.6	-177.4	-178.6	0	0	0	0	111	H73 E76 A125 K154 S155	H73-V78 PolarHBondContact N-O 2.92Å; H73-V78 PolarHBondContact O-N 3.48Å; H73-V78 VanDerWaalsContact O-N 3.13Å; E76-V78 VanDerWaalsContact C-N 3.33Å; E76-V78 HydrophobicContact CB-CG2 4.17Å; V78-A125 HydrophobicContact CB-CB 4.47Å; V78-A125 HydrophobicContact CG1-CB 4.04Å; V78-A125 HydrophobicContact CG2-CB 3.61Å; V78-K154 HydrophobicContact CG1-CB 3.89Å; V78-K154 HydrophobicContact CG1-CG 4.44Å; V78-S155 CarbonylContact C-O 3.58Å; V78-S155 WeakPolarHBondContact CA-O 3.33Å
79	M	95.9	Very high	94.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.6	171	174.4	179.4	77	0	0	110	L69 V72 T81 K154 S155 C157 C171 L173 F230	L69-M79 HydrophobicContact CD1-CG 3.93Å; L69-M79 HydrophobicContact CD1-SD 4.12Å; V72-M79 HydrophobicContact CG2-CG 4.18Å; M79-T81 HydrophobicContact CE-CG2 4.01Å; M79-T81 HydrophobicContact CG-CG2 3.99Å; M79-T81 HydrophobicContact SD-CG2 4.09Å; M79-K154 CarbonylContact O-C 3.57Å; M79-K154 WeakPolarHBondContact O-CA 3.42Å; M79-S155 WeakPolarHBondContact CE-OG 3.23Å; M79-S155 PolarHBondContact N-O 3.35Å; M79-S155 PolarHBondContact O-N 3.26Å; M79-S155 PolarHBondContact O-OG 3.17Å; M79-C157 HydrophobicContact CB-CB 4.41Å; M79-C171 HydrophobicContact CE-CB 3.76Å; M79-C171 HydrophobicContact SD-CB 3.56Å; M79-C171 VanDerWaalsContact SD-CB 3.56Å; M79-L173 HydrophobicContact CE-CD2 3.91Å; M79-L173 HydrophobicContact CE-CG 4.17Å; M79-F230 HydrophobicContact CE-CB 4.26Å; M79-F230 HydrophobicContact CE-CD1 4.18Å; M79-F230 HydrophobicContact CE-CD2 4.02Å; M79-F230 HydrophobicContact CE-CE2 4.45Å; M79-F230 HydrophobicContact CE-CG 3.89Å; M79-F230 HydrophobicContact SD-CB 4.2Å; M79-F230 HydrophobicContact SD-CD1 4.21Å; M79-F230 HydrophobicContact SD-CG 4.2Å
80	T	95.2	Very high	94.4	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.8	177.9	-50.1	0	0	0	0	110.5	I70 S71 I152 Y153 K154	I70-T80 HydrophobicContact CB-CG2 4.17Å; I70-T80 HydrophobicContact CD1-CG2 4.09Å; I70-T80 HydrophobicContact CG2-CG2 4.41Å; I70-T80 PolarHBondContact N-O 2.9Å; S71-T80 PolarHBondContact N-O 2.66Å; S71-T80 PolarHBondContact O-N 3.19Å; T80-I152 HydrophobicContact CG2-CG2 3.71Å; T80-Y153 WeakPolarHBondContact CA-O 3.35Å; T80-K154 HydrophobicContact CG2-CG 4.11Å
81	T	95.2	Very high	94.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	138	-177.4	50	0	0	0	0	111	L66 L69 M79 I152 Y153 F230	L66-T81 HydrophobicContact CD1-CG2 4.28Å; L69-T81 HydrophobicContact CD1-CG2 3.69Å; M79-T81 HydrophobicContact CE-CG2 4.01Å; M79-T81 HydrophobicContact CG-CG2 3.99Å; M79-T81 HydrophobicContact SD-CG2 4.09Å; T81-I152 WeakPolarHBondContact O-CA 3.12Å; T81-Y153 PolarHBondContact N-O 2.82Å; T81-Y153 PolarHBondContact O-N 3.26Å; T81-F230 HydrophobicContact CG2-CE1 4Å; T81-F230 HydrophobicContact CG2-CZ 4.48Å
82	N	94.6	Very high	94.5	Very high	41 Å²	41	44.5 Å²	44.5	22%	0.219	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.9	166.4	-175	13.2	0	0	0	108.9	A67 Q68 I70	A67-N82 HydrophobicContact CB-CB 4.47Å; A67-N82 WeakPolarHBondContact CB-O 3.09Å; A67-N82 PolarHBondContact N-O 3.21Å; Q68-N82 HydrophobicContact CB-CB 4.26Å; Q68-N82 PolarHBondContact N-O 3.5Å; Q68-N82 PolarHBondContact O-N 2.97Å; I70-N82 HydrophobicContact CD1-CB 4.06Å; I70-N82 HydrophobicContact CG1-CB 4.43Å
83	V	94.5	Very high	94.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	150.2	-176.7	-56.4	0	0	0	0	111.2	V64 S65 L66 A151 Y153	V64-V83 HydrophobicContact CG1-CB 4.03Å; V64-V83 HydrophobicContact CG1-CG1 4.05Å; S65-V83 CarbonylContact O-C 3.4Å; S65-V83 WeakPolarHBondContact O-CA 3.49Å; L66-V83 HydrophobicContact CD1-CG1 3.83Å; V83-A151 PolarHBondContact N-O 2.82Å; V83-A151 PolarHBondContact O-N 2.73Å; V83-Y153 HydrophobicContact CG2-CD2 3.38Å; V83-Y153 HydrophobicContact CG2-CE2 3.53Å
84	W	94.3	Very high	94.5	Very high	84 Å²	84	41.1 Å²	41.1	32%	0.318	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.2	164.1	-54	98	0	0	0	107.9	S65 L148 P150	S65-W84 PolarHBondContact N-O 2.85Å; S65-W84 PolarHBondContact O-N 2.98Å; W84-L148 HydrophobicContact CB-CD1 3.85Å; W84-L148 HydrophobicContact CB-CG 4.34Å; W84-L148 HydrophobicContact CE3-CD2 4.34Å; W84-L148 HydrophobicContact CE3-CG 4.22Å; W84-P150 HydrophobicContact CE3-CB 3.84Å; W84-P150 HydrophobicContact CH2-CB 4.09Å; W84-P150 HydrophobicContact CZ3-CB 3.55Å; W84-P150 HydrophobicContact CZ3-CG 3.98Å
85	L	93.6	Very high	94.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	97.9	178.2	-177.1	64.2	0	0	0	108.9	L62 V64 Q87 P149 F175	L62-L85 HydrophobicContact CD2-CD1 3.79Å; L62-L85 HydrophobicContact CD2-CG 4.28Å; V64-L85 HydrophobicContact CG2-CD1 3.8Å; L85-Q87 HydrophobicContact CD2-CG 4.44Å; L85-Q87 VanDerWaalsContact CD2-NE2 3.27Å; L85-Q87 HydrophobicContact CG-CG 4.09Å; L85-Q87 PolarHBondContact O-N 3.38Å; L85-P149 PolarHBondContact N-O 2.58Å; L85-P149 VanDerWaalsContact O-CD 3.31Å; L85-P149 WeakPolarHBondContact O-CD 3.25Å; L85-F175 HydrophobicContact CD1-CE1 4.32Å; L85-F175 HydrophobicContact CD1-CZ 4.4Å; L85-F175 HydrophobicContact CD2-CD1 4.43Å; L85-F175 HydrophobicContact CD2-CE1 4.23Å
86	T	94.7	Very high	94.8	Very high	16 Å²	16	36.5 Å²	36.5	10%	0.098	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.1	176	-51.1	0	0	0	0	109.4	L62 M63 F146 L148	L62-T86 WeakPolarHBondContact CA-O 3.38Å; M63-T86 PolarHBondContact N-O 3.19Å; M63-T86 WeakPolarHBondContact O-CB 3.32Å; M63-T86 PolarHBondContact O-N 3.19Å; T86-F146 HydrophobicContact CG2-CD2 4.08Å; T86-F146 HydrophobicContact CG2-CE2 3.31Å; T86-F146 HydrophobicContact CG2-CZ 3.87Å; T86-L148 HydrophobicContact CG2-CD1 4.4Å; T86-L148 WeakPolarHBondContact OG1-CD1 3.35Å
87	Q	95.7	Very high	94.9	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.5	175.5	-58.6	-179	39.3	0	0	108.8	Q61 L62 L85 W89 W147	Q61-Q87 WeakPolarHBondContact O-CA 3.5Å; L62-Q87 HydrophobicContact CD2-CG 3.89Å; L85-Q87 HydrophobicContact CD2-CG 4.44Å; L85-Q87 VanDerWaalsContact CD2-NE2 3.27Å; L85-Q87 HydrophobicContact CG-CG 4.09Å; L85-Q87 PolarHBondContact O-N 3.38Å; Q87-W89 HydrophobicContact CB-CE3 4.23Å; Q87-W89 HydrophobicContact CB-CZ3 3.89Å; Q87-W147 HydrophobicContact CB-CE3 4.47Å; Q87-W147 PolarHBondContact N-O 3.01Å; Q87-W147 PolarHBondContact O-N 3.13Å
88	E	96.6	Very high	95	Very high	51 Å²	51	31.3 Å²	31.3	24%	0.238	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	127.5	178.6	-170.5	170.2	174	0	0	110	Q61 I145 R190	Q61-E88 HydrophobicContact CB-CB 4.33Å; Q61-E88 PolarHBondContact N-O 2.81Å; Q61-E88 PolarHBondContact O-N 3Å; E88-I145 VanDerWaalsContact CA-O 3.3Å; E88-I145 WeakPolarHBondContact CA-O 3.5Å; E88-R190 IonicContact OE2-CZ 2.85Å; E88-R190 IonicContact OE2-NH1 3.82Å; E88-R190 PolarHBondContact OE2-NH1 2.74Å; E88-R190 IonicContact OE2-NH2 3.19Å
89	W	96.4	Very high	94.9	Very high	7 Å²	7	39 Å²	39	3%	0.027	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	172.7	177.4	69	95.9	0	0	0	109.7	V60 Q87 I114 W115 L116 P117 I145 W147	V60-W89 HydrophobicContact CG2-CB 4.16Å; Q87-W89 HydrophobicContact CB-CE3 4.23Å; Q87-W89 HydrophobicContact CB-CZ3 3.89Å; W89-I114 HydrophobicContact CZ2-CD1 4.4Å; W89-W115 AromaticContact CD1-CZ3 3.74Å; W89-W115 HydrophobicContact CG-CZ3 4.27Å; W89-W115 WeakPolarHBondContact CZ2-O 3.36Å; W89-W115 AromaticContact NE1-CE3 3.65Å; W89-W115 AromaticContact NE1-CZ3 3.72Å; W89-L116 HydrophobicContact CH2-CD2 3.6Å; W89-L116 HydrophobicContact CZ2-CD2 3.84Å; W89-P117 HydrophobicContact CD2-CG 4.45Å; W89-P117 HydrophobicContact CE3-CG 4.15Å; W89-P117 HydrophobicContact CZ3-CG 4.31Å; W89-I145 HydrophobicContact CD2-CB 4.2Å; W89-I145 HydrophobicContact CD2-CG2 4.39Å; W89-I145 HydrophobicContact CH2-CG2 3.67Å; W89-I145 HydrophobicContact CZ2-CB 4.03Å; W89-I145 HydrophobicContact CZ2-CD1 4.15Å; W89-I145 HydrophobicContact CZ2-CG2 3.44Å; W89-I145 VanDerWaalsContact CZ2-CG2 3.44Å; W89-I145 HydrophobicContact CZ3-CG2 4.24Å; W89-I145 PolarHBondContact N-O 2.81Å; W89-I145 VanDerWaalsContact N-O 3.17Å; W89-I145 VanDerWaalsContact NE1-CD1 3.3Å; W89-I145 PolarHBondContact O-N 3.05Å; W89-W147 HydrophobicContact CH2-CB 3.74Å; W89-W147 HydrophobicContact CH2-CE3 4.37Å; W89-W147 HydrophobicContact CH2-CG 4.39Å; W89-W147 HydrophobicContact CZ3-CB 3.74Å; W89-W147 HydrophobicContact CZ3-CE3 4.44Å
90	Q	96.1	Very high	94.7	Very high	119 Å²	119	44.9 Å²	44.9	56%	0.556	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.9	179.9	-164.7	169.5	13.3	0	0	110.5	D142 G143	Q90-D142 PolarHBondContact NE2-O 3.11Å; Q90-D142 VanDerWaalsContact NE2-O 3.13Å; Q90-G143 CarbonylContact C-O 3.38Å; Q90-G143 WeakPolarHBondContact CA-O 3.47Å
91	D	96.2	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.			trans	-122.7	110.6	171.4	-168.1	-23.1	0	0	0	109.5	Y44 P50 R93 L94 G143 I145	Y44-D91 PolarHBondContact OH-OD2 2.85Å; P50-D91 HydrophobicContact CB-CB 3.87Å; P50-D91 WeakPolarHBondContact CB-OD1 3.41Å; P50-D91 HydrophobicContact CG-CB 4.35Å; D91-R93 PolarHBondContact O-N 2.79Å; D91-R93 VanDerWaalsContact OD1-CB 3.31Å; D91-R93 WeakPolarHBondContact OD1-CB 3.35Å; D91-R93 IonicContact OD1-CZ 2.73Å; D91-R93 PolarHBondContact OD1-N 2.84Å; D91-R93 IonicContact OD1-NE 2.98Å; D91-R93 PolarHBondContact OD1-NE 2.96Å; D91-R93 IonicContact OD1-NH2 2.91Å; D91-R93 IonicContact OD2-CZ 3.66Å; D91-R93 IonicContact OD2-NE 3.24Å; D91-R93 PolarHBondContact OD2-NE 3Å; D91-R93 IonicContact OD2-NH2 2.58Å; D91-R93 PolarHBondContact OD2-NH2 2.89Å; D91-L94 HydrophobicContact CB-CB 4.49Å; D91-L94 HydrophobicContact CB-CD1 4.5Å; D91-L94 HydrophobicContact CB-CG 4.45Å; D91-L94 PolarHBondContact O-N 3.04Å; D91-G143 PolarHBondContact N-O 2.91Å; D91-G143 WeakPolarHBondContact O-CA 3.5Å; D91-I145 HydrophobicContact CB-CD1 3.52Å
92	Y	93.7	Very high	94.3	Very high	111 Å²	111	50.9 Å²	50.9	44%	0.435	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63.2	-22.8	-178.7	72.1	-89.8	0	0	0	113.1	T52 L94 T95	T52-Y92 HydrophobicContact CG2-CD1 3.93Å; T52-Y92 HydrophobicContact CG2-CE1 4.03Å; T52-Y92 HydrophobicContact CG2-CG 4.2Å; Y92-L94 VanDerWaalsContact C-N 3.34Å; Y92-T95 WeakPolarHBondContact O-CG2 3.49Å; Y92-T95 PolarHBondContact O-OG1 3.34Å
93	R	94	Very high	94.1	Very high	19 Å²	19	51.2 Å²	51.2	7%	0.072	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-77.9	-20.8	-179.2	-56.2	169.3	-65.9	-176	2.7	112.5	Y44 N45 I48 D91 T95	Y44-R93 HydrophobicContact CD2-CB 4.16Å; Y44-R93 HydrophobicContact CE2-CB 4.31Å; N45-R93 PolarHBondContact O-NH1 3.04Å; I48-R93 PolarHBondContact O-NH1 2.73Å; I48-R93 PolarHBondContact O-NH2 3.47Å; I48-R93 VanDerWaalsContact O-NH2 3.14Å; D91-R93 PolarHBondContact O-N 2.79Å; D91-R93 VanDerWaalsContact OD1-CB 3.31Å; D91-R93 WeakPolarHBondContact OD1-CB 3.35Å; D91-R93 IonicContact OD1-CZ 2.73Å; D91-R93 PolarHBondContact OD1-N 2.84Å; D91-R93 IonicContact OD1-NE 2.98Å; D91-R93 PolarHBondContact OD1-NE 2.96Å; D91-R93 IonicContact OD1-NH2 2.91Å; D91-R93 IonicContact OD2-CZ 3.66Å; D91-R93 IonicContact OD2-NE 3.24Å; D91-R93 PolarHBondContact OD2-NE 3Å; D91-R93 IonicContact OD2-NH2 2.58Å; D91-R93 PolarHBondContact OD2-NH2 2.89Å; R93-T95 VanDerWaalsContact C-N 3.32Å
94	L	94.7	Very high	94	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-99.9	41.6	179	-61.8	-178.5	0	0	0	111.4	L38 L39 Y44 D91 Y92 W96 L109 I114 V139 I145	L38-L94 HydrophobicContact CB-CD2 4.14Å; L39-L94 HydrophobicContact CD2-CD2 4.42Å; Y44-L94 HydrophobicContact CD2-CD2 3.8Å; Y44-L94 HydrophobicContact CD2-CG 4.34Å; Y44-L94 HydrophobicContact CE2-CD1 4.08Å; Y44-L94 HydrophobicContact CE2-CD2 3.65Å; Y44-L94 HydrophobicContact CE2-CG 3.74Å; D91-L94 HydrophobicContact CB-CB 4.49Å; D91-L94 HydrophobicContact CB-CD1 4.5Å; D91-L94 HydrophobicContact CB-CG 4.45Å; D91-L94 PolarHBondContact O-N 3.04Å; Y92-L94 VanDerWaalsContact C-N 3.34Å; L94-W96 WeakPolarHBondContact O-CZ3 3.41Å; L94-L109 HydrophobicContact CD1-CD1 4.48Å; L94-I114 HydrophobicContact CD1-CB 4.37Å; L94-I114 HydrophobicContact CD1-CG2 3.81Å; L94-V139 HydrophobicContact CB-CG1 4.02Å; L94-I145 HydrophobicContact CD1-CD1 4.01Å
95	T	94.6	Very high	93.9	Very high	66 Å²	66	53.3 Å²	53.3	41%	0.405	27%	0.274	S	S	.	.			trans	-105.5	146.8	177.5	54.8	0	0	0	0	110.2	Y92 R93	Y92-T95 WeakPolarHBondContact O-CG2 3.49Å; Y92-T95 PolarHBondContact O-OG1 3.34Å; R93-T95 VanDerWaalsContact C-N 3.32Å
96	W	94.2	Very high	94	Very high	20 Å²	20	59.5 Å²	59.5	8%	0.076	30%	0.301	C	S	.	.			trans	-149.8	161.6	174.4	67.6	94.6	0	0	0	111	L34 L38 L94 P98 F101 M104 V107 V139 S140 Y141	L34-W96 HydrophobicContact CD1-CB 3.93Å; L34-W96 HydrophobicContact CD1-CD2 4Å; L34-W96 HydrophobicContact CD1-CG 3.71Å; L34-W96 HydrophobicContact CD2-CD2 4.06Å; L34-W96 HydrophobicContact CD2-CG 4.38Å; L34-W96 HydrophobicContact CD2-CZ2 4.1Å; L38-W96 HydrophobicContact CD1-CE3 3.84Å; L38-W96 HydrophobicContact CD1-CZ3 4.04Å; L38-W96 HydrophobicContact CD2-CE3 4.21Å; L94-W96 WeakPolarHBondContact O-CZ3 3.41Å; W96-P98 WeakPolarHBondContact O-CD 3.44Å; W96-F101 HydrophobicContact CB-CD2 4.34Å; W96-F101 HydrophobicContact CB-CE2 4.29Å; W96-F101 HydrophobicContact CG-CD2 4.46Å; W96-M104 PolarHBondContact NE1-O 2.96Å; W96-V107 HydrophobicContact CH2-CB 4.43Å; W96-V107 HydrophobicContact CH2-CG1 3.72Å; W96-V107 HydrophobicContact CZ2-CG1 4.39Å; W96-V107 HydrophobicContact CZ3-CG1 4.11Å; W96-V139 HydrophobicContact CH2-CG1 4.38Å; W96-V139 HydrophobicContact CZ3-CG1 3.96Å; W96-S140 WeakPolarHBondContact CZ3-O 3.36Å; W96-Y141 PolarHBondContact N-O 3.38Å
97	V	95.2	Very high	94	Very high	70 Å²	70	58.8 Å²	58.8	42%	0.424	30%	0.296	S	S	.	.			trans	-89.5	117.6	174.8	-178.3	0	0	0	0	108.5	E99 E100	V97-E99 HydrophobicContact CG1-CB 4.1Å; V97-E99 HydrophobicContact CG1-CG 4.45Å; V97-E99 PolarHBondContact O-N 3.29Å; V97-E99 VanDerWaalsContact O-N 3.16Å; V97-E100 HydrophobicContact CB-CG 4.18Å; V97-E100 HydrophobicContact CG1-CG 4.42Å; V97-E100 PolarHBondContact O-N 3.21Å; V97-E100 VanDerWaalsContact O-N 3.14Å
98	P	94.3	Very high	94	Very high	23 Å²	23	66.3 Å²	66.3	15%	0.149	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-57.5	-33.1	-177.2	-27.5	35.8	0	0	0	113.5	W96 E100 F101 G103 M105 Y141	W96-P98 WeakPolarHBondContact O-CD 3.44Å; P98-E100 PolarHBondContact O-N 2.85Å; P98-F101 CarbonylContact O-C 3.27Å; P98-F101 PolarHBondContact O-N 2.82Å; P98-F101 VanDerWaalsContact O-N 3.12Å; P98-G103 VanDerWaalsContact O-CA 3.26Å; P98-G103 WeakPolarHBondContact O-CA 3.39Å; P98-G103 PolarHBondContact O-N 2.78Å; P98-M105 HydrophobicContact CB-SD 3.86Å; P98-M105 HydrophobicContact CG-SD 3.7Å; P98-Y141 HydrophobicContact CG-CD2 3.8Å; P98-Y141 HydrophobicContact CG-CG 3.81Å
99	E	93	Very high	93.9	Very high	179 Å²	179	63.9 Å²	63.9	84%	0.836	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.9	-28	-179.2	-59.1	177.8	178.8	0	0	113.1	V97	V97-E99 HydrophobicContact CG1-CB 4.1Å; V97-E99 HydrophobicContact CG1-CG 4.45Å; V97-E99 PolarHBondContact O-N 3.29Å; V97-E99 VanDerWaalsContact O-N 3.16Å
100	E	91.6	Very high	93.8	Very high	125 Å²	125	66.1 Å²	66.1	58%	0.584	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-81.2	-17.7	178.8	-63.2	-177.4	171.9	0	0	113.1	R33 V97 P98	R33-E100 PolarHBondContact NH2-O 2.95Å; V97-E100 HydrophobicContact CB-CG 4.18Å; V97-E100 HydrophobicContact CG1-CG 4.42Å; V97-E100 PolarHBondContact O-N 3.21Å; V97-E100 VanDerWaalsContact O-N 3.14Å; P98-E100 PolarHBondContact O-N 2.85Å
101	F	91.8	Very high	93.7	Very high	13 Å²	13	60.5 Å²	60.5	6%	0.057	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-127.1	49.7	-173.8	-64.3	-85.5	0	0	0	111.2	T30 R33 L34 H37 W96 P98 G103 M104	T30-F101 HydrophobicContact CG2-CB 4.17Å; T30-F101 HydrophobicContact CG2-CD1 4.41Å; R33-F101 HydrophobicContact CG-CE1 4.36Å; L34-F101 HydrophobicContact CB-CD1 3.72Å; L34-F101 HydrophobicContact CB-CE1 3.94Å; L34-F101 HydrophobicContact CB-CG 4.35Å; L34-F101 HydrophobicContact CD1-CD1 3.9Å; L34-F101 HydrophobicContact CD1-CD2 3.88Å; L34-F101 HydrophobicContact CD1-CE1 3.87Å; L34-F101 HydrophobicContact CD1-CE2 3.86Å; L34-F101 HydrophobicContact CD1-CG 3.9Å; L34-F101 HydrophobicContact CD1-CZ 3.85Å; L34-F101 HydrophobicContact CG-CD1 4.35Å; H37-F101 HydrophobicContact CB-CZ 4.28Å; W96-F101 HydrophobicContact CB-CD2 4.34Å; W96-F101 HydrophobicContact CB-CE2 4.29Å; W96-F101 HydrophobicContact CG-CD2 4.46Å; P98-F101 CarbonylContact O-C 3.27Å; P98-F101 PolarHBondContact O-N 2.82Å; P98-F101 VanDerWaalsContact O-N 3.12Å; F101-G103 PolarHBondContact O-N 3.24Å; F101-G103 VanDerWaalsContact O-N 3.15Å; F101-M104 HydrophobicContact CB-CE 3.81Å; F101-M104 WeakPolarHBondContact O-CB 3.43Å; F101-M104 VanDerWaalsContact O-CG 3.29Å; F101-M104 WeakPolarHBondContact O-CG 3.43Å; F101-M104 PolarHBondContact O-N 3.06Å
102	D	90.5	Very high	93.5	Very high	123 Å²	123	66.8 Å²	66.8	66%	0.658	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	33.7	171.4	-148.8	24.6	0	0	0	114.3	T30 M104	T30-D102 HydrophobicContact CG2-CB 4Å; D102-M104 VanDerWaalsContact C-N 3.32Å; D102-M104 PolarHBondContact O-N 3.48Å
103	G	91.6	Very high	93.5	Very high	48 Å²	48	66.8 Å²	66.8	50%	0.495	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	18	179.7	0	0	0	0	0	114.6	P98 F101 M105	P98-G103 VanDerWaalsContact O-CA 3.26Å; P98-G103 WeakPolarHBondContact O-CA 3.39Å; P98-G103 PolarHBondContact O-N 2.78Å; F101-G103 PolarHBondContact O-N 3.24Å; F101-G103 VanDerWaalsContact O-N 3.15Å; G103-M105 PolarHBondContact O-N 3.02Å
104	M	90.6	Very high	93.5	Very high	37 Å²	37	66.1 Å²	66.1	18%	0.182	33%	0.332	C	S	.	.			trans	-67.7	120.8	179.8	-75.6	-165.2	-61.7	0	0	112.2	T30 E31 L34 W96 F101 D102	T30-M104 HydrophobicContact CG2-CE 3.64Å; E31-M104 HydrophobicContact CB-SD 4.28Å; L34-M104 HydrophobicContact CB-CE 3.94Å; L34-M104 HydrophobicContact CD2-CE 3.7Å; L34-M104 HydrophobicContact CG-CE 4.45Å; W96-M104 PolarHBondContact NE1-O 2.96Å; F101-M104 HydrophobicContact CB-CE 3.81Å; F101-M104 WeakPolarHBondContact O-CB 3.43Å; F101-M104 VanDerWaalsContact O-CG 3.29Å; F101-M104 WeakPolarHBondContact O-CG 3.43Å; F101-M104 PolarHBondContact O-N 3.06Å; D102-M104 VanDerWaalsContact C-N 3.32Å; D102-M104 PolarHBondContact O-N 3.48Å
105	M	93.8	Very high	93.5	Very high	91 Å²	91	66.4 Å²	66.4	45%	0.448	33%	0.333	S	S	.	.			trans	-96.9	-23.1	-178.9	-59.7	-60.8	-77.1	0	0	113.6	P98 G103 S140 Y141	P98-M105 HydrophobicContact CB-SD 3.86Å; P98-M105 HydrophobicContact CG-SD 3.7Å; G103-M105 PolarHBondContact O-N 3.02Å; M105-S140 WeakPolarHBondContact O-CA 3.28Å; M105-Y141 HydrophobicContact CB-CD1 4.46Å; M105-Y141 HydrophobicContact CE-CD1 3.49Å; M105-Y141 VanDerWaalsContact CE-CD1 3.49Å; M105-Y141 HydrophobicContact CE-CE1 3.2Å; M105-Y141 HydrophobicContact CE-CG 4.31Å; M105-Y141 PolarHBondContact O-N 3.01Å; M105-Y141 HydrophobicContact SD-CD1 4.11Å; M105-Y141 HydrophobicContact SD-CE1 4.37Å
106	K	94.9	Very high	93.5	Very high	130 Å²	130	65 Å²	65	57%	0.565	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.3	-176.2	-63.2	-173.6	177.1	-173.8	0	110.9	V138 V139	K106-V138 HydrophobicContact CB-CG1 4.31Å; K106-V138 HydrophobicContact CD-CG1 4.06Å; K106-V139 CarbonylContact C-O 3.55Å; K106-V139 VanDerWaalsContact CA-O 3.23Å; K106-V139 WeakPolarHBondContact CA-O 3.5Å
107	V	94.9	Very high	93.5	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	150.9	174.9	66.9	0	0	0	0	109.8	E31 L34 V35 L38 W96 L109 V139	E31-V107 HydrophobicContact CG-CG2 4.02Å; L34-V107 HydrophobicContact CD2-CB 4.24Å; L34-V107 HydrophobicContact CD2-CG1 4.44Å; V35-V107 HydrophobicContact CG2-CG2 3.98Å; L38-V107 HydrophobicContact CD1-CG1 4.34Å; W96-V107 HydrophobicContact CH2-CB 4.43Å; W96-V107 HydrophobicContact CH2-CG1 3.72Å; W96-V107 HydrophobicContact CZ2-CG1 4.39Å; W96-V107 HydrophobicContact CZ3-CG1 4.11Å; V107-L109 HydrophobicContact CG1-CD2 4.4Å; V107-L109 HydrophobicContact CG1-CG 4.21Å; V107-L109 HydrophobicContact CG2-CD2 4.17Å; V107-V139 HydrophobicContact CG1-CB 4.07Å; V107-V139 PolarHBondContact N-O 3.32Å; V107-V139 PolarHBondContact O-N 2.83Å
108	R	95.1	Very high	93.3	Very high	159 Å²	159	62.7 Å²	62.7	60%	0.6	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	111.5	177.8	-70.3	177.5	-177.1	79.5	-0.7	109.8	A137 V138	R108-A137 WeakPolarHBondContact CA-O 3.38Å; R108-V138 HydrophobicContact CG-CG2 4.3Å
109	L	94.8	Very high	93.2	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.4	178.6	-59.5	-178.2	0	0	0	110.2	V35 L39 L94 V107 S111 I114 N136 A137 V139	V35-L109 HydrophobicContact CB-CD2 4.48Å; V35-L109 HydrophobicContact CG1-CD2 4.12Å; V35-L109 HydrophobicContact CG2-CD2 3.75Å; L39-L109 HydrophobicContact CD1-CD2 4.24Å; L39-L109 HydrophobicContact CD2-CD1 4.33Å; L94-L109 HydrophobicContact CD1-CD1 4.48Å; V107-L109 HydrophobicContact CG1-CD2 4.4Å; V107-L109 HydrophobicContact CG1-CG 4.21Å; V107-L109 HydrophobicContact CG2-CD2 4.17Å; L109-S111 PolarHBondContact O-N 3.33Å; L109-I114 HydrophobicContact CB-CG2 4.27Å; L109-I114 HydrophobicContact CD1-CG2 3.94Å; L109-N136 CarbonylContact O-C 3.53Å; L109-N136 WeakPolarHBondContact O-CA 3.34Å; L109-A137 PolarHBondContact N-O 2.96Å; L109-A137 PolarHBondContact O-N 3.3Å; L109-V139 HydrophobicContact CB-CG2 4.49Å; L109-V139 HydrophobicContact CD1-CG2 3.93Å; L109-V139 HydrophobicContact CG-CG2 4.19Å
110	P	94.9	Very high	93.3	Very high	54 Å²	54	54.4 Å²	54.4	35%	0.351	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	128.2	171.1	-14.3	26.6	0	0	0	110.1	K112 H113	P110-K112 PolarHBondContact O-N 3Å; P110-K112 VanDerWaalsContact O-N 3.08Å; P110-H113 PolarHBondContact O-N 2.85Å
111	S	93.4	Very high	93.4	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.014	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-55.7	-31.6	-174.1	48.7	0	0	0	0	113.4	L109 H113 I114 L116 S135	L109-S111 PolarHBondContact O-N 3.33Å; S111-H113 PolarHBondContact O-N 3.34Å; S111-I114 WeakPolarHBondContact O-CG1 3.36Å; S111-I114 PolarHBondContact O-N 2.84Å; S111-L116 WeakPolarHBondContact O-CD1 3.11Å; S111-S135 WeakPolarHBondContact CB-O 3.17Å; S111-S135 PolarHBondContact OG-O 3.12Å
112	K	91.9	Very high	93.3	Very high	132 Å²	132	51.4 Å²	51.4	57%	0.574	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-66.2	-17	179	-65.2	-174.7	176.3	-177.2	0	115.6	K46 P110	K46-K112 WeakPolarHBondContact CD-O 3.42Å; K46-K112 PolarHBondContact NZ-O 2.96Å; P110-K112 PolarHBondContact O-N 3Å; P110-K112 VanDerWaalsContact O-N 3.08Å
113	H	92.8	Very high	93.5	Very high	111 Å²	111	46.9 Å²	46.9	51%	0.514	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-96.8	-12.9	-179.9	-69.6	-68.5	0	0	0	113.4	L39 Y44 P110 S111	L39-H113 HydrophobicContact CD1-CB 4.22Å; Y44-H113 WeakPolarHBondContact CE1-O 3.35Å; P110-H113 PolarHBondContact O-N 2.85Å; S111-H113 PolarHBondContact O-N 3.34Å
114	I	95	Very high	93.6	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-105.8	162.3	176.1	61.7	170.4	0	0	0	110.8	L39 Y44 W89 L94 L109 S111 L116 A137 I145	L39-I114 HydrophobicContact CD2-CG2 4.13Å; Y44-I114 WeakPolarHBondContact OH-CA 3.47Å; W89-I114 HydrophobicContact CZ2-CD1 4.4Å; L94-I114 HydrophobicContact CD1-CB 4.37Å; L94-I114 HydrophobicContact CD1-CG2 3.81Å; L109-I114 HydrophobicContact CB-CG2 4.27Å; L109-I114 HydrophobicContact CD1-CG2 3.94Å; S111-I114 WeakPolarHBondContact O-CG1 3.36Å; S111-I114 PolarHBondContact O-N 2.84Å; I114-L116 HydrophobicContact CD1-CD2 4.16Å; I114-L116 HydrophobicContact CG1-CD2 4.05Å; I114-L116 HydrophobicContact CG1-CG 4.49Å; I114-A137 HydrophobicContact CD1-CB 3.61Å; I114-I145 HydrophobicContact CD1-CG2 4.14Å
115	W	95.5	Very high	93.5	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.019	22%	0.223	C	C	.	.			trans	-67	135.5	167.6	178.9	91.6	0	0	0	109.1	Y44 K46 R49 P50 V58 W89 P117 Y180 I185	Y44-W115 PolarHBondContact OH-N 2.97Å; K46-W115 WeakPolarHBondContact O-CB 3.44Å; K46-W115 VanDerWaalsContact O-CD1 3.25Å; R49-W115 HydrophobicContact CB-CZ2 3.87Å; P50-W115 HydrophobicContact CG-CD2 4.21Å; P50-W115 HydrophobicContact CG-CE3 3.7Å; P50-W115 HydrophobicContact CG-CH2 4.38Å; P50-W115 HydrophobicContact CG-CZ3 3.8Å; V58-W115 HydrophobicContact CG1-CH2 4Å; V58-W115 HydrophobicContact CG1-CZ3 4.19Å; W89-W115 AromaticContact CD1-CZ3 3.74Å; W89-W115 HydrophobicContact CG-CZ3 4.27Å; W89-W115 WeakPolarHBondContact CZ2-O 3.36Å; W89-W115 AromaticContact NE1-CE3 3.65Å; W89-W115 AromaticContact NE1-CZ3 3.72Å; W115-P117 HydrophobicContact CH2-CB 4Å; W115-P117 HydrophobicContact CZ3-CB 4.35Å; W115-P117 HydrophobicContact CZ3-CG 4.5Å; W115-Y180 HydrophobicContact CZ2-CE2 4.15Å; W115-Y180 AromaticContact NE1-CZ 3.94Å; W115-Y180 PolarHBondContact NE1-OH 2.92Å; W115-Y180 VanDerWaalsContact NE1-OH 3.11Å; W115-I185 HydrophobicContact CH2-CD1 3.92Å; W115-I185 HydrophobicContact CZ2-CD1 3.86Å
116	L	94.5	Very high	93	Very high	36 Å²	36	45.9 Å²	45.9	19%	0.188	22%	0.223	C	C	.	.			trans	-129.1	140.9	177.3	-59.4	166.9	0	0	0	108.2	W89 S111 I114 W147	W89-L116 HydrophobicContact CH2-CD2 3.6Å; W89-L116 HydrophobicContact CZ2-CD2 3.84Å; S111-L116 WeakPolarHBondContact O-CD1 3.11Å; I114-L116 HydrophobicContact CD1-CD2 4.16Å; I114-L116 HydrophobicContact CG1-CD2 4.05Å; I114-L116 HydrophobicContact CG1-CG 4.49Å; L116-W147 HydrophobicContact CD1-CH2 4.33Å; L116-W147 HydrophobicContact CD1-CZ2 4.46Å; L116-W147 HydrophobicContact CD2-CD2 4.14Å; L116-W147 HydrophobicContact CD2-CE3 4.12Å; L116-W147 HydrophobicContact CD2-CZ3 4.45Å
117	P	93.8	Very high	92.2	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.032	22%	0.221	C	C	.	.			trans	-68.7	140.2	167.8	30.5	-33.3	0	0	0	109.9	V60 W89 W115 V119 I185	V60-P117 HydrophobicContact CG1-CB 4.45Å; V60-P117 HydrophobicContact CG1-CG 3.96Å; V60-P117 HydrophobicContact CG2-CB 3.96Å; V60-P117 HydrophobicContact CG2-CG 4.06Å; W89-P117 HydrophobicContact CD2-CG 4.45Å; W89-P117 HydrophobicContact CE3-CG 4.15Å; W89-P117 HydrophobicContact CZ3-CG 4.31Å; W115-P117 HydrophobicContact CH2-CB 4Å; W115-P117 HydrophobicContact CZ3-CB 4.35Å; W115-P117 HydrophobicContact CZ3-CG 4.5Å; P117-V119 VanDerWaalsContact C-N 3.26Å; P117-V119 HydrophobicContact CB-CG2 4.22Å; P117-V119 PolarHBondContact O-N 2.89Å; P117-V119 VanDerWaalsContact O-N 3.1Å; P117-I185 HydrophobicContact CB-CD1 4.43Å
118	D	90.7	Very high	91.7	Very high	38 Å²	38	46.7 Å²	46.7	20%	0.203	25%	0.249	C	C	.	.			trans	-90	55.2	-175.8	66.5	-22.3	0	0	0	112.1	V120 S177 W178 T179 Y180	D118-V120 PolarHBondContact O-N 3.19Å; D118-S177 WeakPolarHBondContact O-CA 3.4Å; D118-S177 WeakPolarHBondContact OD1-CB 3.45Å; D118-W178 PolarHBondContact O-N 2.73Å; D118-W178 VanDerWaalsContact O-N 3.14Å; D118-W178 PolarHBondContact OD1-N 3.08Å; D118-W178 WeakPolarHBondContact OD2-CB 3.39Å; D118-W178 PolarHBondContact OD2-N 3.03Å; D118-T179 VanDerWaalsContact CG-OG1 3.31Å; D118-T179 WeakPolarHBondContact OD2-CA 3.45Å; D118-T179 VanDerWaalsContact OD2-CB 3.23Å; D118-T179 WeakPolarHBondContact OD2-CB 3.49Å; D118-T179 VanDerWaalsContact OD2-CG2 3.32Å; D118-T179 WeakPolarHBondContact OD2-CG2 3.4Å; D118-T179 PolarHBondContact OD2-N 2.91Å; D118-T179 PolarHBondContact OD2-OG1 3.18Å; D118-Y180 WeakPolarHBondContact OD1-CD2 3.32Å
119	V	92.9	Very high	90.9	Very high	10 Å²	10	43.2 Å²	43.2	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	114.4	179.2	-174.6	0	0	0	0	109.8	L62 P117 F175 L187	L62-V119 HydrophobicContact CD1-CG1 4.35Å; L62-V119 HydrophobicContact CD1-CG2 4.28Å; L62-V119 HydrophobicContact CD2-CB 4.48Å; L62-V119 HydrophobicContact CD2-CG1 3.91Å; L62-V119 HydrophobicContact CD2-CG2 4.33Å; P117-V119 VanDerWaalsContact C-N 3.26Å; P117-V119 HydrophobicContact CB-CG2 4.22Å; P117-V119 PolarHBondContact O-N 2.89Å; P117-V119 VanDerWaalsContact O-N 3.1Å; V119-F175 HydrophobicContact CG1-CB 3.93Å; V119-F175 HydrophobicContact CG1-CD1 4.24Å; V119-L187 HydrophobicContact CG2-CD2 4.31Å
120	V	93.1	Very high	90.1	Very high	18 Å²	18	49.4 Å²	49.4	11%	0.109	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	159.8	-178.9	-61.1	0	0	0	0	111.7	D118 Y122 Y129 F175 R176 W178	D118-V120 PolarHBondContact O-N 3.19Å; V120-Y122 HydrophobicContact CG2-CD2 4.03Å; V120-Y122 HydrophobicContact CG2-CE2 3.88Å; V120-Y129 HydrophobicContact CB-CD1 4.5Å; V120-F175 WeakPolarHBondContact O-CA 3.47Å; V120-R176 PolarHBondContact N-O 3.1Å; V120-R176 PolarHBondContact O-N 3.15Å; V120-R176 VanDerWaalsContact O-N 3.09Å; V120-W178 HydrophobicContact CG2-CB 3.95Å; V120-W178 HydrophobicContact CG2-CD2 4.44Å; V120-W178 HydrophobicContact CG2-CE3 3.79Å
121	L	93.9	Very high	89.3	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.3	171	-176.9	75.6	0	0	0	109.9	N123 N124 Y129 Y153 L173 R174 F175	L121-N123 WeakPolarHBondContact CD1-OD1 3.47Å; L121-N124 HydrophobicContact CD2-CB 4.22Å; L121-N124 HydrophobicContact CG-CB 4.47Å; L121-N124 WeakPolarHBondContact O-CB 3.19Å; L121-Y129 VanDerWaalsContact O-CD1 3.26Å; L121-Y129 WeakPolarHBondContact O-CD1 3.36Å; L121-Y129 WeakPolarHBondContact O-CE1 3.38Å; L121-Y153 HydrophobicContact CB-CD1 3.95Å; L121-Y153 HydrophobicContact CB-CE1 4.07Å; L121-Y153 HydrophobicContact CD2-CD1 3.9Å; L121-Y153 HydrophobicContact CD2-CG 4.1Å; L121-L173 HydrophobicContact CD1-CB 3.93Å; L121-L173 HydrophobicContact CD1-CD2 3.94Å; L121-L173 HydrophobicContact CD2-CD2 4.38Å; L121-R174 WeakPolarHBondContact CA-O 3.21Å; L121-F175 HydrophobicContact CD1-CE1 4.34Å; L121-F175 HydrophobicContact CD1-CZ 4.42Å
122	Y	91.4	Very high	88.6	Confident	74 Å²	74	51.3 Å²	51.3	29%	0.29	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-40.3	-177.4	-95.7	-102.4	0	0	0	113.4	V120 N124 R174 R176 S177 W178	V120-Y122 HydrophobicContact CG2-CD2 4.03Å; V120-Y122 HydrophobicContact CG2-CE2 3.88Å; Y122-N124 PolarHBondContact O-N 3.02Å; Y122-N124 VanDerWaalsContact O-N 3.08Å; Y122-R174 PolarHBondContact N-O 3.41Å; Y122-R176 HydrophobicContact CD2-CB 3.59Å; Y122-R176 HydrophobicContact CD2-CG 4.13Å; Y122-R176 HydrophobicContact CE2-CB 3.43Å; Y122-R176 VanDerWaalsContact CE2-CB 3.43Å; Y122-R176 HydrophobicContact CE2-CG 3.47Å; Y122-R176 VanDerWaalsContact CE2-CG 3.47Å; Y122-S177 PolarHBondContact OH-O 2.94Å; Y122-S177 VanDerWaalsContact OH-O 3.13Å; Y122-W178 HydrophobicContact CD1-CZ3 4.34Å; Y122-W178 HydrophobicContact CE1-CE3 4.03Å; Y122-W178 AromaticContact CE1-CZ3 3.92Å; Y122-W178 HydrophobicContact CE1-CZ3 3.92Å; Y122-W178 HydrophobicContact CE2-CE3 4.11Å; Y122-W178 AromaticContact CZ-CE3 3.73Å
123	N	94	Very high	88.3	Confident	27 Å²	27	51 Å²	51	14%	0.144	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	42.5	178.6	68.9	-51.2	0	0	0	112	L121 S155 A156 T172 R174	L121-N123 WeakPolarHBondContact CD1-OD1 3.47Å; N123-S155 CarbonylContact O-C 3.54Å; N123-S155 WeakPolarHBondContact O-CA 3.49Å; N123-A156 PolarHBondContact ND2-O 3.45Å; N123-A156 PolarHBondContact O-N 3.09Å; N123-T172 PolarHBondContact ND2-O 2.98Å; N123-R174 WeakPolarHBondContact OD1-CB 3.38Å; N123-R174 PolarHBondContact OD1-N 3.1Å
124	N	92.9	Very high	88.1	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.112	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-75.2	141	177.9	-176.5	10.1	0	0	0	111.5	L121 Y122 D126 V128 Y129 K154	L121-N124 HydrophobicContact CD2-CB 4.22Å; L121-N124 HydrophobicContact CG-CB 4.47Å; L121-N124 WeakPolarHBondContact O-CB 3.19Å; Y122-N124 PolarHBondContact O-N 3.02Å; Y122-N124 VanDerWaalsContact O-N 3.08Å; N124-D126 PolarHBondContact OD1-N 2.88Å; N124-V128 PolarHBondContact ND2-N 2.94Å; N124-V128 PolarHBondContact ND2-O 2.82Å; N124-Y129 HydrophobicContact CB-CD1 4.03Å; N124-Y129 HydrophobicContact CB-CE1 3.63Å; N124-K154 WeakPolarHBondContact CA-O 3.09Å; N124-K154 PolarHBondContact OD1-O 2.88Å
125	A	89.9	Confident	88	Confident	51 Å²	51	49.9 Å²	49.9	42%	0.421	27%	0.272	S	S	.	.	S	Bend	trans	-101.2	-16.2	177.2	0	0	0	0	0	114.2	V78 K154 A156	V78-A125 HydrophobicContact CB-CB 4.47Å; V78-A125 HydrophobicContact CG1-CB 4.04Å; V78-A125 HydrophobicContact CG2-CB 3.61Å; A125-K154 PolarHBondContact N-O 3.48Å; A125-A156 HydrophobicContact CB-CB 4.33Å
126	D	82.8	Confident	88	Confident	84 Å²	84	54 Å²	54	45%	0.449	29%	0.294	S	S	.	.	S	Bend	trans	-97	-10.8	-172	-145.8	24.6	0	0	0	113.9	N124 V128 K154	N124-D126 PolarHBondContact OD1-N 2.88Å; D126-V128 PolarHBondContact O-N 2.9Å; D126-K154 HydrophobicContact CB-CB 4.2Å; D126-K154 HydrophobicContact CB-CD 3.96Å; D126-K154 IonicContact OD1-NZ 3.79Å; D126-K154 PolarHBondContact OD1-NZ 3.11Å; D126-K154 VanDerWaalsContact OD1-NZ 3.09Å; D126-K154 WeakPolarHBondContact OD2-CD 3.09Å; D126-K154 WeakPolarHBondContact OD2-CE 2.79Å; D126-K154 IonicContact OD2-NZ 3.66Å; D126-K154 PolarHBondContact OD2-NZ 3.14Å
127	G	78.1	Confident	88.1	Confident	51 Å²	51	52.2 Å²	52.2	53%	0.526	29%	0.285	S	S	.	.	S	Bend	trans	72.9	-3.6	-175.1	0	0	0	0	0	115.3	Y129	G127-Y129 WeakPolarHBondContact O-CD2 3.45Å
128	V	83.1	Confident	88.2	Confident	96 Å²	96	53.7 Å²	53.7	58%	0.582	29%	0.294	S	S	*	.			trans	-94.9	103.8	173.2	-177.6	0	0	0	0	109.3	N124 D126	N124-V128 PolarHBondContact ND2-N 2.94Å; N124-V128 PolarHBondContact ND2-O 2.82Å; D126-V128 PolarHBondContact O-N 2.9Å
129	Y	79.9	Confident	88.5	Confident	87 Å²	87	51.9 Å²	51.9	34%	0.341	28%	0.284	S	S	.	.			trans	-92.1	-15.5	-175.9	-65.8	-85.6	0	0	0	113.9	V120 L121 N124 G127	V120-Y129 HydrophobicContact CB-CD1 4.5Å; L121-Y129 VanDerWaalsContact O-CD1 3.26Å; L121-Y129 WeakPolarHBondContact O-CD1 3.36Å; L121-Y129 WeakPolarHBondContact O-CE1 3.38Å; N124-Y129 HydrophobicContact CB-CD1 4.03Å; N124-Y129 HydrophobicContact CB-CE1 3.63Å; G127-Y129 WeakPolarHBondContact O-CD2 3.45Å
130	E	77.6	Confident	88.7	Confident	129 Å²	129	52.1 Å²	52.1	60%	0.603	29%	0.287	S	S	*	.	S	Bend	trans	-76	154.7	178.2	-65.5	-170.3	-164	0	0	112.4	Y134	E130-Y134 WeakPolarHBondContact CG-OH 3.37Å; E130-Y134 PolarHBondContact OE2-OH 2.92Å
131	V	78.4	Confident	88.8	Confident	17 Å²	17	56 Å²	56	10%	0.103	30%	0.3	C	S	.	.			trans	-66.9	148	174.1	-67	0	0	0	0	111.4	F133 Y134 W147 P149 A151	V131-F133 VanDerWaalsContact C-N 3.29Å; V131-F133 PolarHBondContact O-N 2.88Å; V131-Y134 HydrophobicContact CG2-CD1 4.01Å; V131-Y134 HydrophobicContact CG2-CD2 4.34Å; V131-Y134 HydrophobicContact CG2-CE1 3.85Å; V131-Y134 HydrophobicContact CG2-CE2 4.21Å; V131-Y134 HydrophobicContact CG2-CG 4.26Å; V131-W147 HydrophobicContact CG2-CH2 3.99Å; V131-W147 HydrophobicContact CG2-CZ2 4.12Å; V131-P149 HydrophobicContact CB-CB 4.11Å; V131-P149 HydrophobicContact CG1-CB 4.16Å; V131-P149 HydrophobicContact CG1-CG 4.05Å; V131-P149 HydrophobicContact CG2-CB 4.12Å; V131-A151 HydrophobicContact CG1-CB 4.47Å
132	S	77.3	Confident	88.9	Confident	79 Å²	79	59.2 Å²	59.2	55%	0.552	32%	0.317	S	S	*	.	S	Bend	trans	-65.3	-31.1	-175.4	-51	0	0	0	0	113.3	I152	S132-I152 PolarHBondContact OG-N 2.85Å; S132-I152 VanDerWaalsContact OG-N 3.13Å
133	F	86.2	Confident	89	Confident	127 Å²	127	55.7 Å²	55.7	56%	0.557	30%	0.303	S	S	*	.			trans	-145.2	122.9	179.1	-177.2	-101.8	0	0	0	111.3	V131 S135 P150	V131-F133 VanDerWaalsContact C-N 3.29Å; V131-F133 PolarHBondContact O-N 2.88Å; F133-S135 PolarHBondContact O-N 3.3Å; F133-S135 VanDerWaalsContact O-N 3.1Å; F133-P150 HydrophobicContact CB-CG 4.05Å; F133-P150 HydrophobicContact CD1-CG 4.34Å
134	Y	88.4	Confident	89.1	Confident	72 Å²	72	55.5 Å²	55.5	28%	0.282	30%	0.304	S	S	.	.			trans	-80.6	87.6	173.4	-70.6	-88.8	0	0	0	109.7	E130 V131 W147	E130-Y134 WeakPolarHBondContact CG-OH 3.37Å; E130-Y134 PolarHBondContact OE2-OH 2.92Å; V131-Y134 HydrophobicContact CG2-CD1 4.01Å; V131-Y134 HydrophobicContact CG2-CD2 4.34Å; V131-Y134 HydrophobicContact CG2-CE1 3.85Å; V131-Y134 HydrophobicContact CG2-CE2 4.21Å; V131-Y134 HydrophobicContact CG2-CG 4.26Å; Y134-W147 HydrophobicContact CD1-CH2 4.41Å; Y134-W147 HydrophobicContact CD1-CZ2 4.02Å
135	S	92.6	Very high	89.3	Confident	19 Å²	19	54.5 Å²	54.5	13%	0.133	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-68	161.8	173.5	57.5	0	0	0	0	111.7	S111 F133 W147 L148	S111-S135 WeakPolarHBondContact CB-O 3.17Å; S111-S135 PolarHBondContact OG-O 3.12Å; F133-S135 PolarHBondContact O-N 3.3Å; F133-S135 VanDerWaalsContact O-N 3.1Å; S135-W147 PolarHBondContact O-NE1 3.4Å; S135-W147 VanDerWaalsContact O-NE1 3.15Å; S135-W147 PolarHBondContact OG-NE1 3.45Å; S135-L148 PolarHBondContact OG-O 2.92Å; S135-L148 VanDerWaalsContact OG-O 3.1Å
136	N	95.6	Very high	89.7	Confident	91 Å²	91	55.4 Å²	55.4	49%	0.487	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	141.9	170.2	-67.2	-5.2	0	0	0	109.7	L109	L109-N136 CarbonylContact O-C 3.53Å; L109-N136 WeakPolarHBondContact O-CA 3.34Å
137	A	96.4	Very high	90.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	144.8	171.4	0	0	0	0	0	109.7	R108 L109 I114 I145 W147	R108-A137 WeakPolarHBondContact CA-O 3.38Å; L109-A137 PolarHBondContact N-O 2.96Å; L109-A137 PolarHBondContact O-N 3.3Å; I114-A137 HydrophobicContact CD1-CB 3.61Å; A137-I145 HydrophobicContact CB-CG2 3.99Å; A137-W147 HydrophobicContact CB-CB 4.24Å; A137-W147 HydrophobicContact CB-CG 4.36Å
138	V	96.9	Very high	91.1	Very high	35 Å²	35	52 Å²	52	21%	0.212	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.9	174	-176.5	0	0	0	0	107.3	K106 R108 F146	K106-V138 HydrophobicContact CB-CG1 4.31Å; K106-V138 HydrophobicContact CD-CG1 4.06Å; R108-V138 HydrophobicContact CG-CG2 4.3Å; V138-F146 PolarHBondContact N-O 3.34Å; V138-F146 PolarHBondContact O-N 3.14Å
139	V	96.9	Very high	91.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.7	177	-170.2	0	0	0	0	108.1	L94 W96 K106 V107 L109 I145	L94-V139 HydrophobicContact CB-CG1 4.02Å; W96-V139 HydrophobicContact CH2-CG1 4.38Å; W96-V139 HydrophobicContact CZ3-CG1 3.96Å; K106-V139 CarbonylContact C-O 3.55Å; K106-V139 VanDerWaalsContact CA-O 3.23Å; K106-V139 WeakPolarHBondContact CA-O 3.5Å; V107-V139 HydrophobicContact CG1-CB 4.07Å; V107-V139 PolarHBondContact N-O 3.32Å; V107-V139 PolarHBondContact O-N 2.83Å; L109-V139 HydrophobicContact CB-CG2 4.49Å; L109-V139 HydrophobicContact CD1-CG2 3.93Å; L109-V139 HydrophobicContact CG-CG2 4.19Å; V139-I145 HydrophobicContact CG1-CG1 4.02Å; V139-I145 HydrophobicContact CG2-CG1 4.1Å; V139-I145 HydrophobicContact CG2-CG2 4.46Å
140	S	97.1	Very high	92.2	Very high	16 Å²	16	44.9 Å²	44.9	11%	0.112	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	159.8	173.6	-50.2	0	0	0	0	110.9	W96 M105 D142 G143 S144	W96-S140 WeakPolarHBondContact CZ3-O 3.36Å; M105-S140 WeakPolarHBondContact O-CA 3.28Å; S140-D142 WeakPolarHBondContact CB-OD1 3.33Å; S140-D142 PolarHBondContact O-N 3.2Å; S140-D142 VanDerWaalsContact O-N 3.1Å; S140-G143 PolarHBondContact O-N 2.76Å; S140-S144 VanDerWaalsContact CB-OG 3.26Å; S140-S144 WeakPolarHBondContact CB-OG 3.31Å; S140-S144 PolarHBondContact N-O 3.31Å; S140-S144 PolarHBondContact OG-OG 3.01Å
141	Y	95.3	Very high	92.9	Very high	99 Å²	99	38.8 Å²	38.8	39%	0.388	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.3	-174.9	75.7	-79.1	0	0	0	115	W96 P98 M105 G143	W96-Y141 PolarHBondContact N-O 3.38Å; P98-Y141 HydrophobicContact CG-CD2 3.8Å; P98-Y141 HydrophobicContact CG-CG 3.81Å; M105-Y141 HydrophobicContact CB-CD1 4.46Å; M105-Y141 HydrophobicContact CE-CD1 3.49Å; M105-Y141 VanDerWaalsContact CE-CD1 3.49Å; M105-Y141 HydrophobicContact CE-CE1 3.2Å; M105-Y141 HydrophobicContact CE-CG 4.31Å; M105-Y141 PolarHBondContact O-N 3.01Å; M105-Y141 HydrophobicContact SD-CD1 4.11Å; M105-Y141 HydrophobicContact SD-CE1 4.37Å; Y141-G143 PolarHBondContact O-N 3.19Å
142	D	95.4	Very high	93.6	Very high	68 Å²	68	42.2 Å²	42.2	36%	0.364	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.7	177.6	67.8	-23	0	0	0	113.6	Q90 S140 S144	Q90-D142 PolarHBondContact NE2-O 3.11Å; Q90-D142 VanDerWaalsContact NE2-O 3.13Å; S140-D142 WeakPolarHBondContact CB-OD1 3.33Å; S140-D142 PolarHBondContact O-N 3.2Å; S140-D142 VanDerWaalsContact O-N 3.1Å; D142-S144 VanDerWaalsContact C-N 3.31Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 3.06Å; D142-S144 VanDerWaalsContact OD1-N 3.12Å; D142-S144 PolarHBondContact OD1-OG 2.91Å; D142-S144 PolarHBondContact OD2-OG 2.94Å
143	G	94.2	Very high	94.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	82.5	5.7	-178.5	0	0	0	0	0	113.7	Q90 D91 S140 Y141 I145	Q90-G143 CarbonylContact C-O 3.38Å; Q90-G143 WeakPolarHBondContact CA-O 3.47Å; D91-G143 PolarHBondContact N-O 2.91Å; D91-G143 WeakPolarHBondContact O-CA 3.5Å; S140-G143 PolarHBondContact O-N 2.76Å; Y141-G143 PolarHBondContact O-N 3.19Å; G143-I145 PolarHBondContact O-N 3.14Å
144	S	96.6	Very high	94.8	Very high	23 Å²	23	36.3 Å²	36.3	16%	0.161	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.6	172.4	62.4	0	0	0	0	110.3	S140 D142	S140-S144 VanDerWaalsContact CB-OG 3.26Å; S140-S144 WeakPolarHBondContact CB-OG 3.31Å; S140-S144 PolarHBondContact N-O 3.31Å; S140-S144 PolarHBondContact OG-OG 3.01Å; D142-S144 VanDerWaalsContact C-N 3.31Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 3.06Å; D142-S144 VanDerWaalsContact OD1-N 3.12Å; D142-S144 PolarHBondContact OD1-OG 2.91Å; D142-S144 PolarHBondContact OD2-OG 2.94Å
145	I	97.4	Very high	95.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.8	-178.5	-59.8	162	0	0	0	108.2	E88 W89 D91 L94 I114 A137 V139 G143	E88-I145 VanDerWaalsContact CA-O 3.3Å; E88-I145 WeakPolarHBondContact CA-O 3.5Å; W89-I145 HydrophobicContact CD2-CB 4.2Å; W89-I145 HydrophobicContact CD2-CG2 4.39Å; W89-I145 HydrophobicContact CH2-CG2 3.67Å; W89-I145 HydrophobicContact CZ2-CB 4.03Å; W89-I145 HydrophobicContact CZ2-CD1 4.15Å; W89-I145 HydrophobicContact CZ2-CG2 3.44Å; W89-I145 VanDerWaalsContact CZ2-CG2 3.44Å; W89-I145 HydrophobicContact CZ3-CG2 4.24Å; W89-I145 PolarHBondContact N-O 2.81Å; W89-I145 VanDerWaalsContact N-O 3.17Å; W89-I145 VanDerWaalsContact NE1-CD1 3.3Å; W89-I145 PolarHBondContact O-N 3.05Å; D91-I145 HydrophobicContact CB-CD1 3.52Å; L94-I145 HydrophobicContact CD1-CD1 4.01Å; I114-I145 HydrophobicContact CD1-CG2 4.14Å; A137-I145 HydrophobicContact CB-CG2 3.99Å; V139-I145 HydrophobicContact CG1-CG1 4.02Å; V139-I145 HydrophobicContact CG2-CG1 4.1Å; V139-I145 HydrophobicContact CG2-CG2 4.46Å; G143-I145 PolarHBondContact O-N 3.14Å
146	F	96.9	Very high	95.2	Very high	71 Å²	71	34.3 Å²	34.3	31%	0.311	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.5	174.4	178.3	-91.7	0	0	0	109.6	T86 V138 L148	T86-F146 HydrophobicContact CG2-CD2 4.08Å; T86-F146 HydrophobicContact CG2-CE2 3.31Å; T86-F146 HydrophobicContact CG2-CZ 3.87Å; V138-F146 PolarHBondContact N-O 3.34Å; V138-F146 PolarHBondContact O-N 3.14Å; F146-L148 HydrophobicContact CE1-CB 3.81Å; F146-L148 HydrophobicContact CE1-CD2 4.43Å; F146-L148 HydrophobicContact CZ-CB 4.13Å; F146-L148 HydrophobicContact CZ-CD2 4.38Å
147	W	96.1	Very high	95.1	Very high	9 Å²	9	30.2 Å²	30.2	3%	0.034	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.8	178.1	-172.7	47.7	0	0	0	110.8	Q87 W89 L116 V131 Y134 S135 A137 P149	Q87-W147 HydrophobicContact CB-CE3 4.47Å; Q87-W147 PolarHBondContact N-O 3.01Å; Q87-W147 PolarHBondContact O-N 3.13Å; W89-W147 HydrophobicContact CH2-CB 3.74Å; W89-W147 HydrophobicContact CH2-CE3 4.37Å; W89-W147 HydrophobicContact CH2-CG 4.39Å; W89-W147 HydrophobicContact CZ3-CB 3.74Å; W89-W147 HydrophobicContact CZ3-CE3 4.44Å; L116-W147 HydrophobicContact CD1-CH2 4.33Å; L116-W147 HydrophobicContact CD1-CZ2 4.46Å; L116-W147 HydrophobicContact CD2-CD2 4.14Å; L116-W147 HydrophobicContact CD2-CE3 4.12Å; L116-W147 HydrophobicContact CD2-CZ3 4.45Å; V131-W147 HydrophobicContact CG2-CH2 3.99Å; V131-W147 HydrophobicContact CG2-CZ2 4.12Å; Y134-W147 HydrophobicContact CD1-CH2 4.41Å; Y134-W147 HydrophobicContact CD1-CZ2 4.02Å; S135-W147 PolarHBondContact O-NE1 3.4Å; S135-W147 VanDerWaalsContact O-NE1 3.15Å; S135-W147 PolarHBondContact OG-NE1 3.45Å; A137-W147 HydrophobicContact CB-CB 4.24Å; A137-W147 HydrophobicContact CB-CG 4.36Å; W147-P149 HydrophobicContact CD2-CG 4.03Å; W147-P149 HydrophobicContact CE3-CG 4.12Å; W147-P149 HydrophobicContact CH2-CB 4.3Å; W147-P149 HydrophobicContact CH2-CG 3.85Å; W147-P149 HydrophobicContact CZ2-CB 3.81Å; W147-P149 HydrophobicContact CZ2-CG 3.74Å; W147-P149 HydrophobicContact CZ3-CG 4.04Å
148	L	94.1	Very high	94.9	Very high	55 Å²	55	36.3 Å²	36.3	29%	0.288	19%	0.185	S	C	.	.			trans	-131.6	77.8	-176.7	-170.9	70.5	0	0	0	110.1	W84 T86 S135 F146	W84-L148 HydrophobicContact CB-CD1 3.85Å; W84-L148 HydrophobicContact CB-CG 4.34Å; W84-L148 HydrophobicContact CE3-CD2 4.34Å; W84-L148 HydrophobicContact CE3-CG 4.22Å; T86-L148 HydrophobicContact CG2-CD1 4.4Å; T86-L148 WeakPolarHBondContact OG1-CD1 3.35Å; S135-L148 PolarHBondContact OG-O 2.92Å; S135-L148 VanDerWaalsContact OG-O 3.1Å; F146-L148 HydrophobicContact CE1-CB 3.81Å; F146-L148 HydrophobicContact CE1-CD2 4.43Å; F146-L148 HydrophobicContact CZ-CB 4.13Å; F146-L148 HydrophobicContact CZ-CD2 4.38Å
149	P	93.8	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.			trans	-74.2	134.2	171.4	29	-35.8	0	0	0	111.1	L85 V131 W147	L85-P149 PolarHBondContact N-O 2.58Å; L85-P149 VanDerWaalsContact O-CD 3.31Å; L85-P149 WeakPolarHBondContact O-CD 3.25Å; V131-P149 HydrophobicContact CB-CB 4.11Å; V131-P149 HydrophobicContact CG1-CB 4.16Å; V131-P149 HydrophobicContact CG1-CG 4.05Å; V131-P149 HydrophobicContact CG2-CB 4.12Å; W147-P149 HydrophobicContact CD2-CG 4.03Å; W147-P149 HydrophobicContact CE3-CG 4.12Å; W147-P149 HydrophobicContact CH2-CB 4.3Å; W147-P149 HydrophobicContact CH2-CG 3.85Å; W147-P149 HydrophobicContact CZ2-CB 3.81Å; W147-P149 HydrophobicContact CZ2-CG 3.74Å; W147-P149 HydrophobicContact CZ3-CG 4.04Å
150	P	92.9	Very high	94.4	Very high	33 Å²	33	41.4 Å²	41.4	21%	0.214	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.5	163	27.2	-27.7	0	0	0	109.7	W84 F133	W84-P150 HydrophobicContact CE3-CB 3.84Å; W84-P150 HydrophobicContact CH2-CB 4.09Å; W84-P150 HydrophobicContact CZ3-CB 3.55Å; W84-P150 HydrophobicContact CZ3-CG 3.98Å; F133-P150 HydrophobicContact CB-CG 4.05Å; F133-P150 HydrophobicContact CD1-CG 4.34Å
151	A	91.8	Very high	94.1	Very high	1 Å²	1	41 Å²	41	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.8	179.2	0	0	0	0	0	111.7	V83 V131 Y153	V83-A151 PolarHBondContact N-O 2.82Å; V83-A151 PolarHBondContact O-N 2.73Å; V131-A151 HydrophobicContact CG1-CB 4.47Å; A151-Y153 HydrophobicContact CB-CD2 4.11Å; A151-Y153 HydrophobicContact CB-CE1 4.21Å; A151-Y153 HydrophobicContact CB-CE2 3.54Å
152	I	93.4	Very high	93.6	Very high	88 Å²	88	40.2 Å²	40.2	45%	0.451	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	107.9	166.3	-60	172.3	0	0	0	107.3	I70 T80 T81 S132	I70-I152 HydrophobicContact CD1-CG2 4.07Å; T80-I152 HydrophobicContact CG2-CG2 3.71Å; T81-I152 WeakPolarHBondContact O-CA 3.12Å; S132-I152 PolarHBondContact OG-N 2.85Å; S132-I152 VanDerWaalsContact OG-N 3.13Å
153	Y	93.8	Very high	93.3	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.039	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.7	178.3	-73.5	-56.6	0	0	0	111.2	T80 T81 V83 L121 A151 F175	T80-Y153 WeakPolarHBondContact CA-O 3.35Å; T81-Y153 PolarHBondContact N-O 2.82Å; T81-Y153 PolarHBondContact O-N 3.26Å; V83-Y153 HydrophobicContact CG2-CD2 3.38Å; V83-Y153 HydrophobicContact CG2-CE2 3.53Å; L121-Y153 HydrophobicContact CB-CD1 3.95Å; L121-Y153 HydrophobicContact CB-CE1 4.07Å; L121-Y153 HydrophobicContact CD2-CD1 3.9Å; L121-Y153 HydrophobicContact CD2-CG 4.1Å; A151-Y153 HydrophobicContact CB-CD2 4.11Å; A151-Y153 HydrophobicContact CB-CE1 4.21Å; A151-Y153 HydrophobicContact CB-CE2 3.54Å; Y153-F175 HydrophobicContact CD2-CE1 4.17Å; Y153-F175 HydrophobicContact CD2-CZ 4.03Å; Y153-F175 HydrophobicContact CE1-CE1 4.43Å; Y153-F175 AromaticContact CE2-CE1 3.56Å; Y153-F175 HydrophobicContact CE2-CE1 3.56Å; Y153-F175 AromaticContact CE2-CZ 3.74Å; Y153-F175 HydrophobicContact CE2-CZ 3.74Å; Y153-F175 AromaticContact CZ-CE1 3.72Å
154	K	94.9	Very high	93	Very high	72 Å²	72	40.1 Å²	40.1	31%	0.313	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	102.1	167.4	-66.8	-171.9	-165.1	156.2	0	108.9	V78 M79 T80 N124 A125 D126	V78-K154 HydrophobicContact CG1-CB 3.89Å; V78-K154 HydrophobicContact CG1-CG 4.44Å; M79-K154 CarbonylContact O-C 3.57Å; M79-K154 WeakPolarHBondContact O-CA 3.42Å; T80-K154 HydrophobicContact CG2-CG 4.11Å; N124-K154 WeakPolarHBondContact CA-O 3.09Å; N124-K154 PolarHBondContact OD1-O 2.88Å; A125-K154 PolarHBondContact N-O 3.48Å; D126-K154 HydrophobicContact CB-CB 4.2Å; D126-K154 HydrophobicContact CB-CD 3.96Å; D126-K154 IonicContact OD1-NZ 3.79Å; D126-K154 PolarHBondContact OD1-NZ 3.11Å; D126-K154 VanDerWaalsContact OD1-NZ 3.09Å; D126-K154 WeakPolarHBondContact OD2-CD 3.09Å; D126-K154 WeakPolarHBondContact OD2-CE 2.79Å; D126-K154 IonicContact OD2-NZ 3.66Å; D126-K154 PolarHBondContact OD2-NZ 3.14Å
155	S	95.4	Very high	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140	-178.9	60.2	0	0	0	0	111.5	V78 M79 N123 C157 L173	V78-S155 CarbonylContact C-O 3.58Å; V78-S155 WeakPolarHBondContact CA-O 3.33Å; M79-S155 WeakPolarHBondContact CE-OG 3.23Å; M79-S155 PolarHBondContact N-O 3.35Å; M79-S155 PolarHBondContact O-N 3.26Å; M79-S155 PolarHBondContact O-OG 3.17Å; N123-S155 CarbonylContact O-C 3.54Å; N123-S155 WeakPolarHBondContact O-CA 3.49Å; S155-C157 PolarHBondContact O-N 2.95Å; S155-L173 WeakPolarHBondContact OG-CD2 3.4Å
156	A	94.9	Very high	92.2	Very high	49 Å²	49	43.5 Å²	43.5	41%	0.405	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	122.1	167.3	0	0	0	0	0	108.8	N123 A125	N123-A156 PolarHBondContact ND2-O 3.45Å; N123-A156 PolarHBondContact O-N 3.09Å; A125-A156 HydrophobicContact CB-CB 4.33Å
157	C	93.7	Very high	91.9	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.041	20%	0.198	C	C	.	.			trans	-134.3	126	179.6	172.2	0	0	0	0	110.5	Q77 M79 S155 I159 C171	Q77-C157 CarbonylContact C-O 3.57Å; Q77-C157 WeakPolarHBondContact CB-O 3.21Å; Q77-C157 PolarHBondContact O-N 3.09Å; M79-C157 HydrophobicContact CB-CB 4.41Å; S155-C157 PolarHBondContact O-N 2.95Å; C157-I159 PolarHBondContact O-N 3.1Å; C157-C171 HydrophobicContact CB-CB 3.63Å; C157-C171 WeakPolarHBondContact CB-SG 3.44Å; C157-C171 WeakPolarHBondContact SG-CA 3.31Å; C157-C171 WeakPolarHBondContact SG-CB 3.45Å; C157-C171 CovalentContact SG-SG 2.03Å; C157-C171 PolarHBondContact SG-SG 2.84Å
158	K	91.9	Very high	91.7	Very high	127 Å²	127	44.2 Å²	44.2	55%	0.552	22%	0.217	S	C	*	.			trans	-74	123.2	174.7	-177.4	-176.2	173.9	-172.4	0	110.1
159	I	92.1	Very high	91.7	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.036	20%	0.203	C	C	.	.			trans	-95.5	129.9	-178.9	-54.3	-58.7	0	0	0	111	V72 E74 C157 V161	V72-I159 HydrophobicContact CG1-CD1 3.98Å; E74-I159 HydrophobicContact CB-CG2 4.35Å; E74-I159 HydrophobicContact CG-CG2 4.34Å; C157-I159 PolarHBondContact O-N 3.1Å; I159-V161 HydrophobicContact CG2-CG1 3.89Å
160	E	90.5	Very high	91.8	Very high	136 Å²	136	46 Å²	46	64%	0.636	23%	0.227	S	C	*	.			trans	-95.5	107.9	175.9	-64.7	-171.4	176.9	0	0	111	Q169	E160-Q169 PolarHBondContact O-NE2 3.22Å
161	V	90.3	Very high	92	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.042	22%	0.217	C	C	.	.			trans	-98.7	4	-168.6	-59.9	0	0	0	0	114.3	I159 H163 F164 V289 P290 P297	I159-V161 HydrophobicContact CG2-CG1 3.89Å; V161-H163 VanDerWaalsContact C-N 3.31Å; V161-H163 PolarHBondContact O-N 3.43Å; V161-F164 WeakPolarHBondContact O-CB 3.41Å; V161-F164 PolarHBondContact O-N 3.04Å; V161-V289 HydrophobicContact CB-CG1 3.96Å; V161-V289 HydrophobicContact CG1-CG1 3.82Å; V161-V289 HydrophobicContact CG2-CG1 3.96Å; V161-P290 HydrophobicContact CG1-CG 3.9Å; V161-P297 WeakPolarHBondContact O-CA 3.49Å; V161-P297 WeakPolarHBondContact O-CB 3.44Å
162	K	86.6	Confident	92.2	Very high	83 Å²	83	46.4 Å²	46.4	36%	0.361	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-43.3	-172.5	-176.5	174.5	176.2	172.7	0	113.2	L298	K162-L298 PolarHBondContact O-N 3.22Å
163	H	87.3	Confident	92.3	Very high	57 Å²	57	42.2 Å²	42.2	26%	0.264	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	20	-175.7	-56.8	115.4	0	0	0	113.9	V161 F166 Q488	V161-H163 VanDerWaalsContact C-N 3.31Å; V161-H163 PolarHBondContact O-N 3.43Å; H163-F166 CarbonylContact O-C 3.6Å; H163-F166 WeakPolarHBondContact O-CA 3.45Å; H163-F166 PolarHBondContact O-N 2.86Å; H163-Q488 PolarHBondContact CE1-OE1 3.25Å; H163-Q488 PolarHBondContact NE2-OE1 3.44Å; H163-Q488 VanDerWaalsContact NE2-OE1 3.08Å
164	F	88.1	Confident	92.3	Very high	9 Å²	9	46.1 Å²	46.1	4%	0.039	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	133.5	177.5	-179.9	-91.3	0	0	0	112	V161 Y239 I285 I288 P297	V161-F164 WeakPolarHBondContact O-CB 3.41Å; V161-F164 PolarHBondContact O-N 3.04Å; F164-Y239 HydrophobicContact CE1-CD1 4.24Å; F164-Y239 HydrophobicContact CE2-CE1 4.44Å; F164-Y239 AromaticContact CZ-CD1 3.63Å; F164-Y239 HydrophobicContact CZ-CD1 3.63Å; F164-Y239 HydrophobicContact CZ-CD2 4.47Å; F164-Y239 AromaticContact CZ-CE1 3.73Å; F164-Y239 HydrophobicContact CZ-CE1 3.73Å; F164-Y239 HydrophobicContact CZ-CG 4.01Å; F164-I285 HydrophobicContact CD1-CD1 4.06Å; F164-I285 HydrophobicContact CE1-CD1 3.71Å; F164-I285 HydrophobicContact CZ-CD1 4.49Å; F164-I288 HydrophobicContact CZ-CG2 4.23Å; F164-P297 HydrophobicContact CB-CB 4.32Å
165	P	90.1	Very high	92.3	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.3	15.9	1	39.4	-37.7	0	0	0	114.5	D167 R234 P236 Y239 I244	P165-D167 VanDerWaalsContact C-N 3.26Å; P165-D167 WeakPolarHBondContact CA-OD1 3.47Å; P165-D167 PolarHBondContact O-N 3.4Å; P165-R234 WeakPolarHBondContact O-CD 3.27Å; P165-P236 HydrophobicContact CG-CB 4.28Å; P165-Y239 HydrophobicContact CB-CD2 4.07Å; P165-Y239 HydrophobicContact CB-CG 4.02Å; P165-I244 HydrophobicContact CG-CD1 4.04Å
166	F	88.8	Confident	92.2	Very high	92 Å²	92	44.1 Å²	44.1	40%	0.404	21%	0.212	S	C	.	.	S	Bend	trans	-96.4	34.4	178.5	-53.9	-74.3	0	0	0	111.6	H163 P236 I244	H163-F166 CarbonylContact O-C 3.6Å; H163-F166 WeakPolarHBondContact O-CA 3.45Å; H163-F166 PolarHBondContact O-N 2.86Å; F166-P236 HydrophobicContact CD1-CB 3.59Å; F166-P236 HydrophobicContact CD1-CG 3.78Å; F166-P236 HydrophobicContact CE1-CB 3.47Å; F166-P236 VanDerWaalsContact CE1-CB 3.47Å; F166-P236 HydrophobicContact CE1-CG 3.67Å; F166-P236 HydrophobicContact CZ-CB 4.35Å; F166-I244 HydrophobicContact CE2-CD1 3.95Å; F166-I244 HydrophobicContact CZ-CD1 4.18Å
167	D	89.9	Confident	92.1	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.027	20%	0.195	C	C	.	.			trans	-86	152	-172.3	52.8	-52.2	0	0	0	112.8	P165 Q169 R234	P165-D167 VanDerWaalsContact C-N 3.26Å; P165-D167 WeakPolarHBondContact CA-OD1 3.47Å; P165-D167 PolarHBondContact O-N 3.4Å; D167-Q169 PolarHBondContact OD2-NE2 3Å; D167-R234 PolarHBondContact O-N 3.32Å; D167-R234 IonicContact OD1-NE 3.23Å; D167-R234 PolarHBondContact OD1-NE 3.29Å; D167-R234 IonicContact OD2-CZ 2.65Å; D167-R234 IonicContact OD2-NE 3.5Å; D167-R234 IonicContact OD2-NH2 2.88Å; D167-R234 PolarHBondContact OD2-NH2 3.21Å
168	Q	91.9	Very high	92	Very high	90 Å²	90	48.8 Å²	48.8	42%	0.421	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.1	163.7	-67	-178.3	17.4	0	0	107.3	I208 I232 R233	Q168-I208 HydrophobicContact CG-CD1 4.32Å; Q168-I232 CarbonylContact C-O 3.55Å; Q168-I232 WeakPolarHBondContact CA-O 3.35Å; Q168-R233 HydrophobicContact CG-CB 4.32Å; Q168-R233 HydrophobicContact CG-CG 4.29Å
169	Q	94.5	Very high	92	Very high	3 Å²	3	47 Å²	47	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.3	179.2	-55.8	-59.7	-24.2	0	0	109.4	E160 D167 W205 I231 I232	E160-Q169 PolarHBondContact O-NE2 3.22Å; D167-Q169 PolarHBondContact OD2-NE2 3Å; Q169-W205 HydrophobicContact CB-CZ3 4.49Å; Q169-W205 HydrophobicContact CG-CH2 3.79Å; Q169-W205 HydrophobicContact CG-CZ3 3.82Å; Q169-I231 WeakPolarHBondContact O-CA 3.32Å; Q169-I232 HydrophobicContact CB-CD1 4.2Å; Q169-I232 HydrophobicContact CB-CG1 3.76Å; Q169-I232 PolarHBondContact N-O 3.05Å; Q169-I232 PolarHBondContact O-N 2.91Å
170	N	95.4	Very high	91.9	Very high	91 Å²	91	48.6 Å²	48.6	49%	0.487	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	96.5	173.3	-173.3	2.8	0	0	0	108.6	F230	N170-F230 WeakPolarHBondContact CA-O 3.45Å
171	C	96.1	Very high	91.9	Very high	1 Å²	1	45 Å²	45	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	151.7	177.3	-67.6	0	0	0	0	110.5	M79 C157 D229 F230	M79-C171 HydrophobicContact CE-CB 3.76Å; M79-C171 HydrophobicContact SD-CB 3.56Å; M79-C171 VanDerWaalsContact SD-CB 3.56Å; C157-C171 HydrophobicContact CB-CB 3.63Å; C157-C171 WeakPolarHBondContact CB-SG 3.44Å; C157-C171 WeakPolarHBondContact SG-CA 3.31Å; C157-C171 WeakPolarHBondContact SG-CB 3.45Å; C157-C171 CovalentContact SG-SG 2.03Å; C157-C171 PolarHBondContact SG-SG 2.84Å; C171-D229 CarbonylContact O-C 3.57Å; C171-F230 HydrophobicContact CB-CB 4.19Å; C171-F230 PolarHBondContact N-O 3.22Å; C171-F230 WeakPolarHBondContact O-CA 3.37Å; C171-F230 WeakPolarHBondContact O-CB 3.49Å; C171-F230 PolarHBondContact O-N 2.73Å
172	T	96.2	Very high	91.9	Very high	40 Å²	40	48.5 Å²	48.5	25%	0.245	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.8	-176.3	62.9	0	0	0	0	111.1	N123 T227 Y228 D229	N123-T172 PolarHBondContact ND2-O 2.98Å; T172-T227 HydrophobicContact CG2-CG2 4.25Å; T172-Y228 CarbonylContact C-O 3.59Å; T172-Y228 WeakPolarHBondContact CA-O 3.38Å; T172-D229 WeakPolarHBondContact CG2-OD1 3.35Å
173	L	95.4	Very high	92	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.6	164.3	-63.2	-177.1	0	0	0	108.9	M79 L121 S155 F175 T227 Y228 F230	M79-L173 HydrophobicContact CE-CD2 3.91Å; M79-L173 HydrophobicContact CE-CG 4.17Å; L121-L173 HydrophobicContact CD1-CB 3.93Å; L121-L173 HydrophobicContact CD1-CD2 3.94Å; L121-L173 HydrophobicContact CD2-CD2 4.38Å; S155-L173 WeakPolarHBondContact OG-CD2 3.4Å; L173-F175 HydrophobicContact CB-CD2 4.46Å; L173-F175 HydrophobicContact CB-CE2 3.77Å; L173-F175 HydrophobicContact CB-CZ 4.27Å; L173-F175 HydrophobicContact CD1-CE2 4.32Å; L173-F175 HydrophobicContact CD1-CZ 4.32Å; L173-T227 CarbonylContact O-C 3.58Å; L173-T227 VanDerWaalsContact O-CA 3.28Å; L173-T227 WeakPolarHBondContact O-CA 3.25Å; L173-Y228 PolarHBondContact N-O 2.75Å; L173-Y228 PolarHBondContact O-N 2.84Å; L173-F230 HydrophobicContact CB-CE2 4.29Å; L173-F230 HydrophobicContact CD1-CD2 4.47Å; L173-F230 HydrophobicContact CD1-CE2 3.45Å; L173-F230 VanDerWaalsContact CD1-CE2 3.45Å; L173-F230 HydrophobicContact CD1-CZ 3.61Å; L173-F230 HydrophobicContact CG-CD2 4.19Å; L173-F230 HydrophobicContact CG-CE2 3.58Å; L173-F230 HydrophobicContact CG-CZ 4.21Å
174	R	94.9	Very high	92.2	Very high	92 Å²	92	49.1 Å²	49.1	35%	0.347	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	104.8	-177.4	-59	-178.4	70.5	-174.6	5.7	110.8	L121 Y122 N123 Y223 D225 T227	L121-R174 WeakPolarHBondContact CA-O 3.21Å; Y122-R174 PolarHBondContact N-O 3.41Å; N123-R174 WeakPolarHBondContact OD1-CB 3.38Å; N123-R174 PolarHBondContact OD1-N 3.1Å; R174-Y223 PolarHBondContact NH2-OH 3.48Å; R174-D225 IonicContact CZ-OD2 2.75Å; R174-D225 IonicContact NE-OD2 3.09Å; R174-D225 PolarHBondContact NE-OD2 3.32Å; R174-D225 IonicContact NH2-OD2 2.68Å; R174-D225 PolarHBondContact NH2-OD2 2.92Å; R174-T227 HydrophobicContact CG-CG2 3.99Å
175	F	95.2	Very high	92.5	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.009	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.2	177.8	-65	-76.5	0	0	0	111.3	V64 L85 V119 V120 L121 Y153 L173 D225 I226 Y228	V64-F175 HydrophobicContact CG2-CD2 4.35Å; V64-F175 HydrophobicContact CG2-CE2 3.71Å; V64-F175 HydrophobicContact CG2-CZ 4.22Å; L85-F175 HydrophobicContact CD1-CE1 4.32Å; L85-F175 HydrophobicContact CD1-CZ 4.4Å; L85-F175 HydrophobicContact CD2-CD1 4.43Å; L85-F175 HydrophobicContact CD2-CE1 4.23Å; V119-F175 HydrophobicContact CG1-CB 3.93Å; V119-F175 HydrophobicContact CG1-CD1 4.24Å; V120-F175 WeakPolarHBondContact O-CA 3.47Å; L121-F175 HydrophobicContact CD1-CE1 4.34Å; L121-F175 HydrophobicContact CD1-CZ 4.42Å; Y153-F175 HydrophobicContact CD2-CE1 4.17Å; Y153-F175 HydrophobicContact CD2-CZ 4.03Å; Y153-F175 HydrophobicContact CE1-CE1 4.43Å; Y153-F175 AromaticContact CE2-CE1 3.56Å; Y153-F175 HydrophobicContact CE2-CE1 3.56Å; Y153-F175 AromaticContact CE2-CZ 3.74Å; Y153-F175 HydrophobicContact CE2-CZ 3.74Å; Y153-F175 AromaticContact CZ-CE1 3.72Å; L173-F175 HydrophobicContact CB-CD2 4.46Å; L173-F175 HydrophobicContact CB-CE2 3.77Å; L173-F175 HydrophobicContact CB-CZ 4.27Å; L173-F175 HydrophobicContact CD1-CE2 4.32Å; L173-F175 HydrophobicContact CD1-CZ 4.32Å; F175-D225 WeakPolarHBondContact O-CA 3.05Å; F175-I226 PolarHBondContact N-O 3.08Å; F175-I226 PolarHBondContact O-N 3.13Å; F175-Y228 HydrophobicContact CD2-CD2 4.06Å; F175-Y228 HydrophobicContact CD2-CE2 4.43Å; F175-Y228 HydrophobicContact CE2-CD2 4.1Å
176	R	93	Very high	92.6	Very high	29 Å²	29	50.4 Å²	50.4	11%	0.109	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	156.8	175	165.3	180	179.8	169.5	7.1	109.9	V120 Y122 D181 V224 D225	V120-R176 PolarHBondContact N-O 3.1Å; V120-R176 PolarHBondContact O-N 3.15Å; V120-R176 VanDerWaalsContact O-N 3.09Å; Y122-R176 HydrophobicContact CD2-CB 3.59Å; Y122-R176 HydrophobicContact CD2-CG 4.13Å; Y122-R176 HydrophobicContact CE2-CB 3.43Å; Y122-R176 VanDerWaalsContact CE2-CB 3.43Å; Y122-R176 HydrophobicContact CE2-CG 3.47Å; Y122-R176 VanDerWaalsContact CE2-CG 3.47Å; R176-D181 IonicContact NH2-OD1 2.89Å; R176-V224 WeakPolarHBondContact CD-O 3.48Å; R176-V224 VanDerWaalsContact CG-O 3.31Å; R176-V224 WeakPolarHBondContact CG-O 3.34Å; R176-D225 HydrophobicContact CB-CB 4.08Å
177	S	92.8	Very high	92.9	Very high	7 Å²	7	46.1 Å²	46.1	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.9	169.4	44.3	0	0	0	0	111.5	D118 Y122 Y180	D118-S177 WeakPolarHBondContact O-CA 3.4Å; D118-S177 WeakPolarHBondContact OD1-CB 3.45Å; Y122-S177 PolarHBondContact OH-O 2.94Å; Y122-S177 VanDerWaalsContact OH-O 3.13Å; S177-Y180 WeakPolarHBondContact CB-O 3.39Å; S177-Y180 PolarHBondContact OG-O 3.3Å
178	W	90.6	Very high	93.1	Very high	145 Å²	145	48.3 Å²	48.3	55%	0.549	24%	0.235	S	C	.	.	S	Bend	trans	-77.3	-41.6	-178.4	-172.3	-99.5	0	0	0	113.1	D118 V120 Y122	D118-W178 PolarHBondContact O-N 2.73Å; D118-W178 VanDerWaalsContact O-N 3.14Å; D118-W178 PolarHBondContact OD1-N 3.08Å; D118-W178 WeakPolarHBondContact OD2-CB 3.39Å; D118-W178 PolarHBondContact OD2-N 3.03Å; V120-W178 HydrophobicContact CG2-CB 3.95Å; V120-W178 HydrophobicContact CG2-CD2 4.44Å; V120-W178 HydrophobicContact CG2-CE3 3.79Å; Y122-W178 HydrophobicContact CD1-CZ3 4.34Å; Y122-W178 HydrophobicContact CE1-CE3 4.03Å; Y122-W178 AromaticContact CE1-CZ3 3.92Å; Y122-W178 HydrophobicContact CE1-CZ3 3.92Å; Y122-W178 HydrophobicContact CE2-CE3 4.11Å; Y122-W178 AromaticContact CZ-CE3 3.73Å
179	T	91.8	Very high	93.3	Very high	91 Å²	91	45.3 Å²	45.3	56%	0.558	22%	0.222	S	C	*	.	S	Bend	trans	-102.4	-35.1	-173.1	57.6	0	0	0	0	113.3	D118	D118-T179 VanDerWaalsContact CG-OG1 3.31Å; D118-T179 WeakPolarHBondContact OD2-CA 3.45Å; D118-T179 VanDerWaalsContact OD2-CB 3.23Å; D118-T179 WeakPolarHBondContact OD2-CB 3.49Å; D118-T179 VanDerWaalsContact OD2-CG2 3.32Å; D118-T179 WeakPolarHBondContact OD2-CG2 3.4Å; D118-T179 PolarHBondContact OD2-N 2.91Å; D118-T179 PolarHBondContact OD2-OG1 3.18Å
180	Y	91.7	Very high	93.2	Very high	39 Å²	39	51.1 Å²	51.1	15%	0.153	24%	0.244	C	C	.	.			trans	-91.4	142.2	-177.2	-59.1	-78.8	0	0	0	112.3	R49 W115 D118 S177 E184 I185	R49-Y180 HydrophobicContact CB-CE1 4.31Å; W115-Y180 HydrophobicContact CZ2-CE2 4.15Å; W115-Y180 AromaticContact NE1-CZ 3.94Å; W115-Y180 PolarHBondContact NE1-OH 2.92Å; W115-Y180 VanDerWaalsContact NE1-OH 3.11Å; D118-Y180 WeakPolarHBondContact OD1-CD2 3.32Å; S177-Y180 WeakPolarHBondContact CB-O 3.39Å; S177-Y180 PolarHBondContact OG-O 3.3Å; Y180-E184 HydrophobicContact CD1-CB 4.1Å; Y180-E184 WeakPolarHBondContact CD1-OE2 3.32Å; Y180-I185 HydrophobicContact CD1-CD1 4.1Å; Y180-I185 HydrophobicContact CD1-CG1 4.29Å; Y180-I185 HydrophobicContact CD2-CD1 3.26Å; Y180-I185 HydrophobicContact CD2-CG1 4.23Å; Y180-I185 HydrophobicContact CE2-CD1 3.9Å; Y180-I185 HydrophobicContact CG-CD1 3.37Å; Y180-I185 HydrophobicContact CG-CG1 3.84Å
181	D	90	Very high	93	Very high	62 Å²	62	48.4 Å²	48.4	33%	0.332	23%	0.234	S	C	.	.			trans	-95.1	170.8	173.4	-75.4	-32.3	0	0	0	112	R176 T183 E184 I185	R176-D181 IonicContact NH2-OD1 2.89Å; D181-T183 PolarHBondContact O-N 3.18Å; D181-E184 PolarHBondContact O-N 2.95Å; D181-I185 PolarHBondContact O-N 3.06Å
182	R	89.8	Confident	92.8	Very high	79 Å²	79	54.5 Å²	54.5	30%	0.298	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-28	173.9	-175.2	-174.8	-178.8	163.7	-0.1	113.8	L57 E184 I185 E216 P221 T222 V224	L57-R182 WeakPolarHBondContact CD2-O 3.4Å; R182-E184 PolarHBondContact O-N 3.45Å; R182-I185 WeakPolarHBondContact CA-O 3.43Å; R182-E216 IonicContact CZ-OE1 3.03Å; R182-E216 IonicContact CZ-OE2 2.76Å; R182-E216 VanDerWaalsContact CZ-OE2 3.24Å; R182-E216 IonicContact NH1-OE1 3.93Å; R182-E216 PolarHBondContact NH1-OE1 3.23Å; R182-E216 IonicContact NH1-OE2 3.63Å; R182-E216 PolarHBondContact NH1-OE2 2.66Å; R182-E216 IonicContact NH2-OE1 2.77Å; R182-E216 PolarHBondContact NH2-OE1 3.43Å; R182-E216 IonicContact NH2-OE2 3.43Å; R182-E216 PolarHBondContact NH2-OE2 2.87Å; R182-P221 WeakPolarHBondContact CD-O 3.4Å; R182-T222 WeakPolarHBondContact CB-O 3.33Å; R182-T222 PolarHBondContact N-O 3.23Å; R182-V224 HydrophobicContact CB-CG2 3.73Å; R182-V224 VanDerWaalsContact CD-CG2 3.49Å; R182-V224 HydrophobicContact CG-CG2 3.51Å
183	T	89.1	Confident	92.6	Very high	88 Å²	88	56.6 Å²	56.6	54%	0.54	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-9.2	-179.9	53.2	0	0	0	0	113.9	L57 D181	L57-T183 WeakPolarHBondContact CD2-O 3.31Å; D181-T183 PolarHBondContact O-N 3.18Å
184	E	91.9	Very high	92.5	Very high	66 Å²	66	56.8 Å²	56.8	31%	0.308	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-39	-178.1	-61	178.6	120.7	0	0	112	R49 V58 Y180 D181 R182	R49-E184 PolarHBondContact NH1-O 3.08Å; V58-E184 PolarHBondContact N-O 3.43Å; Y180-E184 HydrophobicContact CD1-CB 4.1Å; Y180-E184 WeakPolarHBondContact CD1-OE2 3.32Å; D181-E184 PolarHBondContact O-N 2.95Å; R182-E184 PolarHBondContact O-N 3.45Å
185	I	93.2	Very high	92.4	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.7	179.2	-62.1	-172.2	0	0	0	109.5	V58 V60 W115 P117 Y180 D181 R182 L187	V58-I185 HydrophobicContact CB-CG1 4.44Å; V58-I185 WeakPolarHBondContact O-CA 3.3Å; V58-I185 WeakPolarHBondContact O-CG2 3.48Å; V60-I185 HydrophobicContact CB-CG2 4.44Å; V60-I185 HydrophobicContact CG2-CG2 3.81Å; W115-I185 HydrophobicContact CH2-CD1 3.92Å; W115-I185 HydrophobicContact CZ2-CD1 3.86Å; P117-I185 HydrophobicContact CB-CD1 4.43Å; Y180-I185 HydrophobicContact CD1-CD1 4.1Å; Y180-I185 HydrophobicContact CD1-CG1 4.29Å; Y180-I185 HydrophobicContact CD2-CD1 3.26Å; Y180-I185 HydrophobicContact CD2-CG1 4.23Å; Y180-I185 HydrophobicContact CE2-CD1 3.9Å; Y180-I185 HydrophobicContact CG-CD1 3.37Å; Y180-I185 HydrophobicContact CG-CG1 3.84Å; D181-I185 PolarHBondContact O-N 3.06Å; R182-I185 WeakPolarHBondContact CA-O 3.43Å; I185-L187 HydrophobicContact CG2-CD2 3.7Å
186	D	93.3	Very high	92.2	Very high	34 Å²	34	56.1 Å²	56.1	18%	0.182	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.8	171	-170.5	27.3	0	0	0	110.3	V58 T59 V60 R214	V58-D186 PolarHBondContact O-N 2.79Å; T59-D186 CarbonylContact C-O 3.54Å; T59-D186 WeakPolarHBondContact CA-O 3.23Å; T59-D186 HydrophobicContact CG2-CB 4.4Å; V60-D186 PolarHBondContact N-O 2.66Å; D186-R214 IonicContact OD1-CZ 2.69Å; D186-R214 IonicContact OD1-NE 3.77Å; D186-R214 IonicContact OD1-NH2 3.49Å; D186-R214 PolarHBondContact OD1-NH2 2.57Å
187	L	94.2	Very high	92.1	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.2	178.4	-56.5	-176	0	0	0	109.2	V60 L62 V119 I185 R214 V224 I226	V60-L187 HydrophobicContact CB-CD2 3.98Å; V60-L187 HydrophobicContact CG1-CD2 4.49Å; L62-L187 HydrophobicContact CD1-CB 3.98Å; L62-L187 HydrophobicContact CD1-CD1 4.19Å; L62-L187 HydrophobicContact CD1-CD2 3.72Å; L62-L187 HydrophobicContact CD1-CG 4.16Å; V119-L187 HydrophobicContact CG2-CD2 4.31Å; I185-L187 HydrophobicContact CG2-CD2 3.7Å; L187-R214 VanDerWaalsContact O-CD 3.25Å; L187-R214 WeakPolarHBondContact O-CD 3.49Å; L187-R214 PolarHBondContact O-NE 3.26Å; L187-V224 HydrophobicContact CB-CG1 4.27Å; L187-I226 HydrophobicContact CB-CD1 3.75Å; L187-I226 HydrophobicContact CB-CG1 4.11Å
188	V	95	Very high	91.9	Very high	51 Å²	51	66.7 Å²	66.7	31%	0.309	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.1	-177.7	-176.2	0	0	0	0	109.8	V60 Q61 L62	V60-V188 PolarHBondContact O-N 2.76Å; Q61-V188 CarbonylContact C-O 3.59Å; Q61-V188 WeakPolarHBondContact CA-O 3.45Å; L62-V188 PolarHBondContact N-O 3.26Å
189	L	94.9	Very high	92.1	Very high	28 Å²	28	62.4 Å²	62.4	15%	0.147	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.5	172.3	-73.5	88.8	0	0	0	109.4	A191 G212 R214 I226	L189-A191 VanDerWaalsContact C-N 3.32Å; L189-G212 VanDerWaalsContact CD2-C 3.47Å; L189-R214 HydrophobicContact CD1-CB 3.55Å; L189-R214 HydrophobicContact CD1-CG 4.33Å; L189-I226 HydrophobicContact CD1-CB 4.41Å; L189-I226 HydrophobicContact CD1-CD1 3.8Å; L189-I226 HydrophobicContact CD1-CG1 3.8Å; L189-I226 HydrophobicContact CD1-CG2 3.91Å; L189-I226 HydrophobicContact CD2-CG2 4.07Å; L189-I226 HydrophobicContact CG-CD1 4.06Å; L189-I226 HydrophobicContact CG-CG1 4.4Å; L189-I226 HydrophobicContact CG-CG2 3.81Å
190	R	92.9	Very high	92.1	Very high	124 Å²	124	61.4 Å²	61.4	47%	0.468	32%	0.321	S	S	.	.	S	Bend	trans	-70.7	-32.4	171.8	-171.5	178.1	179.8	144.2	9.2	112.1	L62 M63 E88	L62-R190 PolarHBondContact O-N 3.47Å; M63-R190 HydrophobicContact CB-CB 4Å; E88-R190 IonicContact OE2-CZ 2.85Å; E88-R190 IonicContact OE2-NH1 3.82Å; E88-R190 PolarHBondContact OE2-NH1 2.74Å; E88-R190 IonicContact OE2-NH2 3.19Å
191	A	91.3	Very high	92.2	Very high	35 Å²	35	64.4 Å²	64.4	29%	0.289	35%	0.346	S	S	.	.			trans	-145.6	147	178.8	0	0	0	0	0	110.1	L189 V193	L189-A191 VanDerWaalsContact C-N 3.32Å; A191-V193 PolarHBondContact O-N 2.65Å
192	D	90.9	Very high	92.3	Very high	128 Å²	128	62.6 Å²	62.6	68%	0.684	34%	0.338	S	S	*	.	S	Bend	trans	-73.6	-11.8	-179.2	-62.1	-33.2	0	0	0	113.4	G212	D192-G212 PolarHBondContact O-N 2.76Å
193	V	93	Very high	92.3	Very high	84 Å²	84	62.3 Å²	62.3	51%	0.509	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-130.8	138.4	-179.1	-175.3	0	0	0	0	108.8	A191 L210	A191-V193 PolarHBondContact O-N 2.65Å; V193-L210 WeakPolarHBondContact CG1-O 3.49Å
194	A	92.8	Very high	92.4	Very high	4 Å²	4	61.5 Å²	61.5	3%	0.033	35%	0.35	C	S	.	.			trans	-65.1	139.3	174	0	0	0	0	0	110.8	V64 L210 Y228	V64-A194 WeakPolarHBondContact O-CA 3.47Å; V64-A194 WeakPolarHBondContact O-CB 3.35Å; A194-L210 HydrophobicContact CB-CB 3.86Å; A194-L210 HydrophobicContact CB-CD1 4.12Å; A194-L210 PolarHBondContact N-O 3.47Å; A194-Y228 HydrophobicContact CB-CD1 3.87Å; A194-Y228 HydrophobicContact CB-CE1 3.93Å
195	S	93.1	Very high	92.6	Very high	15 Å²	15	58.5 Å²	58.5	11%	0.105	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-70.8	144.3	174.5	164.9	0	0	0	0	110.5	M63 V64 S65 L66 D197	M63-S195 VanDerWaalsContact CE-CB 3.46Å; V64-S195 PolarHBondContact O-N 3.43Å; V64-S195 VanDerWaalsContact O-N 3.09Å; S65-S195 WeakPolarHBondContact CA-O 3.45Å; L66-S195 PolarHBondContact N-O 3.36Å; S195-D197 PolarHBondContact OG-N 3.08Å; S195-D197 PolarHBondContact OG-OD2 2.94Å
196	M	91.4	Very high	92.6	Very high	66 Å²	66	61.9 Å²	61.9	33%	0.325	35%	0.353	S	S	.	.			trans	-123.3	22.6	173.4	-62.6	179.2	-173.7	0	0	111.2	D198 F199 I207 L210	M196-D198 VanDerWaalsContact C-N 3.28Å; M196-D198 PolarHBondContact O-N 3.43Å; M196-F199 HydrophobicContact CB-CB 3.91Å; M196-F199 WeakPolarHBondContact O-CB 3.42Å; M196-F199 PolarHBondContact O-N 3.09Å; M196-F199 VanDerWaalsContact O-N 3.12Å; M196-I207 HydrophobicContact CE-CB 4.31Å; M196-I207 HydrophobicContact CE-CG2 3.53Å; M196-L210 HydrophobicContact CE-CB 3.93Å; M196-L210 HydrophobicContact CE-CD1 3.23Å; M196-L210 HydrophobicContact CE-CG 3.31Å; M196-L210 HydrophobicContact CG-CD1 4.04Å; M196-L210 HydrophobicContact SD-CD1 4.42Å
197	D	89.6	Confident	92.6	Very high	143 Å²	143	61.7 Å²	61.7	77%	0.765	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-36	-171.7	-61.1	-40.2	0	0	0	112.3	S195	S195-D197 PolarHBondContact OG-N 3.08Å; S195-D197 PolarHBondContact OG-OD2 2.94Å
198	D	90.1	Very high	92.6	Very high	115 Å²	115	65.2 Å²	65.2	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	26.4	177.1	-70.4	-30.6	0	0	0	112.8	M196	M196-D198 VanDerWaalsContact C-N 3.28Å; M196-D198 PolarHBondContact O-N 3.43Å
199	F	93.4	Very high	92.5	Very high	55 Å²	55	64.5 Å²	64.5	24%	0.241	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-77	127.1	-174.7	176.2	-115	0	0	0	112.9	L66 M196 P201 I207	L66-F199 HydrophobicContact CD2-CD2 3.92Å; L66-F199 HydrophobicContact CD2-CE2 3.91Å; L66-F199 HydrophobicContact CG-CD2 4.07Å; L66-F199 HydrophobicContact CG-CE2 4.4Å; M196-F199 HydrophobicContact CB-CB 3.91Å; M196-F199 WeakPolarHBondContact O-CB 3.42Å; M196-F199 PolarHBondContact O-N 3.09Å; M196-F199 VanDerWaalsContact O-N 3.12Å; F199-P201 HydrophobicContact CE1-CB 4.13Å; F199-I207 HydrophobicContact CD2-CD1 4.17Å; F199-I207 HydrophobicContact CE1-CD1 4.12Å; F199-I207 HydrophobicContact CE2-CD1 3.37Å; F199-I207 HydrophobicContact CE2-CG1 4.41Å; F199-I207 HydrophobicContact CZ-CD1 3.34Å; F199-I207 HydrophobicContact CZ-CG1 3.93Å
200	T	93.4	Very high	92.5	Very high	69 Å²	69	63.3 Å²	63.3	42%	0.423	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-96	119.5	168.8	52	0	0	0	0	110.6	A67 Q68	A67-T200 PolarHBondContact O-N 3.35Å; A67-T200 PolarHBondContact O-OG1 2.89Å; Q68-T200 WeakPolarHBondContact CB-OG1 3.38Å; Q68-T200 WeakPolarHBondContact CG-OG1 3.43Å
201	P	92.3	Very high	92.7	Very high	103 Å²	103	59.7 Å²	59.7	67%	0.669	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-66.8	139.4	-175.4	26.6	-34.1	0	0	0	112.2	F199	F199-P201 HydrophobicContact CE1-CB 4.13Å
202	S	91.9	Very high	92.9	Very high	24 Å²	24	58.5 Å²	58.5	17%	0.168	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-81.2	147.1	175.9	-179.8	0	0	0	0	111.8	E204 K235	S202-E204 VanDerWaalsContact C-N 3.3Å; S202-E204 PolarHBondContact OG-N 2.88Å; S202-K235 PolarHBondContact O-NZ 3.31Å
203	G	91.3	Very high	93.1	Very high	73 Å²	73	58.2 Å²	58.2	75%	0.753	34%	0.337	S	S	*	.	S	Bend	trans	-73.2	-20.1	175.5	0	0	0	0	0	113.9	K235	G203-K235 WeakPolarHBondContact O-CD 3.39Å
204	E	91.4	Very high	93.1	Very high	71 Å²	71	58 Å²	58	33%	0.332	33%	0.327	S	S	.	.	S	Bend	trans	-111.3	-33.5	-174.4	-172.8	178.1	175.9	0	0	113.4	S202 R234 K235	S202-E204 VanDerWaalsContact C-N 3.3Å; S202-E204 PolarHBondContact OG-N 2.88Å; E204-R234 IonicContact OE1-NH1 2.74Å; E204-R234 PolarHBondContact OE1-NH1 2.95Å; E204-K235 WeakPolarHBondContact O-CB 3.35Å; E204-K235 PolarHBondContact O-N 2.76Å
205	W	94.6	Very high	93	Very high	3 Å²	3	59.4 Å²	59.4	1%	0.011	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.4	-173.2	-65.4	93.5	0	0	0	111.5	L69 V72 Q169 I232 R234	L69-W205 HydrophobicContact CD2-CB 3.73Å; L69-W205 HydrophobicContact CD2-CG 4.18Å; V72-W205 HydrophobicContact CB-CZ2 4.16Å; V72-W205 HydrophobicContact CG1-CZ2 4.31Å; Q169-W205 HydrophobicContact CB-CZ3 4.49Å; Q169-W205 HydrophobicContact CG-CH2 3.79Å; Q169-W205 HydrophobicContact CG-CZ3 3.82Å; W205-I232 HydrophobicContact CD2-CD1 4.07Å; W205-I232 HydrophobicContact CE3-CB 4.11Å; W205-I232 HydrophobicContact CE3-CD1 3.71Å; W205-I232 HydrophobicContact CE3-CG1 3.79Å; W205-I232 HydrophobicContact CZ3-CD1 4.01Å; W205-I232 HydrophobicContact CZ3-CG1 4Å; W205-R234 HydrophobicContact CE3-CB 4.09Å; W205-R234 HydrophobicContact CH2-CB 4.13Å; W205-R234 VanDerWaalsContact CH2-CZ 3.49Å; W205-R234 VanDerWaalsContact CH2-NH2 3.27Å; W205-R234 VanDerWaalsContact CZ2-NH2 3.29Å; W205-R234 HydrophobicContact CZ3-CB 3.8Å
206	D	94	Very high	92.9	Very high	72 Å²	72	62.5 Å²	62.5	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.4	168.6	-70.9	-40.3	0	0	0	109.7	I232 R233 K235	D206-I232 CarbonylContact O-C 3.59Å; D206-I232 VanDerWaalsContact O-CA 3.32Å; D206-I232 WeakPolarHBondContact O-CA 3.42Å; D206-R233 PolarHBondContact N-O 3.03Å; D206-R233 PolarHBondContact O-N 3.38Å; D206-K235 WeakPolarHBondContact OD1-CE 3.38Å; D206-K235 IonicContact OD1-NZ 3.18Å; D206-K235 PolarHBondContact OD1-NZ 3.09Å; D206-K235 WeakPolarHBondContact OD2-CE 3.32Å
207	I	93.9	Very high	92.6	Very high	30 Å²	30	62.8 Å²	62.8	15%	0.154	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.6	176	-50.9	-177.7	0	0	0	108.3	L66 M196 F199 L210 I232	L66-I207 HydrophobicContact CD2-CD1 3.19Å; M196-I207 HydrophobicContact CE-CB 4.31Å; M196-I207 HydrophobicContact CE-CG2 3.53Å; F199-I207 HydrophobicContact CD2-CD1 4.17Å; F199-I207 HydrophobicContact CE1-CD1 4.12Å; F199-I207 HydrophobicContact CE2-CD1 3.37Å; F199-I207 HydrophobicContact CE2-CG1 4.41Å; F199-I207 HydrophobicContact CZ-CD1 3.34Å; F199-I207 HydrophobicContact CZ-CG1 3.93Å; I207-L210 HydrophobicContact CG2-CD1 4.21Å; I207-L210 HydrophobicContact CG2-CD2 3.81Å; I207-L210 HydrophobicContact CG2-CG 3.72Å; I207-I232 HydrophobicContact CG1-CG2 4.29Å
208	I	92.7	Very high	92.4	Very high	76 Å²	76	62.3 Å²	62.3	39%	0.39	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-48	179.4	-59.5	163.8	0	0	0	110	Q168 I231 R233	Q168-I208 HydrophobicContact CG-CD1 4.32Å; I208-I231 HydrophobicContact CB-CG2 4.19Å; I208-I231 WeakPolarHBondContact CB-O 3.37Å; I208-I231 HydrophobicContact CD1-CG2 4.09Å; I208-I231 PolarHBondContact N-O 3.48Å; I208-R233 HydrophobicContact CD1-CB 3.73Å; I208-R233 HydrophobicContact CG1-CB 4.16Å
209	A	92.9	Very high	92.2	Very high	37 Å²	37	61.1 Å²	61.1	31%	0.306	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	149	-177.5	0	0	0	0	0	111.4	I231	A209-I231 HydrophobicContact CB-CB 4.44Å; A209-I231 HydrophobicContact CB-CD1 4.31Å; A209-I231 PolarHBondContact N-O 2.78Å; A209-I231 PolarHBondContact O-N 2.71Å; A209-I231 VanDerWaalsContact O-N 3.09Å
210	L	95.3	Very high	92	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	37%	0.365	C	S	.	.			trans	-130.9	64.2	175.7	-63.8	-179.8	0	0	0	112.6	L66 V193 A194 M196 I207 D229 F230	L66-L210 HydrophobicContact CB-CD1 4.16Å; L66-L210 HydrophobicContact CD2-CD1 3.77Å; V193-L210 WeakPolarHBondContact CG1-O 3.49Å; A194-L210 HydrophobicContact CB-CB 3.86Å; A194-L210 HydrophobicContact CB-CD1 4.12Å; A194-L210 PolarHBondContact N-O 3.47Å; M196-L210 HydrophobicContact CE-CB 3.93Å; M196-L210 HydrophobicContact CE-CD1 3.23Å; M196-L210 HydrophobicContact CE-CG 3.31Å; M196-L210 HydrophobicContact CG-CD1 4.04Å; M196-L210 HydrophobicContact SD-CD1 4.42Å; I207-L210 HydrophobicContact CG2-CD1 4.21Å; I207-L210 HydrophobicContact CG2-CD2 3.81Å; I207-L210 HydrophobicContact CG2-CG 3.72Å; L210-D229 WeakPolarHBondContact CA-O 3.36Å; L210-F230 HydrophobicContact CD1-CE1 4.4Å; L210-F230 HydrophobicContact CD2-CB 4.02Å; L210-F230 HydrophobicContact CD2-CD1 3.31Å; L210-F230 HydrophobicContact CD2-CD2 4.04Å; L210-F230 HydrophobicContact CD2-CE1 3.65Å; L210-F230 HydrophobicContact CD2-CE2 4.31Å; L210-F230 HydrophobicContact CD2-CG 3.52Å; L210-F230 HydrophobicContact CD2-CZ 4.14Å
211	P	96.6	Very high	91.4	Very high	48 Å²	48	62.5 Å²	62.5	31%	0.312	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-70.3	140.3	176.9	30.4	-34.5	0	0	0	111.4	Y228 D229	P211-Y228 WeakPolarHBondContact O-CA 3.35Å; P211-D229 WeakPolarHBondContact CD-O 3.26Å; P211-D229 HydrophobicContact CG-CB 4.15Å; P211-D229 PolarHBondContact O-N 2.03Å
212	G	95.6	Very high	91.1	Very high	11 Å²	11	59.6 Å²	59.6	11%	0.113	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	139	168.1	0	0	0	0	0	110.2	L189 D192 T227	L189-G212 VanDerWaalsContact CD2-C 3.47Å; D192-G212 PolarHBondContact O-N 2.76Å; G212-T227 WeakPolarHBondContact CA-O 3.4Å
213	R	94.9	Very high	90.9	Very high	122 Å²	122	60.5 Å²	60.5	46%	0.46	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.5	176.9	63.2	-165.4	-162.4	95.5	10.8	111.4	N215 T227 D229	R213-N215 VanDerWaalsContact CZ-OD1 3.25Å; R213-N215 PolarHBondContact NH1-OD1 3.28Å; R213-T227 PolarHBondContact N-O 3.16Å; R213-T227 PolarHBondContact O-N 3.4Å; R213-D229 WeakPolarHBondContact CD-OD2 3.32Å; R213-D229 IonicContact NE-OD1 3.18Å; R213-D229 IonicContact NE-OD2 3.38Å; R213-D229 PolarHBondContact NE-OD2 3.14Å
214	R	93.9	Very high	90.9	Very high	80 Å²	80	57.3 Å²	57.3	30%	0.302	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.3	171.2	-168.3	162.8	167.6	-78.4	-4.4	108.3	D186 L187 L189 E216 V224	D186-R214 IonicContact OD1-CZ 2.69Å; D186-R214 IonicContact OD1-NE 3.77Å; D186-R214 IonicContact OD1-NH2 3.49Å; D186-R214 PolarHBondContact OD1-NH2 2.57Å; L187-R214 VanDerWaalsContact O-CD 3.25Å; L187-R214 WeakPolarHBondContact O-CD 3.49Å; L187-R214 PolarHBondContact O-NE 3.26Å; L189-R214 HydrophobicContact CD1-CB 3.55Å; L189-R214 HydrophobicContact CD1-CG 4.33Å; R214-E216 IonicContact CZ-OE1 3.38Å; R214-E216 IonicContact NH1-OE1 3.26Å; R214-E216 PolarHBondContact NH1-OE1 3.01Å; R214-E216 IonicContact NH2-OE1 3.55Å; R214-E216 PolarHBondContact NH2-OE1 2.94Å; R214-V224 HydrophobicContact CG-CG1 4.46Å
215	N	91.6	Very high	91	Very high	33 Å²	33	54 Å²	54	18%	0.176	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.7	173.6	-43.8	-70.4	0	0	0	110.5	R213 D225 T227	R213-N215 VanDerWaalsContact CZ-OD1 3.25Å; R213-N215 PolarHBondContact NH1-OD1 3.28Å; N215-D225 WeakPolarHBondContact CB-OD1 3.2Å; N215-D225 PolarHBondContact N-O 2.95Å; N215-D225 PolarHBondContact ND2-OD1 3.15Å; N215-D225 PolarHBondContact O-N 3.13Å; N215-D225 VanDerWaalsContact O-N 3.14Å; N215-T227 PolarHBondContact ND2-OG1 3.48Å
216	E	89.4	Confident	91.1	Very high	80 Å²	80	53.9 Å²	53.9	37%	0.374	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.6	168.1	-57.7	-171.7	171.1	0	0	107.6	R182 R214 P218 V224	R182-E216 IonicContact CZ-OE1 3.03Å; R182-E216 IonicContact CZ-OE2 2.76Å; R182-E216 VanDerWaalsContact CZ-OE2 3.24Å; R182-E216 IonicContact NH1-OE1 3.93Å; R182-E216 PolarHBondContact NH1-OE1 3.23Å; R182-E216 IonicContact NH1-OE2 3.63Å; R182-E216 PolarHBondContact NH1-OE2 2.66Å; R182-E216 IonicContact NH2-OE1 2.77Å; R182-E216 PolarHBondContact NH2-OE1 3.43Å; R182-E216 IonicContact NH2-OE2 3.43Å; R182-E216 PolarHBondContact NH2-OE2 2.87Å; R214-E216 IonicContact CZ-OE1 3.38Å; R214-E216 IonicContact NH1-OE1 3.26Å; R214-E216 PolarHBondContact NH1-OE1 3.01Å; R214-E216 IonicContact NH2-OE1 3.55Å; R214-E216 PolarHBondContact NH2-OE1 2.94Å; E216-P218 WeakPolarHBondContact O-CD 3.07Å; E216-V224 HydrophobicContact CG-CG2 4.47Å
217	N	86	Confident	91.1	Very high	71 Å²	71	50.5 Å²	50.5	38%	0.38	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119	176.7	-168.2	-3.1	0	0	0	109.6	A219 D220 Y223	N217-A219 PolarHBondContact O-N 2.96Å; N217-A219 PolarHBondContact OD1-N 3.38Å; N217-D220 HydrophobicContact CB-CB 4.35Å; N217-D220 CarbonylContact O-C 3.58Å; N217-D220 VanDerWaalsContact O-C 3.27Å; N217-D220 PolarHBondContact O-N 2.81Å; N217-Y223 HydrophobicContact CB-CD1 3.98Å; N217-Y223 HydrophobicContact CB-CG 3.98Å
218	P	84.6	Confident	91.3	Very high	133 Å²	133	49.1 Å²	49.1	86%	0.864	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27	178.4	-21.3	32.7	0	0	0	113.3	E216	E216-P218 WeakPolarHBondContact O-CD 3.07Å
219	A	86.8	Confident	91.4	Very high	91 Å²	91	46.6 Å²	46.6	75%	0.752	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-23	179.5	0	0	0	0	0	113.2	N217	N217-A219 PolarHBondContact O-N 2.96Å; N217-A219 PolarHBondContact OD1-N 3.38Å
220	D	87.8	Confident	91.6	Very high	62 Å²	62	44.9 Å²	44.9	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	95.4	-179.3	-176.9	13.3	0	0	0	109.7	N217 T222 Y223	N217-D220 HydrophobicContact CB-CB 4.35Å; N217-D220 CarbonylContact O-C 3.58Å; N217-D220 VanDerWaalsContact O-C 3.27Å; N217-D220 PolarHBondContact O-N 2.81Å; D220-T222 PolarHBondContact O-N 2.81Å; D220-T222 PolarHBondContact OD1-N 3.05Å; D220-T222 PolarHBondContact OD1-OG1 2.81Å; D220-Y223 VanDerWaalsContact O-CB 3.27Å; D220-Y223 WeakPolarHBondContact O-CB 3.25Å; D220-Y223 PolarHBondContact O-N 2.91Å; D220-Y223 VanDerWaalsContact O-N 3.08Å
221	P	82.4	Confident	91.6	Very high	91 Å²	91	47.2 Å²	47.2	59%	0.591	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	-15.1	-172.7	28.5	-34.7	0	0	0	113.3	R182 Y223	R182-P221 WeakPolarHBondContact CD-O 3.4Å; P221-Y223 VanDerWaalsContact C-N 3.31Å
222	T	86.3	Confident	91.5	Very high	41 Å²	41	44.9 Å²	44.9	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-14.4	175.5	65.3	0	0	0	0	112.5	R182 D220 V224	R182-T222 WeakPolarHBondContact CB-O 3.33Å; R182-T222 PolarHBondContact N-O 3.23Å; D220-T222 PolarHBondContact O-N 2.81Å; D220-T222 PolarHBondContact OD1-N 3.05Å; D220-T222 PolarHBondContact OD1-OG1 2.81Å; T222-V224 PolarHBondContact O-N 2.88Å
223	Y	87.5	Confident	91.4	Very high	43 Å²	43	50 Å²	50	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	116.1	-177.9	-169.7	-74.9	0	0	0	111.6	R174 N217 D220 P221 D225	R174-Y223 PolarHBondContact NH2-OH 3.48Å; N217-Y223 HydrophobicContact CB-CD1 3.98Å; N217-Y223 HydrophobicContact CB-CG 3.98Å; D220-Y223 VanDerWaalsContact O-CB 3.27Å; D220-Y223 WeakPolarHBondContact O-CB 3.25Å; D220-Y223 PolarHBondContact O-N 2.91Å; D220-Y223 VanDerWaalsContact O-N 3.08Å; P221-Y223 VanDerWaalsContact C-N 3.31Å; Y223-D225 HydrophobicContact CE1-CB 4.01Å; Y223-D225 WeakPolarHBondContact CE1-OD2 2.97Å; Y223-D225 PolarHBondContact OH-OD2 3.38Å
224	V	90.9	Very high	91.4	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.8	166.1	174.8	0	0	0	0	109.1	R176 R182 L187 R214 E216 T222	R176-V224 WeakPolarHBondContact CD-O 3.48Å; R176-V224 VanDerWaalsContact CG-O 3.31Å; R176-V224 WeakPolarHBondContact CG-O 3.34Å; R182-V224 HydrophobicContact CB-CG2 3.73Å; R182-V224 VanDerWaalsContact CD-CG2 3.49Å; R182-V224 HydrophobicContact CG-CG2 3.51Å; L187-V224 HydrophobicContact CB-CG1 4.27Å; R214-V224 HydrophobicContact CG-CG1 4.46Å; E216-V224 HydrophobicContact CG-CG2 4.47Å; T222-V224 PolarHBondContact O-N 2.88Å
225	D	93.5	Very high	91.3	Very high	2 Å²	2	44 Å²	44	1%	0.011	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.4	166.6	72	15.3	0	0	0	111.6	R174 F175 R176 N215 Y223 T227	R174-D225 IonicContact CZ-OD2 2.75Å; R174-D225 IonicContact NE-OD2 3.09Å; R174-D225 PolarHBondContact NE-OD2 3.32Å; R174-D225 IonicContact NH2-OD2 2.68Å; R174-D225 PolarHBondContact NH2-OD2 2.92Å; F175-D225 WeakPolarHBondContact O-CA 3.05Å; R176-D225 HydrophobicContact CB-CB 4.08Å; N215-D225 WeakPolarHBondContact CB-OD1 3.2Å; N215-D225 PolarHBondContact N-O 2.95Å; N215-D225 PolarHBondContact ND2-OD1 3.15Å; N215-D225 PolarHBondContact O-N 3.13Å; N215-D225 VanDerWaalsContact O-N 3.14Å; Y223-D225 HydrophobicContact CE1-CB 4.01Å; Y223-D225 WeakPolarHBondContact CE1-OD2 2.97Å; Y223-D225 PolarHBondContact OH-OD2 3.38Å; D225-T227 PolarHBondContact OD1-OG1 2.92Å
226	I	95.3	Very high	91.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.8	168.5	-65.8	-177.1	0	0	0	107	L62 F175 L187 L189 Y228	L62-I226 HydrophobicContact CB-CD1 3.92Å; L62-I226 HydrophobicContact CD1-CD1 3.75Å; L62-I226 HydrophobicContact CG-CD1 4.48Å; F175-I226 PolarHBondContact N-O 3.08Å; F175-I226 PolarHBondContact O-N 3.13Å; L187-I226 HydrophobicContact CB-CD1 3.75Å; L187-I226 HydrophobicContact CB-CG1 4.11Å; L189-I226 HydrophobicContact CD1-CB 4.41Å; L189-I226 HydrophobicContact CD1-CD1 3.8Å; L189-I226 HydrophobicContact CD1-CG1 3.8Å; L189-I226 HydrophobicContact CD1-CG2 3.91Å; L189-I226 HydrophobicContact CD2-CG2 4.07Å; L189-I226 HydrophobicContact CG-CD1 4.06Å; L189-I226 HydrophobicContact CG-CG1 4.4Å; L189-I226 HydrophobicContact CG-CG2 3.81Å; I226-Y228 HydrophobicContact CG2-CD2 4.13Å; I226-Y228 HydrophobicContact CG2-CE2 3.61Å
227	T	95.9	Very high	91.3	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130	179.8	-57	0	0	0	0	110.2	T172 L173 R174 G212 R213 N215 D225 D229	T172-T227 HydrophobicContact CG2-CG2 4.25Å; L173-T227 CarbonylContact O-C 3.58Å; L173-T227 VanDerWaalsContact O-CA 3.28Å; L173-T227 WeakPolarHBondContact O-CA 3.25Å; R174-T227 HydrophobicContact CG-CG2 3.99Å; G212-T227 WeakPolarHBondContact CA-O 3.4Å; R213-T227 PolarHBondContact N-O 3.16Å; R213-T227 PolarHBondContact O-N 3.4Å; N215-T227 PolarHBondContact ND2-OG1 3.48Å; D225-T227 PolarHBondContact OD1-OG1 2.92Å; T227-D229 WeakPolarHBondContact CG2-OD1 3.4Å
228	Y	96.6	Very high	91.6	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.9	168.3	-73.4	-89.4	0	0	0	109.4	V64 T172 L173 F175 A194 P211 I226	V64-Y228 HydrophobicContact CB-CD1 4.44Å; V64-Y228 HydrophobicContact CB-CD2 4.17Å; V64-Y228 HydrophobicContact CB-CE1 4.15Å; V64-Y228 HydrophobicContact CB-CE2 3.88Å; V64-Y228 HydrophobicContact CB-CG 4.43Å; V64-Y228 HydrophobicContact CG2-CD2 3.65Å; V64-Y228 HydrophobicContact CG2-CE2 3.33Å; V64-Y228 HydrophobicContact CG2-CG 4.36Å; V64-Y228 PolarHBondContact N-OH 2.86Å; T172-Y228 CarbonylContact C-O 3.59Å; T172-Y228 WeakPolarHBondContact CA-O 3.38Å; L173-Y228 PolarHBondContact N-O 2.75Å; L173-Y228 PolarHBondContact O-N 2.84Å; F175-Y228 HydrophobicContact CD2-CD2 4.06Å; F175-Y228 HydrophobicContact CD2-CE2 4.43Å; F175-Y228 HydrophobicContact CE2-CD2 4.1Å; A194-Y228 HydrophobicContact CB-CD1 3.87Å; A194-Y228 HydrophobicContact CB-CE1 3.93Å; P211-Y228 WeakPolarHBondContact O-CA 3.35Å; I226-Y228 HydrophobicContact CG2-CD2 4.13Å; I226-Y228 HydrophobicContact CG2-CE2 3.61Å
229	D	96.1	Very high	91.8	Very high	22 Å²	22	44.2 Å²	44.2	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129	179.4	-59	-33.9	0	0	0	109.4	C171 T172 L210 P211 R213 T227	C171-D229 CarbonylContact O-C 3.57Å; T172-D229 WeakPolarHBondContact CG2-OD1 3.35Å; L210-D229 WeakPolarHBondContact CA-O 3.36Å; P211-D229 WeakPolarHBondContact CD-O 3.26Å; P211-D229 HydrophobicContact CG-CB 4.15Å; P211-D229 PolarHBondContact O-N 2.03Å; R213-D229 WeakPolarHBondContact CD-OD2 3.32Å; R213-D229 IonicContact NE-OD1 3.18Å; R213-D229 IonicContact NE-OD2 3.38Å; R213-D229 PolarHBondContact NE-OD2 3.14Å; T227-D229 WeakPolarHBondContact CG2-OD1 3.4Å
230	F	95.9	Very high	91.9	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	94.3	-178.6	-76.4	-112.3	0	0	0	109.1	L66 M79 T81 N170 C171 L173 L210 I232	L66-F230 HydrophobicContact CD1-CE1 4.01Å; L66-F230 HydrophobicContact CD2-CE1 4.04Å; M79-F230 HydrophobicContact CE-CB 4.26Å; M79-F230 HydrophobicContact CE-CD1 4.18Å; M79-F230 HydrophobicContact CE-CD2 4.02Å; M79-F230 HydrophobicContact CE-CE2 4.45Å; M79-F230 HydrophobicContact CE-CG 3.89Å; M79-F230 HydrophobicContact SD-CB 4.2Å; M79-F230 HydrophobicContact SD-CD1 4.21Å; M79-F230 HydrophobicContact SD-CG 4.2Å; T81-F230 HydrophobicContact CG2-CE1 4Å; T81-F230 HydrophobicContact CG2-CZ 4.48Å; N170-F230 WeakPolarHBondContact CA-O 3.45Å; C171-F230 HydrophobicContact CB-CB 4.19Å; C171-F230 PolarHBondContact N-O 3.22Å; C171-F230 WeakPolarHBondContact O-CA 3.37Å; C171-F230 WeakPolarHBondContact O-CB 3.49Å; C171-F230 PolarHBondContact O-N 2.73Å; L173-F230 HydrophobicContact CB-CE2 4.29Å; L173-F230 HydrophobicContact CD1-CD2 4.47Å; L173-F230 HydrophobicContact CD1-CE2 3.45Å; L173-F230 VanDerWaalsContact CD1-CE2 3.45Å; L173-F230 HydrophobicContact CD1-CZ 3.61Å; L173-F230 HydrophobicContact CG-CD2 4.19Å; L173-F230 HydrophobicContact CG-CE2 3.58Å; L173-F230 HydrophobicContact CG-CZ 4.21Å; L210-F230 HydrophobicContact CD1-CE1 4.4Å; L210-F230 HydrophobicContact CD2-CB 4.02Å; L210-F230 HydrophobicContact CD2-CD1 3.31Å; L210-F230 HydrophobicContact CD2-CD2 4.04Å; L210-F230 HydrophobicContact CD2-CE1 3.65Å; L210-F230 HydrophobicContact CD2-CE2 4.31Å; L210-F230 HydrophobicContact CD2-CG 3.52Å; L210-F230 HydrophobicContact CD2-CZ 4.14Å; F230-I232 HydrophobicContact CB-CG2 4.49Å; F230-I232 PolarHBondContact O-N 2.81Å
231	I	95.6	Very high	92.1	Very high	51 Å²	51	43 Å²	43	26%	0.262	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	102.4	176.4	-52.5	179.7	0	0	0	108	Q169 I208 A209	Q169-I231 WeakPolarHBondContact O-CA 3.32Å; I208-I231 HydrophobicContact CB-CG2 4.19Å; I208-I231 WeakPolarHBondContact CB-O 3.37Å; I208-I231 HydrophobicContact CD1-CG2 4.09Å; I208-I231 PolarHBondContact N-O 3.48Å; A209-I231 HydrophobicContact CB-CB 4.44Å; A209-I231 HydrophobicContact CB-CD1 4.31Å; A209-I231 PolarHBondContact N-O 2.78Å; A209-I231 PolarHBondContact O-N 2.71Å; A209-I231 VanDerWaalsContact O-N 3.09Å
232	I	95	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148.8	-174.5	62.5	178.2	0	0	0	111.5	L69 V72 Q168 Q169 W205 D206 I207 F230	L69-I232 HydrophobicContact CD2-CD1 4.42Å; L69-I232 HydrophobicContact CD2-CG2 4.34Å; V72-I232 HydrophobicContact CG2-CD1 3.84Å; Q168-I232 CarbonylContact C-O 3.55Å; Q168-I232 WeakPolarHBondContact CA-O 3.35Å; Q169-I232 HydrophobicContact CB-CD1 4.2Å; Q169-I232 HydrophobicContact CB-CG1 3.76Å; Q169-I232 PolarHBondContact N-O 3.05Å; Q169-I232 PolarHBondContact O-N 2.91Å; W205-I232 HydrophobicContact CD2-CD1 4.07Å; W205-I232 HydrophobicContact CE3-CB 4.11Å; W205-I232 HydrophobicContact CE3-CD1 3.71Å; W205-I232 HydrophobicContact CE3-CG1 3.79Å; W205-I232 HydrophobicContact CZ3-CD1 4.01Å; W205-I232 HydrophobicContact CZ3-CG1 4Å; D206-I232 CarbonylContact O-C 3.59Å; D206-I232 VanDerWaalsContact O-CA 3.32Å; D206-I232 WeakPolarHBondContact O-CA 3.42Å; I207-I232 HydrophobicContact CG1-CG2 4.29Å; F230-I232 HydrophobicContact CB-CG2 4.49Å; F230-I232 PolarHBondContact O-N 2.81Å
233	R	93.9	Very high	92.5	Very high	117 Å²	117	41.1 Å²	41.1	44%	0.442	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136	177.8	-178.5	-177.7	-65.1	153.4	2.9	110.6	Q168 D206 I208	Q168-R233 HydrophobicContact CG-CB 4.32Å; Q168-R233 HydrophobicContact CG-CG 4.29Å; D206-R233 PolarHBondContact N-O 3.03Å; D206-R233 PolarHBondContact O-N 3.38Å; I208-R233 HydrophobicContact CD1-CB 3.73Å; I208-R233 HydrophobicContact CG1-CB 4.16Å
234	R	93.5	Very high	92.5	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.026	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	143.1	177.5	-168.5	-175.4	-59.7	-90	2.6	111.9	E74 P165 D167 E204 W205 P236	E74-R234 IonicContact OE1-CZ 3.18Å; E74-R234 IonicContact OE1-NH1 2.81Å; E74-R234 PolarHBondContact OE1-NH1 2.84Å; E74-R234 IonicContact OE1-NH2 3.01Å; E74-R234 PolarHBondContact OE1-NH2 2.71Å; P165-R234 WeakPolarHBondContact O-CD 3.27Å; D167-R234 PolarHBondContact O-N 3.32Å; D167-R234 IonicContact OD1-NE 3.23Å; D167-R234 PolarHBondContact OD1-NE 3.29Å; D167-R234 IonicContact OD2-CZ 2.65Å; D167-R234 IonicContact OD2-NE 3.5Å; D167-R234 IonicContact OD2-NH2 2.88Å; D167-R234 PolarHBondContact OD2-NH2 3.21Å; E204-R234 IonicContact OE1-NH1 2.74Å; E204-R234 PolarHBondContact OE1-NH1 2.95Å; W205-R234 HydrophobicContact CE3-CB 4.09Å; W205-R234 HydrophobicContact CH2-CB 4.13Å; W205-R234 VanDerWaalsContact CH2-CZ 3.49Å; W205-R234 VanDerWaalsContact CH2-NH2 3.27Å; W205-R234 VanDerWaalsContact CZ2-NH2 3.29Å; W205-R234 HydrophobicContact CZ3-CB 3.8Å; R234-P236 WeakPolarHBondContact O-CD 3.47Å
235	K	92	Very high	92.4	Very high	71 Å²	71	43.9 Å²	43.9	31%	0.309	22%	0.215	S	C	.	.			trans	-81.9	108.2	164.5	-69.1	173.5	-179.7	163.8	0	109.5	S202 G203 E204 D206 L237	S202-K235 PolarHBondContact O-NZ 3.31Å; G203-K235 WeakPolarHBondContact O-CD 3.39Å; E204-K235 WeakPolarHBondContact O-CB 3.35Å; E204-K235 PolarHBondContact O-N 2.76Å; D206-K235 WeakPolarHBondContact OD1-CE 3.38Å; D206-K235 IonicContact OD1-NZ 3.18Å; D206-K235 PolarHBondContact OD1-NZ 3.09Å; D206-K235 WeakPolarHBondContact OD2-CE 3.32Å; K235-L237 VanDerWaalsContact C-N 3.34Å; K235-L237 PolarHBondContact O-N 2.88Å
236	P	91.1	Very high	92.2	Very high	41 Å²	41	45.4 Å²	45.4	27%	0.266	23%	0.225	S	C	.	.			trans	-82.2	-6.2	-164.4	33	-38	0	0	0	114.7	P165 F166 R234 F238 Y239 T240	P165-P236 HydrophobicContact CG-CB 4.28Å; F166-P236 HydrophobicContact CD1-CB 3.59Å; F166-P236 HydrophobicContact CD1-CG 3.78Å; F166-P236 HydrophobicContact CE1-CB 3.47Å; F166-P236 VanDerWaalsContact CE1-CB 3.47Å; F166-P236 HydrophobicContact CE1-CG 3.67Å; F166-P236 HydrophobicContact CZ-CB 4.35Å; R234-P236 WeakPolarHBondContact O-CD 3.47Å; P236-F238 PolarHBondContact O-N 3.34Å; P236-Y239 PolarHBondContact O-N 3.3Å; P236-T240 WeakPolarHBondContact O-CB 3.38Å; P236-T240 PolarHBondContact O-N 2.81Å; P236-T240 PolarHBondContact O-OG1 2.84Å
237	L	90.3	Very high	91.8	Very high	121 Å²	121	45.6 Å²	45.6	63%	0.634	23%	0.226	S	C	*	.	H	α-helix	trans	-60.1	-44.8	-165.9	-169.8	154.4	0	0	0	112.6	K235 Y239 T240 I241	K235-L237 VanDerWaalsContact C-N 3.34Å; K235-L237 PolarHBondContact O-N 2.88Å; L237-Y239 PolarHBondContact O-N 3.36Å; L237-T240 PolarHBondContact O-N 3.28Å; L237-I241 HydrophobicContact CD2-CD1 3.53Å; L237-I241 HydrophobicContact CD2-CG1 4.37Å; L237-I241 HydrophobicContact CG-CD1 4.28Å; L237-I241 PolarHBondContact O-N 3.48Å
238	F	91.8	Very high	91.4	Very high	131 Å²	131	48.9 Å²	48.9	58%	0.575	25%	0.246	S	C	*	.	H	α-helix	trans	-58.7	-49.4	179.7	178.3	-97.4	0	0	0	112.2	P236 N242	P236-F238 PolarHBondContact O-N 3.34Å; F238-N242 WeakPolarHBondContact CD2-ND2 3.38Å; F238-N242 WeakPolarHBondContact CE2-ND2 3.37Å; F238-N242 WeakPolarHBondContact O-CB 3.3Å; F238-N242 PolarHBondContact O-N 2.91Å; F238-N242 PolarHBondContact O-ND2 3.06Å
239	Y	90.3	Very high	91	Very high	28 Å²	28	53.6 Å²	53.6	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-71.9	-31.1	179.1	-64.7	-77	0	0	0	112.5	F164 P165 P236 L237 L243 I244 I288	F164-Y239 HydrophobicContact CE1-CD1 4.24Å; F164-Y239 HydrophobicContact CE2-CE1 4.44Å; F164-Y239 AromaticContact CZ-CD1 3.63Å; F164-Y239 HydrophobicContact CZ-CD1 3.63Å; F164-Y239 HydrophobicContact CZ-CD2 4.47Å; F164-Y239 AromaticContact CZ-CE1 3.73Å; F164-Y239 HydrophobicContact CZ-CE1 3.73Å; F164-Y239 HydrophobicContact CZ-CG 4.01Å; P165-Y239 HydrophobicContact CB-CD2 4.07Å; P165-Y239 HydrophobicContact CB-CG 4.02Å; P236-Y239 PolarHBondContact O-N 3.3Å; L237-Y239 PolarHBondContact O-N 3.36Å; Y239-L243 WeakPolarHBondContact O-CA 3.34Å; Y239-L243 WeakPolarHBondContact O-CB 3.45Å; Y239-L243 PolarHBondContact O-N 3.08Å; Y239-I244 PolarHBondContact O-N 3.35Å; Y239-I244 VanDerWaalsContact O-N 3.14Å; Y239-I288 HydrophobicContact CE1-CD1 4.46Å; Y239-I288 HydrophobicContact CE1-CG2 4.35Å
240	T	88.6	Confident	90.6	Very high	39 Å²	39	53.5 Å²	53.5	24%	0.239	27%	0.27	C	S	.	.	I	π-helix	trans	-63.3	-47.7	176.2	-57.6	0	0	0	0	110.7	P236 L237 I244 I245	P236-T240 WeakPolarHBondContact O-CB 3.38Å; P236-T240 PolarHBondContact O-N 2.81Å; P236-T240 PolarHBondContact O-OG1 2.84Å; L237-T240 PolarHBondContact O-N 3.28Å; T240-I244 WeakPolarHBondContact O-CB 3.35Å; T240-I244 PolarHBondContact O-N 2.89Å; T240-I245 WeakPolarHBondContact O-CG1 3.35Å; T240-I245 PolarHBondContact O-N 3.49Å
241	I	91.6	Very high	90.1	Very high	88 Å²	88	54.1 Å²	54.1	45%	0.451	27%	0.273	S	S	.	.	I	π-helix	trans	-71.4	-45.2	-179	-65	177.8	0	0	0	111.9	L237 I245 P246	L237-I241 HydrophobicContact CD2-CD1 3.53Å; L237-I241 HydrophobicContact CD2-CG1 4.37Å; L237-I241 HydrophobicContact CG-CD1 4.28Å; L237-I241 PolarHBondContact O-N 3.48Å; I241-I245 HydrophobicContact CG1-CD1 4.42Å; I241-P246 VanDerWaalsContact O-CD 3.27Å; I241-P246 WeakPolarHBondContact O-CD 3.46Å
242	N	89.1	Confident	89.7	Confident	85 Å²	85	54.5 Å²	54.5	46%	0.455	28%	0.281	S	S	.	.	I	π-helix	trans	-89	-18.4	-170.4	-66.7	-33.9	0	0	0	114.3	F238	F238-N242 WeakPolarHBondContact CD2-ND2 3.38Å; F238-N242 WeakPolarHBondContact CE2-ND2 3.37Å; F238-N242 WeakPolarHBondContact O-CB 3.3Å; F238-N242 PolarHBondContact O-N 2.91Å; F238-N242 PolarHBondContact O-ND2 3.06Å
243	L	87.7	Confident	89.4	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.037	30%	0.298	C	S	.	.	I	π-helix	trans	-121.7	-51.6	-174.9	-158	159.6	0	0	0	111.8	Y239 C247 L284 I285 V299	Y239-L243 WeakPolarHBondContact O-CA 3.34Å; Y239-L243 WeakPolarHBondContact O-CB 3.45Å; Y239-L243 PolarHBondContact O-N 3.08Å; L243-C247 VanDerWaalsContact O-CB 3.26Å; L243-C247 WeakPolarHBondContact O-CB 3.44Å; L243-C247 PolarHBondContact O-N 3.49Å; L243-L284 HydrophobicContact CD1-CD2 3.86Å; L243-I285 HydrophobicContact CD1-CD1 3.98Å; L243-V299 HydrophobicContact CD2-CG1 3.46Å; L243-V299 VanDerWaalsContact CD2-CG1 3.46Å
244	I	87.1	Confident	88.9	Confident	24 Å²	24	52.5 Å²	52.5	12%	0.123	28%	0.279	C	S	.	.	I	π-helix	trans	-71.6	-49.7	-175.3	-57.4	-179.4	0	0	0	111.6	P165 F166 Y239 T240 C247 V248	P165-I244 HydrophobicContact CG-CD1 4.04Å; F166-I244 HydrophobicContact CE2-CD1 3.95Å; F166-I244 HydrophobicContact CZ-CD1 4.18Å; Y239-I244 PolarHBondContact O-N 3.35Å; Y239-I244 VanDerWaalsContact O-N 3.14Å; T240-I244 WeakPolarHBondContact O-CB 3.35Å; T240-I244 PolarHBondContact O-N 2.89Å; I244-C247 WeakPolarHBondContact O-CB 3.47Å; I244-C247 PolarHBondContact O-N 2.96Å; I244-V248 HydrophobicContact CG2-CG2 4.38Å; I244-V248 WeakPolarHBondContact O-CG2 3.38Å; I244-V248 PolarHBondContact O-N 3.18Å
245	I	88.4	Confident	88.7	Confident	84 Å²	84	54 Å²	54	43%	0.431	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-50.5	-177.5	-67.6	176.7	0	0	0	112.2	T240 I241 C247 V248 L249	T240-I245 WeakPolarHBondContact O-CG1 3.35Å; T240-I245 PolarHBondContact O-N 3.49Å; I241-I245 HydrophobicContact CG1-CD1 4.42Å; I245-C247 VanDerWaalsContact C-N 3.28Å; I245-C247 PolarHBondContact O-N 3.39Å; I245-V248 PolarHBondContact O-N 3.26Å; I245-L249 HydrophobicContact CG2-CD1 3.99Å; I245-L249 HydrophobicContact CG2-CG 4.43Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.43Å
246	P	90.8	Very high	88.5	Confident	34 Å²	34	55.1 Å²	55.1	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-37.8	176.7	-26.3	36	0	0	0	112.9	I241 L249 I250 F281	I241-P246 VanDerWaalsContact O-CD 3.27Å; I241-P246 WeakPolarHBondContact O-CD 3.46Å; P246-L249 PolarHBondContact O-N 2.75Å; P246-I250 WeakPolarHBondContact O-CB 3.47Å; P246-I250 WeakPolarHBondContact O-CD1 3.38Å; P246-I250 VanDerWaalsContact O-CG1 3.22Å; P246-I250 WeakPolarHBondContact O-CG1 3.39Å; P246-I250 PolarHBondContact O-N 2.77Å; P246-F281 HydrophobicContact CB-CE1 4.07Å; P246-F281 HydrophobicContact CB-CE2 4.4Å; P246-F281 HydrophobicContact CB-CZ 3.65Å; P246-F281 HydrophobicContact CG-CZ 4.49Å
247	C	86.6	Confident	88.4	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-62.1	-47	177.4	-175	0	0	0	0	111.5	L243 I244 I245 L249 I250 T251 Y302 L303	L243-C247 VanDerWaalsContact O-CB 3.26Å; L243-C247 WeakPolarHBondContact O-CB 3.44Å; L243-C247 PolarHBondContact O-N 3.49Å; I244-C247 WeakPolarHBondContact O-CB 3.47Å; I244-C247 PolarHBondContact O-N 2.96Å; I245-C247 VanDerWaalsContact C-N 3.28Å; I245-C247 PolarHBondContact O-N 3.39Å; C247-L249 PolarHBondContact O-N 3.06Å; C247-I250 PolarHBondContact O-N 3.23Å; C247-T251 VanDerWaalsContact O-CG2 3.31Å; C247-T251 WeakPolarHBondContact O-CG2 3.41Å; C247-T251 PolarHBondContact O-N 2.82Å; C247-T251 PolarHBondContact O-OG1 3.48Å; C247-Y302 VanDerWaalsContact SG-CD1 3.56Å; C247-Y302 WeakPolarHBondContact SG-CE1 3.28Å; C247-L303 WeakPolarHBondContact SG-CD2 3.36Å
248	V	86.4	Confident	88.3	Confident	70 Å²	70	47.5 Å²	47.5	42%	0.424	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-43.8	175.9	174.3	0	0	0	0	111.2	I244 I245 I250 T251 S252	I244-V248 HydrophobicContact CG2-CG2 4.38Å; I244-V248 WeakPolarHBondContact O-CG2 3.38Å; I244-V248 PolarHBondContact O-N 3.18Å; I245-V248 PolarHBondContact O-N 3.26Å; V248-I250 PolarHBondContact O-N 3.43Å; V248-T251 WeakPolarHBondContact CA-OG1 3.44Å; V248-T251 PolarHBondContact O-N 2.92Å; V248-T251 PolarHBondContact O-OG1 3.45Å; V248-S252 PolarHBondContact O-N 2.94Å
249	L	89	Confident	88.1	Confident	100 Å²	100	48 Å²	48	52%	0.524	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-45.4	177	-70.1	172.9	0	0	0	112.1	I245 P246 C247 T251 S252 L253	I245-L249 HydrophobicContact CG2-CD1 3.99Å; I245-L249 HydrophobicContact CG2-CG 4.43Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.43Å; P246-L249 PolarHBondContact O-N 2.75Å; C247-L249 PolarHBondContact O-N 3.06Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 3.13Å; L249-S252 WeakPolarHBondContact O-CB 3.27Å; L249-S252 PolarHBondContact O-N 2.99Å; L249-S252 VanDerWaalsContact O-N 3.11Å; L249-S252 PolarHBondContact O-OG 2.89Å; L249-L253 PolarHBondContact O-N 2.68Å
250	I	88.8	Confident	88.1	Confident	20 Å²	20	49.1 Å²	49.1	10%	0.103	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-39	178.3	-69.2	164.6	0	0	0	111.1	P246 C247 V248 S252 L253 A254 V274 A277 L278 F281	P246-I250 WeakPolarHBondContact O-CB 3.47Å; P246-I250 WeakPolarHBondContact O-CD1 3.38Å; P246-I250 VanDerWaalsContact O-CG1 3.22Å; P246-I250 WeakPolarHBondContact O-CG1 3.39Å; P246-I250 PolarHBondContact O-N 2.77Å; C247-I250 PolarHBondContact O-N 3.23Å; V248-I250 PolarHBondContact O-N 3.43Å; I250-S252 VanDerWaalsContact C-N 3.29Å; I250-S252 PolarHBondContact O-N 2.95Å; I250-L253 WeakPolarHBondContact O-CB 3.27Å; I250-L253 PolarHBondContact O-N 3.35Å; I250-A254 PolarHBondContact O-N 2.88Å; I250-A254 VanDerWaalsContact O-N 3.1Å; I250-V274 HydrophobicContact CG2-CG1 3.93Å; I250-A277 HydrophobicContact CD1-CB 4.07Å; I250-L278 HydrophobicContact CG2-CD1 4.48Å; I250-L278 HydrophobicContact CG2-CD2 3.7Å; I250-L278 HydrophobicContact CG2-CG 3.76Å; I250-F281 HydrophobicContact CD1-CD2 3.58Å; I250-F281 HydrophobicContact CD1-CE2 3.25Å; I250-F281 HydrophobicContact CD1-CZ 4.22Å
251	T	84.4	Confident	88.1	Confident	14 Å²	14	50.5 Å²	50.5	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-66.4	-31	175.8	57.2	0	0	0	0	113	C247 V248 L249 A254 Y302 T306	C247-T251 VanDerWaalsContact O-CG2 3.31Å; C247-T251 WeakPolarHBondContact O-CG2 3.41Å; C247-T251 PolarHBondContact O-N 2.82Å; C247-T251 PolarHBondContact O-OG1 3.48Å; V248-T251 WeakPolarHBondContact CA-OG1 3.44Å; V248-T251 PolarHBondContact O-N 2.92Å; V248-T251 PolarHBondContact O-OG1 3.45Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 3.13Å; T251-A254 WeakPolarHBondContact O-CB 3.18Å; T251-A254 PolarHBondContact O-N 2.91Å; T251-Y302 WeakPolarHBondContact CB-OH 3.49Å; T251-Y302 HydrophobicContact CG2-CE1 3.91Å; T251-Y302 WeakPolarHBondContact CG2-OH 3.2Å; T251-Y302 PolarHBondContact OG1-OH 3.19Å; T251-T306 HydrophobicContact CG2-CG2 3.32Å
252	S	86.8	Confident	87.8	Confident	59 Å²	59	47 Å²	47	41%	0.413	25%	0.253	S	S	.	.	H	α-helix	trans	-68.8	-37.3	171.9	78.8	0	0	0	0	112.4	V248 L249 I250 A254 I255 L256	V248-S252 PolarHBondContact O-N 2.94Å; L249-S252 WeakPolarHBondContact O-CB 3.27Å; L249-S252 PolarHBondContact O-N 2.99Å; L249-S252 VanDerWaalsContact O-N 3.11Å; L249-S252 PolarHBondContact O-OG 2.89Å; I250-S252 VanDerWaalsContact C-N 3.29Å; I250-S252 PolarHBondContact O-N 2.95Å; S252-A254 VanDerWaalsContact C-N 3.31Å; S252-A254 PolarHBondContact O-N 3.02Å; S252-I255 PolarHBondContact O-N 3.49Å; S252-L256 PolarHBondContact O-N 3.18Å; S252-L256 VanDerWaalsContact O-N 3.17Å
253	L	88.6	Confident	87.7	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.366	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-34.9	175.9	-66.7	175.3	0	0	0	112.1	L249 I250 I255 L256 V257 V274	L249-L253 PolarHBondContact O-N 2.68Å; I250-L253 WeakPolarHBondContact O-CB 3.27Å; I250-L253 PolarHBondContact O-N 3.35Å; L253-I255 VanDerWaalsContact C-N 3.25Å; L253-I255 PolarHBondContact O-N 2.75Å; L253-L256 HydrophobicContact CD2-CD2 4.25Å; L253-L256 WeakPolarHBondContact O-CB 3.27Å; L253-L256 PolarHBondContact O-N 3.06Å; L253-L256 VanDerWaalsContact O-N 3.17Å; L253-V257 PolarHBondContact O-N 2.93Å; L253-V274 HydrophobicContact CB-CG2 4.11Å
254	A	84.8	Confident	87.6	Confident	5 Å²	5	51.4 Å²	51.4	4%	0.041	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-35	175.7	0	0	0	0	0	113	I250 T251 S252 V274 V310	I250-A254 PolarHBondContact O-N 2.88Å; I250-A254 VanDerWaalsContact O-N 3.1Å; T251-A254 WeakPolarHBondContact O-CB 3.18Å; T251-A254 PolarHBondContact O-N 2.91Å; S252-A254 VanDerWaalsContact C-N 3.31Å; S252-A254 PolarHBondContact O-N 3.02Å; A254-V274 HydrophobicContact CB-CG1 4.09Å; A254-V310 HydrophobicContact CB-CG2 3.71Å
255	I	87.9	Confident	87.5	Confident	38 Å²	38	52.8 Å²	52.8	20%	0.195	30%	0.302	C	S	.	.	H	α-helix	trans	-75.1	-38.9	176.4	-60.5	170.4	0	0	0	110.4	S252 L253 V257 F258 V471 C474	S252-I255 PolarHBondContact O-N 3.49Å; L253-I255 VanDerWaalsContact C-N 3.25Å; L253-I255 PolarHBondContact O-N 2.75Å; I255-V257 PolarHBondContact O-N 3.09Å; I255-V257 VanDerWaalsContact O-N 3.17Å; I255-F258 PolarHBondContact O-N 3.32Å; I255-V471 HydrophobicContact CG2-CG2 3.43Å; I255-V471 VanDerWaalsContact CG2-CG2 3.43Å; I255-C474 HydrophobicContact CD1-CB 3.66Å; I255-C474 HydrophobicContact CG1-CB 4.35Å
256	L	88.1	Confident	87.5	Confident	95 Å²	95	54.2 Å²	54.2	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-24.1	-178.8	-169.7	65.7	0	0	0	113.1	S252 L253 F258 Y259 L260	S252-L256 PolarHBondContact O-N 3.18Å; S252-L256 VanDerWaalsContact O-N 3.17Å; L253-L256 HydrophobicContact CD2-CD2 4.25Å; L253-L256 WeakPolarHBondContact O-CB 3.27Å; L253-L256 PolarHBondContact O-N 3.06Å; L253-L256 VanDerWaalsContact O-N 3.17Å; L256-F258 VanDerWaalsContact C-N 3.27Å; L256-F258 PolarHBondContact O-N 2.88Å; L256-Y259 VanDerWaalsContact O-CB 3.3Å; L256-Y259 WeakPolarHBondContact O-CB 3.44Å; L256-Y259 PolarHBondContact O-N 2.89Å; L256-L260 PolarHBondContact O-N 3Å
257	V	88.9	Confident	87.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-50.9	-43.6	174	168.8	0	0	0	0	112.7	L253 I255 Y259 L260 K267 L270 C271	L253-V257 PolarHBondContact O-N 2.93Å; I255-V257 PolarHBondContact O-N 3.09Å; I255-V257 VanDerWaalsContact O-N 3.17Å; V257-Y259 PolarHBondContact O-N 3.48Å; V257-L260 PolarHBondContact O-N 2.84Å; V257-K267 HydrophobicContact CG1-CG 4.07Å; V257-L270 HydrophobicContact CG2-CD2 3.72Å; V257-L270 HydrophobicContact CG2-CG 3.92Å; V257-C271 WeakPolarHBondContact CG1-SG 3.46Å
258	F	87.9	Confident	87.6	Confident	1 Å²	1	55 Å²	55	0%	0.004	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-75.5	-6.2	-178.5	-63.1	-76	0	0	0	113.4	I255 L256 S313 T316 D463 F466 L467 F470	I255-F258 PolarHBondContact O-N 3.32Å; L256-F258 VanDerWaalsContact C-N 3.27Å; L256-F258 PolarHBondContact O-N 2.88Å; F258-S313 VanDerWaalsContact CE2-OG 3.23Å; F258-S313 WeakPolarHBondContact CE2-OG 3.28Å; F258-S313 WeakPolarHBondContact CZ-OG 3.32Å; F258-T316 WeakPolarHBondContact CE1-OG1 3.41Å; F258-D463 WeakPolarHBondContact CD1-OD1 3.33Å; F258-D463 VanDerWaalsContact O-OD2 3.12Å; F258-F466 HydrophobicContact CD1-CB 4.14Å; F258-F466 HydrophobicContact CE1-CB 3.94Å; F258-F466 HydrophobicContact CZ-CB 4.48Å; F258-L467 HydrophobicContact CB-CB 3.74Å; F258-L467 HydrophobicContact CB-CD1 4.15Å; F258-L467 HydrophobicContact CB-CG 4.14Å; F258-F470 HydrophobicContact CD2-CB 4.49Å; F258-F470 HydrophobicContact CD2-CD2 4.16Å; F258-F470 HydrophobicContact CD2-CG 4.49Å; F258-F470 HydrophobicContact CE1-CD2 4.19Å; F258-F470 HydrophobicContact CE1-CE2 4.12Å; F258-F470 HydrophobicContact CE2-CB 4.11Å; F258-F470 HydrophobicContact CE2-CD1 4.37Å; F258-F470 AromaticContact CE2-CD2 3.29Å; F258-F470 HydrophobicContact CE2-CD2 3.29Å; F258-F470 AromaticContact CE2-CE2 3.73Å; F258-F470 HydrophobicContact CE2-CE2 3.73Å; F258-F470 AromaticContact CE2-CG 3.68Å; F258-F470 HydrophobicContact CE2-CG 3.68Å; F258-F470 HydrophobicContact CE2-CZ 4.41Å; F258-F470 AromaticContact CZ-CD2 3.31Å; F258-F470 HydrophobicContact CZ-CD2 3.31Å; F258-F470 AromaticContact CZ-CE2 3.27Å; F258-F470 HydrophobicContact CZ-CE2 3.27Å; F258-F470 HydrophobicContact CZ-CG 4.13Å; F258-F470 HydrophobicContact CZ-CZ 4.01Å
259	Y	89.1	Confident	87.8	Confident	142 Å²	142	55 Å²	55	56%	0.557	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-89.7	-22.1	172.6	-165.5	-93.4	0	0	0	111.8	L256 V257 L467	L256-Y259 VanDerWaalsContact O-CB 3.3Å; L256-Y259 WeakPolarHBondContact O-CB 3.44Å; L256-Y259 PolarHBondContact O-N 2.89Å; V257-Y259 PolarHBondContact O-N 3.48Å; Y259-L467 HydrophobicContact CD2-CD1 4.27Å
260	L	89.2	Confident	87.8	Confident	52 Å²	52	52.8 Å²	52.8	27%	0.272	30%	0.297	S	S	.	.	S	Bend	trans	-76.5	125.9	-177.2	-167	74.2	0	0	0	110.6	L256 V257 E266 K267	L256-L260 PolarHBondContact O-N 3Å; V257-L260 PolarHBondContact O-N 2.84Å; L260-E266 HydrophobicContact CD2-CB 4.47Å; L260-K267 HydrophobicContact CD2-CB 4.28Å
261	P	88.4	Confident	87.9	Confident	67 Å²	67	52 Å²	52	44%	0.435	29%	0.292	S	S	.	.			trans	-64.2	142.6	178.7	27.4	-34.1	0	0	0	111.3	D263 C264	P261-D263 PolarHBondContact O-N 2.84Å; P261-C264 PolarHBondContact O-N 2.89Å
262	S	86.4	Confident	88.2	Confident	15 Å²	15	56 Å²	56	11%	0.105	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-66.7	-17.2	179.3	41.9	0	0	0	0	114.1	C264 H324	S262-C264 PolarHBondContact O-N 3.21Å; S262-H324 PolarHBondContact OG-CD2 3.42Å; S262-H324 VanDerWaalsContact OG-CG 3.24Å; S262-H324 PolarHBondContact OG-NE2 2.95Å
263	D	85.9	Confident	88.5	Confident	110 Å²	110	56.4 Å²	56.4	59%	0.588	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-65.9	-24.8	177.3	-67	-51.5	0	0	0	113	P261 G265 H324	P261-D263 PolarHBondContact O-N 2.84Å; D263-G265 VanDerWaalsContact C-N 3.34Å; D263-G265 PolarHBondContact O-N 2.94Å; D263-H324 IonicContact OD1-CE1 3.75Å; D263-H324 PolarHBondContact OD1-CE1 3.15Å; D263-H324 IonicContact OD1-NE2 3.58Å; D263-H324 PolarHBondContact OD1-NE2 3.39Å
264	C	85.1	Confident	88.6	Confident	75 Å²	75	53.4 Å²	53.4	51%	0.507	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-78.4	-9.9	-174.6	-71.1	0	0	0	0	114.7	P261 S262 E266	P261-C264 PolarHBondContact O-N 2.89Å; S262-C264 PolarHBondContact O-N 3.21Å; C264-E266 PolarHBondContact O-N 3.26Å
265	G	85.3	Confident	88.9	Confident	53 Å²	53	55.2 Å²	55.2	55%	0.546	31%	0.309	S	S	.	.	S	Bend	trans	68.6	-25.2	-179.5	0	0	0	0	0	116.2	D263 K267	D263-G265 VanDerWaalsContact C-N 3.34Å; D263-G265 PolarHBondContact O-N 2.94Å; G265-K267 VanDerWaalsContact C-N 3.27Å; G265-K267 PolarHBondContact O-N 2.87Å
266	E	88.5	Confident	89.1	Confident	114 Å²	114	58.7 Å²	58.7	53%	0.533	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.9	-175.5	-66.9	-54.9	148.6	0	0	115.3	L260 C264 M268 T269 L270	L260-E266 HydrophobicContact CD2-CB 4.47Å; C264-E266 PolarHBondContact O-N 3.26Å; E266-M268 VanDerWaalsContact C-N 3.3Å; E266-M268 PolarHBondContact O-N 2.72Å; E266-T269 PolarHBondContact O-N 2.94Å; E266-T269 WeakPolarHBondContact OE2-CB 3.47Å; E266-T269 PolarHBondContact OE2-OG1 3.3Å; E266-L270 PolarHBondContact O-N 3.03Å; E266-L270 VanDerWaalsContact O-N 3.11Å
267	K	89.3	Confident	89.4	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-42	-178.7	-174.3	171.5	-175.9	165.7	0	112.3	V257 L260 G265 C271 D463	V257-K267 HydrophobicContact CG1-CG 4.07Å; L260-K267 HydrophobicContact CD2-CB 4.28Å; G265-K267 VanDerWaalsContact C-N 3.27Å; G265-K267 PolarHBondContact O-N 2.87Å; K267-C271 PolarHBondContact O-N 3Å; K267-C271 PolarHBondContact O-SG 3.14Å; K267-D463 IonicContact NZ-OD1 3.78Å; K267-D463 PolarHBondContact NZ-OD1 3.48Å; K267-D463 IonicContact NZ-OD2 3.11Å; K267-D463 PolarHBondContact NZ-OD2 2.92Å
268	M	89.8	Confident	89.4	Confident	47 Å²	47	55.6 Å²	55.6	23%	0.232	32%	0.315	C	S	.	.	H	α-helix	trans	-71.9	-40.5	-179.2	-66.5	-55	-59.7	0	0	112.1	E266 L270 C271 I272 I314 V318 L321	E266-M268 VanDerWaalsContact C-N 3.3Å; E266-M268 PolarHBondContact O-N 2.72Å; M268-L270 PolarHBondContact O-N 2.7Å; M268-C271 PolarHBondContact O-N 3.26Å; M268-I272 WeakPolarHBondContact O-CG1 3.4Å; M268-I272 PolarHBondContact O-N 3.32Å; M268-I314 HydrophobicContact CE-CG2 4.33Å; M268-V318 HydrophobicContact CE-CG2 3.41Å; M268-V318 VanDerWaalsContact CE-CG2 3.41Å; M268-V318 HydrophobicContact SD-CG2 3.93Å; M268-L321 HydrophobicContact CG-CD2 4.24Å
269	T	90.9	Very high	89.6	Confident	71 Å²	71	57.6 Å²	57.6	44%	0.436	33%	0.327	S	S	.	.	H	α-helix	trans	-56.6	-50.3	176.3	-46	0	0	0	0	110.5	E266 C271 I272 S273	E266-T269 PolarHBondContact O-N 2.94Å; E266-T269 WeakPolarHBondContact OE2-CB 3.47Å; E266-T269 PolarHBondContact OE2-OG1 3.3Å; T269-C271 VanDerWaalsContact C-N 3.34Å; T269-C271 PolarHBondContact O-N 3.23Å; T269-I272 PolarHBondContact O-N 3Å; T269-S273 WeakPolarHBondContact O-CB 3.41Å; T269-S273 PolarHBondContact O-N 2.9Å; T269-S273 PolarHBondContact O-OG 2.99Å; T269-S273 VanDerWaalsContact O-OG 3.1Å
270	L	90.7	Very high	89.8	Confident	54 Å²	54	54.7 Å²	54.7	28%	0.283	32%	0.324	S	S	.	.	H	α-helix	trans	-58.6	-44	179.4	-177.4	63.7	0	0	0	112.1	V257 E266 M268 S273 V274	V257-L270 HydrophobicContact CG2-CD2 3.72Å; V257-L270 HydrophobicContact CG2-CG 3.92Å; E266-L270 PolarHBondContact O-N 3.03Å; E266-L270 VanDerWaalsContact O-N 3.11Å; M268-L270 PolarHBondContact O-N 2.7Å; L270-S273 PolarHBondContact O-N 3.27Å; L270-V274 HydrophobicContact CD1-CG2 4.38Å; L270-V274 WeakPolarHBondContact O-CB 3.25Å; L270-V274 VanDerWaalsContact O-CG2 3.26Å; L270-V274 WeakPolarHBondContact O-CG2 3.24Å; L270-V274 PolarHBondContact O-N 3.48Å
271	C	89.2	Confident	89.8	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-44.9	179.1	-61.3	0	0	0	0	112.6	V257 K267 M268 T269 V274 L275 I314	V257-C271 WeakPolarHBondContact CG1-SG 3.46Å; K267-C271 PolarHBondContact O-N 3Å; K267-C271 PolarHBondContact O-SG 3.14Å; M268-C271 PolarHBondContact O-N 3.26Å; T269-C271 VanDerWaalsContact C-N 3.34Å; T269-C271 PolarHBondContact O-N 3.23Å; C271-V274 PolarHBondContact O-N 3.29Å; C271-L275 PolarHBondContact O-N 3.34Å; C271-I314 HydrophobicContact CB-CD1 4.41Å; C271-I314 HydrophobicContact CB-CG1 3.62Å
272	I	91.3	Very high	89.8	Confident	98 Å²	98	53.3 Å²	53.3	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-67.3	-43.6	-178.8	-65.6	168.4	0	0	0	110	M268 T269 V274 L275 L276	M268-I272 WeakPolarHBondContact O-CG1 3.4Å; M268-I272 PolarHBondContact O-N 3.32Å; T269-I272 PolarHBondContact O-N 3Å; I272-V274 VanDerWaalsContact C-N 3.33Å; I272-V274 PolarHBondContact O-N 3.45Å; I272-L275 PolarHBondContact O-N 3.25Å; I272-L276 WeakPolarHBondContact O-CB 3.34Å; I272-L276 PolarHBondContact O-N 3.34Å
273	S	92.3	Very high	90	Very high	69 Å²	69	57.8 Å²	57.8	48%	0.483	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-40.6	176.5	-62.7	0	0	0	0	112.3	T269 L270 L276 A277	T269-S273 WeakPolarHBondContact O-CB 3.41Å; T269-S273 PolarHBondContact O-N 2.9Å; T269-S273 PolarHBondContact O-OG 2.99Å; T269-S273 VanDerWaalsContact O-OG 3.1Å; L270-S273 PolarHBondContact O-N 3.27Å; S273-L276 PolarHBondContact O-N 3.34Å; S273-A277 WeakPolarHBondContact O-CB 3.39Å; S273-A277 PolarHBondContact O-N 3.22Å
274	V	91.8	Very high	90.3	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.042	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-44	175.3	167.3	0	0	0	0	111.3	I250 L253 A254 L270 C271 I272 L276 A277 L278 V310	I250-V274 HydrophobicContact CG2-CG1 3.93Å; L253-V274 HydrophobicContact CB-CG2 4.11Å; A254-V274 HydrophobicContact CB-CG1 4.09Å; L270-V274 HydrophobicContact CD1-CG2 4.38Å; L270-V274 WeakPolarHBondContact O-CB 3.25Å; L270-V274 VanDerWaalsContact O-CG2 3.26Å; L270-V274 WeakPolarHBondContact O-CG2 3.24Å; L270-V274 PolarHBondContact O-N 3.48Å; C271-V274 PolarHBondContact O-N 3.29Å; I272-V274 VanDerWaalsContact C-N 3.33Å; I272-V274 PolarHBondContact O-N 3.45Å; V274-L276 PolarHBondContact O-N 3.33Å; V274-A277 PolarHBondContact O-N 2.91Å; V274-L278 HydrophobicContact CG1-CD1 4.3Å; V274-L278 WeakPolarHBondContact O-CG 3.41Å; V274-L278 PolarHBondContact O-N 3.42Å; V274-V310 HydrophobicContact CG1-CG1 4.29Å; V274-V310 HydrophobicContact CG1-CG2 4.11Å
275	L	91.1	Very high	90.5	Very high	43 Å²	43	53 Å²	53	23%	0.225	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-45.1	176.5	-179.3	65.7	0	0	0	111.5	C271 I272 L278 T279 M307 V310 I314	C271-L275 PolarHBondContact O-N 3.34Å; I272-L275 PolarHBondContact O-N 3.25Å; L275-L278 PolarHBondContact O-N 2.95Å; L275-T279 WeakPolarHBondContact O-CG2 3.22Å; L275-T279 PolarHBondContact O-N 3.46Å; L275-T279 PolarHBondContact O-OG1 2.78Å; L275-M307 HydrophobicContact CD1-CG 4.06Å; L275-V310 HydrophobicContact CB-CG1 4.04Å; L275-V310 HydrophobicContact CD1-CG1 4.25Å; L275-I314 HydrophobicContact CB-CD1 4.17Å; L275-I314 HydrophobicContact CD2-CD1 3.77Å; L275-I314 HydrophobicContact CG-CD1 4.47Å
276	L	92.9	Very high	90.6	Very high	110 Å²	110	54 Å²	54	58%	0.576	30%	0.301	S	S	*	.	H	α-helix	trans	-65.7	-39.2	178.6	-171.9	146.3	0	0	0	111.9	I272 S273 V274 T279 V280	I272-L276 WeakPolarHBondContact O-CB 3.34Å; I272-L276 PolarHBondContact O-N 3.34Å; S273-L276 PolarHBondContact O-N 3.34Å; V274-L276 PolarHBondContact O-N 3.33Å; L276-T279 WeakPolarHBondContact CA-OG1 3.27Å; L276-T279 PolarHBondContact O-N 2.93Å; L276-T279 PolarHBondContact O-OG1 3Å; L276-V280 HydrophobicContact CD2-CG2 4.22Å; L276-V280 WeakPolarHBondContact O-CG2 3.31Å; L276-V280 PolarHBondContact O-N 3.49Å
277	A	92.4	Very high	90.6	Very high	28 Å²	28	55.6 Å²	55.6	23%	0.231	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-46.2	173.8	0	0	0	0	0	111.1	I250 S273 V274 T279 V280 F281	I250-A277 HydrophobicContact CD1-CB 4.07Å; S273-A277 WeakPolarHBondContact O-CB 3.39Å; S273-A277 PolarHBondContact O-N 3.22Å; V274-A277 PolarHBondContact O-N 2.91Å; A277-T279 VanDerWaalsContact C-N 3.35Å; A277-T279 PolarHBondContact O-N 3.35Å; A277-V280 PolarHBondContact O-N 3.41Å; A277-F281 VanDerWaalsContact O-CD2 3.22Å; A277-F281 WeakPolarHBondContact O-CD2 3.35Å; A277-F281 PolarHBondContact O-N 2.82Å
278	L	90.6	Very high	90.6	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-41.1	177.1	-73.6	173.2	0	0	0	112.6	I250 V274 L275 F281 L282 L303 V310	I250-L278 HydrophobicContact CG2-CD1 4.48Å; I250-L278 HydrophobicContact CG2-CD2 3.7Å; I250-L278 HydrophobicContact CG2-CG 3.76Å; V274-L278 HydrophobicContact CG1-CD1 4.3Å; V274-L278 WeakPolarHBondContact O-CG 3.41Å; V274-L278 PolarHBondContact O-N 3.42Å; L275-L278 PolarHBondContact O-N 2.95Å; L278-F281 PolarHBondContact O-N 3.43Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 3.35Å; L278-L303 HydrophobicContact CD2-CD2 3.91Å; L278-V310 HydrophobicContact CD1-CB 4.24Å; L278-V310 HydrophobicContact CD1-CG2 3.62Å
279	T	91.1	Very high	90.5	Very high	43 Å²	43	55.9 Å²	55.9	26%	0.264	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-38.2	176.9	57.5	0	0	0	0	111.9	L275 L276 A277 L282 L283 M307	L275-T279 WeakPolarHBondContact O-CG2 3.22Å; L275-T279 PolarHBondContact O-N 3.46Å; L275-T279 PolarHBondContact O-OG1 2.78Å; L276-T279 WeakPolarHBondContact CA-OG1 3.27Å; L276-T279 PolarHBondContact O-N 2.93Å; L276-T279 PolarHBondContact O-OG1 3Å; A277-T279 VanDerWaalsContact C-N 3.35Å; A277-T279 PolarHBondContact O-N 3.35Å; T279-L282 PolarHBondContact O-N 2.83Å; T279-L283 WeakPolarHBondContact O-CG 3.5Å; T279-L283 PolarHBondContact O-N 3.33Å; T279-M307 HydrophobicContact CG2-CE 3.68Å; T279-M307 HydrophobicContact CG2-SD 4.25Å
280	V	92.9	Very high	90.5	Very high	82 Å²	82	52.7 Å²	52.7	50%	0.497	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-44.2	173.8	171.5	0	0	0	0	111.4	L276 A277 L282 L283 L284	L276-V280 HydrophobicContact CD2-CG2 4.22Å; L276-V280 WeakPolarHBondContact O-CG2 3.31Å; L276-V280 PolarHBondContact O-N 3.49Å; A277-V280 PolarHBondContact O-N 3.41Å; V280-L282 VanDerWaalsContact C-N 3.33Å; V280-L282 PolarHBondContact O-N 3.34Å; V280-L283 PolarHBondContact O-N 2.76Å; V280-L284 PolarHBondContact O-N 2.88Å
281	F	90	Very high	90.3	Very high	46 Å²	46	55.9 Å²	55.9	20%	0.202	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-37	175.3	-82.5	-73.4	0	0	0	112.5	P246 I250 A277 L278 L284 I285 L303	P246-F281 HydrophobicContact CB-CE1 4.07Å; P246-F281 HydrophobicContact CB-CE2 4.4Å; P246-F281 HydrophobicContact CB-CZ 3.65Å; P246-F281 HydrophobicContact CG-CZ 4.49Å; I250-F281 HydrophobicContact CD1-CD2 3.58Å; I250-F281 HydrophobicContact CD1-CE2 3.25Å; I250-F281 HydrophobicContact CD1-CZ 4.22Å; A277-F281 VanDerWaalsContact O-CD2 3.22Å; A277-F281 WeakPolarHBondContact O-CD2 3.35Å; A277-F281 PolarHBondContact O-N 2.82Å; L278-F281 PolarHBondContact O-N 3.43Å; F281-L284 PolarHBondContact O-N 3.32Å; F281-I285 PolarHBondContact O-N 3.37Å; F281-L303 HydrophobicContact CB-CD1 4.42Å; F281-L303 HydrophobicContact CB-CD2 4.3Å
282	L	88.6	Confident	90.1	Very high	44 Å²	44	57.9 Å²	57.9	23%	0.23	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-38.6	174.1	-175.2	64.9	0	0	0	112.2	L278 T279 V280 L284 I285 S286 L303 M304 M307	L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 3.35Å; T279-L282 PolarHBondContact O-N 2.83Å; V280-L282 VanDerWaalsContact C-N 3.33Å; V280-L282 PolarHBondContact O-N 3.34Å; L282-L284 VanDerWaalsContact C-N 3.34Å; L282-I285 HydrophobicContact CD1-CG2 4.1Å; L282-I285 WeakPolarHBondContact O-CG2 3.46Å; L282-S286 PolarHBondContact O-N 3.15Å; L282-S286 PolarHBondContact O-OG 3.4Å; L282-L303 HydrophobicContact CD1-CB 4.33Å; L282-M304 HydrophobicContact CD1-CG 4.48Å; L282-M304 HydrophobicContact CD1-SD 4.15Å; L282-M304 HydrophobicContact CD2-SD 3.69Å; L282-M307 HydrophobicContact CD2-SD 4.22Å
283	L	90.6	Very high	89.6	Confident	109 Å²	109	59 Å²	59	57%	0.571	34%	0.342	S	S	*	.	H	α-helix	trans	-70.6	-30.2	174.3	-68.8	177.2	0	0	0	112.6	T279 V280 S286 K287	T279-L283 WeakPolarHBondContact O-CG 3.5Å; T279-L283 PolarHBondContact O-N 3.33Å; V280-L283 PolarHBondContact O-N 2.76Å; L283-S286 PolarHBondContact O-OG 3.11Å; L283-S286 VanDerWaalsContact O-OG 3.06Å; L283-K287 WeakPolarHBondContact O-CG 3.46Å; L283-K287 PolarHBondContact O-N 3.27Å
284	L	91.1	Very high	89	Confident	78 Å²	78	61 Å²	61	41%	0.408	35%	0.346	S	S	.	.	H	α-helix	trans	-68	-46.1	174.6	-177.3	147	0	0	0	110.8	L243 V280 F281 L282 S286 K287 I288	L243-L284 HydrophobicContact CD1-CD2 3.86Å; V280-L284 PolarHBondContact O-N 2.88Å; F281-L284 PolarHBondContact O-N 3.32Å; L282-L284 VanDerWaalsContact C-N 3.34Å; L284-S286 VanDerWaalsContact C-N 3.35Å; L284-S286 PolarHBondContact O-N 3.25Å; L284-K287 PolarHBondContact O-N 3.46Å; L284-I288 HydrophobicContact CD2-CD1 3.53Å; L284-I288 HydrophobicContact CG-CD1 4.32Å; L284-I288 WeakPolarHBondContact O-CG1 3.47Å; L284-I288 PolarHBondContact O-N 3.39Å
285	I	89.4	Confident	88.3	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-65.9	-36.8	179.4	-170.7	68.3	0	0	0	112.1	F164 L243 F281 L282 K287 I288 V289 L303	F164-I285 HydrophobicContact CD1-CD1 4.06Å; F164-I285 HydrophobicContact CE1-CD1 3.71Å; F164-I285 HydrophobicContact CZ-CD1 4.49Å; L243-I285 HydrophobicContact CD1-CD1 3.98Å; F281-I285 PolarHBondContact O-N 3.37Å; L282-I285 HydrophobicContact CD1-CG2 4.1Å; L282-I285 WeakPolarHBondContact O-CG2 3.46Å; I285-K287 PolarHBondContact O-N 3.45Å; I285-I288 PolarHBondContact O-N 3.17Å; I285-I288 VanDerWaalsContact O-N 3.15Å; I285-V289 HydrophobicContact CD1-CG2 3.61Å; I285-V289 HydrophobicContact CG1-CG2 3.88Å; I285-V289 PolarHBondContact O-N 3.02Å; I285-L303 HydrophobicContact CG2-CD1 4.14Å
286	S	87.4	Confident	87.9	Confident	73 Å²	73	65.7 Å²	65.7	51%	0.51	37%	0.374	S	S	.	.	H	α-helix	trans	-68.7	-16.7	177.7	70.8	0	0	0	0	113.9	L282 L283 L284	L282-S286 PolarHBondContact O-N 3.15Å; L282-S286 PolarHBondContact O-OG 3.4Å; L283-S286 PolarHBondContact O-OG 3.11Å; L283-S286 VanDerWaalsContact O-OG 3.06Å; L284-S286 VanDerWaalsContact C-N 3.35Å; L284-S286 PolarHBondContact O-N 3.25Å
287	K	89.4	Confident	87.7	Confident	149 Å²	149	61.1 Å²	61.1	65%	0.648	35%	0.351	S	S	*	.	H	α-helix	trans	-86	-24.3	172.4	-74.6	-178.6	178.4	-178.4	0	113.6	R75 L283 L284 I285	R75-K287 WeakPolarHBondContact CD-O 3.45Å; L283-K287 WeakPolarHBondContact O-CG 3.46Å; L283-K287 PolarHBondContact O-N 3.27Å; L284-K287 PolarHBondContact O-N 3.46Å; I285-K287 PolarHBondContact O-N 3.45Å
288	I	88.9	Confident	87.4	Confident	45 Å²	45	61 Å²	61	23%	0.231	35%	0.346	C	S	.	.	H	α-helix	trans	-89.8	-45	-178.5	-63	169.5	0	0	0	110.3	F164 Y239 L284 I285	F164-I288 HydrophobicContact CZ-CG2 4.23Å; Y239-I288 HydrophobicContact CE1-CD1 4.46Å; Y239-I288 HydrophobicContact CE1-CG2 4.35Å; L284-I288 HydrophobicContact CD2-CD1 3.53Å; L284-I288 HydrophobicContact CG-CD1 4.32Å; L284-I288 WeakPolarHBondContact O-CG1 3.47Å; L284-I288 PolarHBondContact O-N 3.39Å; I285-I288 PolarHBondContact O-N 3.17Å; I285-I288 VanDerWaalsContact O-N 3.15Å
289	V	88.8	Confident	87.1	Confident	13 Å²	13	61.1 Å²	61.1	8%	0.079	35%	0.347	C	S	.	.	S	Bend	trans	-81.9	141.1	-175.9	179.4	0	0	0	0	110	V161 I285 P297	V161-V289 HydrophobicContact CB-CG1 3.96Å; V161-V289 HydrophobicContact CG1-CG1 3.82Å; V161-V289 HydrophobicContact CG2-CG1 3.96Å; I285-V289 HydrophobicContact CD1-CG2 3.61Å; I285-V289 HydrophobicContact CG1-CG2 3.88Å; I285-V289 PolarHBondContact O-N 3.02Å; V289-P297 HydrophobicContact CG1-CG 4.28Å; V289-P297 HydrophobicContact CG2-CG 4.36Å
290	P	89.2	Confident	87	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.032	34%	0.337	C	S	.	.			trans	-59.2	145.8	174.8	21.6	-32.9	0	0	0	112.5	E74 Q77 V161 T292	E74-P290 VanDerWaalsContact O-CB 3.25Å; E74-P290 WeakPolarHBondContact O-CB 3.38Å; E74-P290 WeakPolarHBondContact O-CD 3.26Å; E74-P290 WeakPolarHBondContact O-CG 3.43Å; Q77-P290 HydrophobicContact CG-CB 4.14Å; V161-P290 HydrophobicContact CG1-CG 3.9Å; P290-T292 HydrophobicContact CB-CG2 4.13Å; P290-T292 PolarHBondContact O-N 3.1Å
291	P	86.9	Confident	86.7	Confident	120 Å²	120	59.6 Å²	59.6	78%	0.779	33%	0.331	S	S	*	.			trans	-75.3	65	177.1	34.2	-36.6	0	0	0	110.9
292	T	85.4	Confident	86.6	Confident	44 Å²	44	57.7 Å²	57.7	27%	0.27	32%	0.323	S	S	.	.			trans	-107.1	141.8	178.4	55.1	0	0	0	0	110.7	Q77 P290	Q77-T292 VanDerWaalsContact NE2-CG2 3.3Å; P290-T292 HydrophobicContact CB-CG2 4.13Å; P290-T292 PolarHBondContact O-N 3.1Å
293	S	81.8	Confident	86.6	Confident	122 Å²	122	55.8 Å²	55.8	85%	0.853	31%	0.313	S	S	*	.	S	Bend	trans	-96.5	-2.7	179.2	56	0	0	0	0	113.9
294	L	79.2	Confident	86.5	Confident	110 Å²	110	55 Å²	55	58%	0.576	31%	0.307	S	S	*	.	S	Bend	trans	-63.6	-44.4	-176.2	-67.1	172.7	0	0	0	111.7
295	D	75.6	Confident	86.4	Confident	76 Å²	76	54.1 Å²	54.1	41%	0.406	30%	0.301	S	S	.	.			trans	-151.7	139.3	177.8	-88	-52.3	0	0	0	110.4
296	V	83.8	Confident	86.4	Confident	74 Å²	74	54.2 Å²	54.2	45%	0.448	30%	0.301	S	S	.	.			trans	-90	132.7	172.4	-179	0	0	0	0	108.8	K301	V296-K301 HydrophobicContact CB-CG 4.15Å; V296-K301 HydrophobicContact CG1-CG 3.91Å; V296-K301 VanDerWaalsContact O-CE 3.27Å; V296-K301 WeakPolarHBondContact O-CE 3.48Å
297	P	88.6	Confident	86.5	Confident	13 Å²	13	53.3 Å²	53.3	8%	0.084	29%	0.29	C	S	.	.			trans	-58.2	145.5	178.6	24.5	-35.4	0	0	0	111.3	V161 F164 V289 V299 G300 K301	V161-P297 WeakPolarHBondContact O-CA 3.49Å; V161-P297 WeakPolarHBondContact O-CB 3.44Å; F164-P297 HydrophobicContact CB-CB 4.32Å; V289-P297 HydrophobicContact CG1-CG 4.28Å; V289-P297 HydrophobicContact CG2-CG 4.36Å; P297-V299 VanDerWaalsContact C-N 3.26Å; P297-V299 PolarHBondContact O-N 3.17Å; P297-G300 WeakPolarHBondContact O-CA 3.17Å; P297-G300 PolarHBondContact O-N 3.33Å; P297-K301 PolarHBondContact O-N 3.46Å
298	L	85.3	Confident	86.6	Confident	25 Å²	25	49.9 Å²	49.9	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-54.8	-42.5	179.9	-176.3	68.9	0	0	0	112.6	K162 G300 K301 Y302 M481 P485	K162-L298 PolarHBondContact O-N 3.22Å; L298-G300 VanDerWaalsContact C-N 3.3Å; L298-G300 PolarHBondContact O-N 3.03Å; L298-K301 WeakPolarHBondContact O-CB 3.26Å; L298-K301 PolarHBondContact O-N 3.26Å; L298-Y302 PolarHBondContact O-N 2.92Å; L298-M481 HydrophobicContact CD1-CB 4.31Å; L298-P485 HydrophobicContact CD2-CG 3.31Å
299	V	85.6	Confident	86.7	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-38.7	176	177.7	0	0	0	0	111.6	L243 P297 Y302 L303	L243-V299 HydrophobicContact CD2-CG1 3.46Å; L243-V299 VanDerWaalsContact CD2-CG1 3.46Å; P297-V299 VanDerWaalsContact C-N 3.26Å; P297-V299 PolarHBondContact O-N 3.17Å; V299-Y302 WeakPolarHBondContact O-CB 3.41Å; V299-Y302 PolarHBondContact O-N 3.07Å; V299-L303 HydrophobicContact CG1-CD1 4.32Å; V299-L303 WeakPolarHBondContact O-CG 3.5Å; V299-L303 PolarHBondContact O-N 3.39Å
300	G	88	Confident	86.8	Confident	4 Å²	4	47.9 Å²	47.9	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-43.1	174.5	0	0	0	0	0	112.1	P297 L298 Y302 L303 M304	P297-G300 WeakPolarHBondContact O-CA 3.17Å; P297-G300 PolarHBondContact O-N 3.33Å; L298-G300 VanDerWaalsContact C-N 3.3Å; L298-G300 PolarHBondContact O-N 3.03Å; G300-Y302 VanDerWaalsContact C-N 3.3Å; G300-Y302 PolarHBondContact O-N 2.63Å; G300-L303 PolarHBondContact O-N 3.21Å; G300-M304 WeakPolarHBondContact O-CB 3.39Å; G300-M304 VanDerWaalsContact O-CG 3.28Å; G300-M304 WeakPolarHBondContact O-CG 3.38Å; G300-M304 PolarHBondContact O-N 3.43Å
301	K	87.6	Confident	86.9	Confident	89 Å²	89	50.8 Å²	50.8	39%	0.387	29%	0.288	S	S	.	.	H	α-helix	trans	-60	-41.5	173.6	-68.2	177	179.8	167	0	111.6	V296 P297 L298 M304 F305	V296-K301 HydrophobicContact CB-CG 4.15Å; V296-K301 HydrophobicContact CG1-CG 3.91Å; V296-K301 VanDerWaalsContact O-CE 3.27Å; V296-K301 WeakPolarHBondContact O-CE 3.48Å; P297-K301 PolarHBondContact O-N 3.46Å; L298-K301 WeakPolarHBondContact O-CB 3.26Å; L298-K301 PolarHBondContact O-N 3.26Å; K301-M304 PolarHBondContact O-N 3.17Å; K301-F305 WeakPolarHBondContact O-CB 3.38Å; K301-F305 PolarHBondContact O-N 3Å
302	Y	87.9	Confident	87.1	Confident	6 Å²	6	51.1 Å²	51.1	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-50	175.8	-178.7	-110.4	0	0	0	112	C247 T251 L298 V299 G300 M304 F305 T306 T478 M481 F482	C247-Y302 VanDerWaalsContact SG-CD1 3.56Å; C247-Y302 WeakPolarHBondContact SG-CE1 3.28Å; T251-Y302 WeakPolarHBondContact CB-OH 3.49Å; T251-Y302 HydrophobicContact CG2-CE1 3.91Å; T251-Y302 WeakPolarHBondContact CG2-OH 3.2Å; T251-Y302 PolarHBondContact OG1-OH 3.19Å; L298-Y302 PolarHBondContact O-N 2.92Å; V299-Y302 WeakPolarHBondContact O-CB 3.41Å; V299-Y302 PolarHBondContact O-N 3.07Å; G300-Y302 VanDerWaalsContact C-N 3.3Å; G300-Y302 PolarHBondContact O-N 2.63Å; Y302-M304 VanDerWaalsContact C-N 3.32Å; Y302-M304 PolarHBondContact O-N 2.9Å; Y302-F305 PolarHBondContact O-N 3.08Å; Y302-T306 HydrophobicContact CD1-CG2 4.25Å; Y302-T306 HydrophobicContact CD2-CG2 4.2Å; Y302-T306 HydrophobicContact CE1-CG2 3.92Å; Y302-T306 HydrophobicContact CE2-CG2 3.84Å; Y302-T306 HydrophobicContact CG-CG2 4.39Å; Y302-T306 WeakPolarHBondContact O-CG2 3.19Å; Y302-T306 PolarHBondContact O-N 3.37Å; Y302-T306 PolarHBondContact O-OG1 3.42Å; Y302-T478 HydrophobicContact CE2-CG2 3.53Å; Y302-T478 VanDerWaalsContact OH-CG2 3.27Å; Y302-T478 WeakPolarHBondContact OH-CG2 3.46Å; Y302-M481 HydrophobicContact CD2-SD 4.03Å; Y302-F482 HydrophobicContact CD1-CE2 4.23Å; Y302-F482 HydrophobicContact CD1-CZ 4.27Å; Y302-F482 AromaticContact CD2-CE2 3.85Å; Y302-F482 HydrophobicContact CD2-CE2 3.85Å; Y302-F482 HydrophobicContact CE1-CE2 4.32Å; Y302-F482 AromaticContact CE2-CE2 3.96Å; Y302-F482 HydrophobicContact CE2-CE2 3.96Å; Y302-F482 AromaticContact CG-CE2 3.99Å; Y302-F482 HydrophobicContact CG-CE2 3.99Å; Y302-F482 HydrophobicContact CG-CZ 4.25Å
303	L	88.3	Confident	87.3	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-42.9	176.5	-76.9	171.5	0	0	0	111.9	C247 L278 F281 L282 I285 V299 G300 T306 M307	C247-L303 WeakPolarHBondContact SG-CD2 3.36Å; L278-L303 HydrophobicContact CD2-CD2 3.91Å; F281-L303 HydrophobicContact CB-CD1 4.42Å; F281-L303 HydrophobicContact CB-CD2 4.3Å; L282-L303 HydrophobicContact CD1-CB 4.33Å; I285-L303 HydrophobicContact CG2-CD1 4.14Å; V299-L303 HydrophobicContact CG1-CD1 4.32Å; V299-L303 WeakPolarHBondContact O-CG 3.5Å; V299-L303 PolarHBondContact O-N 3.39Å; G300-L303 PolarHBondContact O-N 3.21Å; L303-T306 WeakPolarHBondContact CA-OG1 3.1Å; L303-T306 PolarHBondContact O-N 2.88Å; L303-T306 PolarHBondContact O-OG1 3.13Å; L303-M307 WeakPolarHBondContact O-CB 3.48Å; L303-M307 PolarHBondContact O-N 2.88Å
304	M	88.3	Confident	87.8	Confident	93 Å²	93	44.8 Å²	44.8	46%	0.458	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-45	176.2	-71.1	-62	-64.7	0	0	112.5	L282 G300 K301 Y302 T306 M307 V308	L282-M304 HydrophobicContact CD1-CG 4.48Å; L282-M304 HydrophobicContact CD1-SD 4.15Å; L282-M304 HydrophobicContact CD2-SD 3.69Å; G300-M304 WeakPolarHBondContact O-CB 3.39Å; G300-M304 VanDerWaalsContact O-CG 3.28Å; G300-M304 WeakPolarHBondContact O-CG 3.38Å; G300-M304 PolarHBondContact O-N 3.43Å; K301-M304 PolarHBondContact O-N 3.17Å; Y302-M304 VanDerWaalsContact C-N 3.32Å; Y302-M304 PolarHBondContact O-N 2.9Å; M304-T306 VanDerWaalsContact C-N 3.33Å; M304-T306 PolarHBondContact O-N 3.15Å; M304-M307 PolarHBondContact O-N 3.41Å; M304-V308 WeakPolarHBondContact O-CG2 3.48Å; M304-V308 PolarHBondContact O-N 3.5Å; M304-V308 VanDerWaalsContact O-N 3.08Å
305	F	89.2	Confident	88.4	Confident	60 Å²	60	44 Å²	44	26%	0.263	23%	0.232	S	C	.	.	H	α-helix	trans	-58.8	-45.6	174.7	170.1	-102.4	0	0	0	111.6	K301 Y302 M307 V308 L309 V473 M481	K301-F305 WeakPolarHBondContact O-CB 3.38Å; K301-F305 PolarHBondContact O-N 3Å; Y302-F305 PolarHBondContact O-N 3.08Å; F305-M307 PolarHBondContact O-N 3.31Å; F305-V308 PolarHBondContact O-N 3.46Å; F305-L309 HydrophobicContact CE1-CD1 4.21Å; F305-L309 HydrophobicContact CZ-CD1 4.09Å; F305-L309 WeakPolarHBondContact O-CB 3.2Å; F305-L309 PolarHBondContact O-N 3.12Å; F305-V473 HydrophobicContact CE2-CG1 4.39Å; F305-V473 HydrophobicContact CZ-CG1 3.8Å; F305-M481 HydrophobicContact CB-CE 3.8Å; F305-M481 HydrophobicContact CD1-CE 4.34Å; F305-M481 HydrophobicContact CD2-CE 4.29Å; F305-M481 HydrophobicContact CG-CE 3.89Å
306	T	88.5	Confident	89.1	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.043	22%	0.219	C	C	.	.	H	α-helix	trans	-66.5	-38	178.8	64.6	0	0	0	0	112	T251 Y302 L303 M304 V308 L309 V310	T251-T306 HydrophobicContact CG2-CG2 3.32Å; Y302-T306 HydrophobicContact CD1-CG2 4.25Å; Y302-T306 HydrophobicContact CD2-CG2 4.2Å; Y302-T306 HydrophobicContact CE1-CG2 3.92Å; Y302-T306 HydrophobicContact CE2-CG2 3.84Å; Y302-T306 HydrophobicContact CG-CG2 4.39Å; Y302-T306 WeakPolarHBondContact O-CG2 3.19Å; Y302-T306 PolarHBondContact O-N 3.37Å; Y302-T306 PolarHBondContact O-OG1 3.42Å; L303-T306 WeakPolarHBondContact CA-OG1 3.1Å; L303-T306 PolarHBondContact O-N 2.88Å; L303-T306 PolarHBondContact O-OG1 3.13Å; M304-T306 VanDerWaalsContact C-N 3.33Å; M304-T306 PolarHBondContact O-N 3.15Å; T306-V308 PolarHBondContact O-N 3.2Å; T306-L309 PolarHBondContact O-N 3.46Å; T306-V310 VanDerWaalsContact O-CG2 3.31Å; T306-V310 WeakPolarHBondContact O-CG2 3.41Å; T306-V310 PolarHBondContact O-N 3.17Å
307	M	90.9	Very high	89.5	Confident	55 Å²	55	38 Å²	38	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-61.3	-46.6	176.8	-175.1	175.8	177	0	0	111.3	L275 T279 L282 L303 M304 F305 L309 V310 T311	L275-M307 HydrophobicContact CD1-CG 4.06Å; T279-M307 HydrophobicContact CG2-CE 3.68Å; T279-M307 HydrophobicContact CG2-SD 4.25Å; L282-M307 HydrophobicContact CD2-SD 4.22Å; L303-M307 WeakPolarHBondContact O-CB 3.48Å; L303-M307 PolarHBondContact O-N 2.88Å; M304-M307 PolarHBondContact O-N 3.41Å; F305-M307 PolarHBondContact O-N 3.31Å; M307-L309 VanDerWaalsContact C-N 3.34Å; M307-L309 PolarHBondContact O-N 3.16Å; M307-V310 PolarHBondContact O-N 3.33Å; M307-T311 PolarHBondContact O-N 3.29Å; M307-T311 PolarHBondContact O-OG1 3.47Å
308	V	91.8	Very high	89.6	Confident	76 Å²	76	40.9 Å²	40.9	46%	0.461	22%	0.215	S	C	.	.	H	α-helix	trans	-60.3	-45	174.9	172	0	0	0	0	110.9	M304 F305 T306 V310 T311 F312	M304-V308 WeakPolarHBondContact O-CG2 3.48Å; M304-V308 PolarHBondContact O-N 3.5Å; M304-V308 VanDerWaalsContact O-N 3.08Å; F305-V308 PolarHBondContact O-N 3.46Å; T306-V308 PolarHBondContact O-N 3.2Å; V308-V310 PolarHBondContact O-N 3.45Å; V308-T311 PolarHBondContact O-N 3.36Å; V308-F312 HydrophobicContact CG1-CD2 3.76Å; V308-F312 HydrophobicContact CG1-CE2 3.45Å; V308-F312 VanDerWaalsContact CG1-CE2 3.45Å; V308-F312 WeakPolarHBondContact O-CD2 3.35Å; V308-F312 PolarHBondContact O-N 2.82Å
309	L	89.4	Confident	90	Very high	13 Å²	13	43 Å²	43	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-42	178.2	-173.7	142.4	0	0	0	112.3	F305 T306 M307 F312 S313 F470 V473 C474	F305-L309 HydrophobicContact CE1-CD1 4.21Å; F305-L309 HydrophobicContact CZ-CD1 4.09Å; F305-L309 WeakPolarHBondContact O-CB 3.2Å; F305-L309 PolarHBondContact O-N 3.12Å; T306-L309 PolarHBondContact O-N 3.46Å; M307-L309 VanDerWaalsContact C-N 3.34Å; M307-L309 PolarHBondContact O-N 3.16Å; L309-F312 PolarHBondContact O-N 2.88Å; L309-S313 WeakPolarHBondContact O-CB 3.47Å; L309-S313 PolarHBondContact O-N 3.24Å; L309-F470 HydrophobicContact CD1-CD1 4.09Å; L309-F470 HydrophobicContact CD2-CD1 3.65Å; L309-F470 HydrophobicContact CD2-CE1 4.03Å; L309-F470 HydrophobicContact CG-CD1 3.64Å; L309-F470 HydrophobicContact CG-CE1 3.76Å; L309-F470 WeakPolarHBondContact O-CE1 3.47Å; L309-V473 HydrophobicContact CD1-CB 4.37Å; L309-V473 HydrophobicContact CD1-CG1 3.66Å; L309-C474 VanDerWaalsContact CD1-SG 3.52Å
310	V	90.6	Very high	90.3	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-38.5	175.2	173.9	0	0	0	0	111.4	A254 V274 L275 L278 T306 M307 V308 S313 I314	A254-V310 HydrophobicContact CB-CG2 3.71Å; V274-V310 HydrophobicContact CG1-CG1 4.29Å; V274-V310 HydrophobicContact CG1-CG2 4.11Å; L275-V310 HydrophobicContact CB-CG1 4.04Å; L275-V310 HydrophobicContact CD1-CG1 4.25Å; L278-V310 HydrophobicContact CD1-CB 4.24Å; L278-V310 HydrophobicContact CD1-CG2 3.62Å; T306-V310 VanDerWaalsContact O-CG2 3.31Å; T306-V310 WeakPolarHBondContact O-CG2 3.41Å; T306-V310 PolarHBondContact O-N 3.17Å; M307-V310 PolarHBondContact O-N 3.33Å; V308-V310 PolarHBondContact O-N 3.45Å; V310-S313 WeakPolarHBondContact O-CB 3.46Å; V310-S313 PolarHBondContact O-N 3.49Å; V310-S313 VanDerWaalsContact O-N 3.17Å; V310-I314 HydrophobicContact CG1-CD1 4.11Å; V310-I314 WeakPolarHBondContact O-CG1 3.31Å; V310-I314 PolarHBondContact O-N 3.28Å
311	T	91.4	Very high	90.4	Very high	65 Å²	65	45 Å²	45	40%	0.399	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-45.6	174.3	-56	0	0	0	0	111.6	M307 V308 S313 I314 V315	M307-T311 PolarHBondContact O-N 3.29Å; M307-T311 PolarHBondContact O-OG1 3.47Å; V308-T311 PolarHBondContact O-N 3.36Å; T311-S313 VanDerWaalsContact C-N 3.29Å; T311-S313 PolarHBondContact O-N 2.85Å; T311-I314 PolarHBondContact O-N 3.17Å; T311-V315 WeakPolarHBondContact O-CG2 3.48Å; T311-V315 PolarHBondContact O-N 3.23Å; T311-V315 VanDerWaalsContact O-N 3.17Å
312	F	91.4	Very high	90.6	Very high	127 Å²	127	45.3 Å²	45.3	56%	0.557	25%	0.247	S	C	*	.	H	α-helix	trans	-62	-39	173.4	-75.3	-60.6	0	0	0	111.9	V308 L309 I314 V315 T316 F470	V308-F312 HydrophobicContact CG1-CD2 3.76Å; V308-F312 HydrophobicContact CG1-CE2 3.45Å; V308-F312 VanDerWaalsContact CG1-CE2 3.45Å; V308-F312 WeakPolarHBondContact O-CD2 3.35Å; V308-F312 PolarHBondContact O-N 2.82Å; L309-F312 PolarHBondContact O-N 2.88Å; F312-I314 PolarHBondContact O-N 3.33Å; F312-V315 PolarHBondContact O-N 2.82Å; F312-T316 WeakPolarHBondContact O-CG2 3.49Å; F312-T316 PolarHBondContact O-N 3.48Å; F312-T316 PolarHBondContact O-OG1 3Å; F312-F470 HydrophobicContact CB-CE1 4.41Å; F312-F470 HydrophobicContact CB-CZ 4.17Å
313	S	90.2	Very high	90.8	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-44	175.6	172.3	0	0	0	0	112.6	F258 L309 V310 T311 V315 T316 S317	F258-S313 VanDerWaalsContact CE2-OG 3.23Å; F258-S313 WeakPolarHBondContact CE2-OG 3.28Å; F258-S313 WeakPolarHBondContact CZ-OG 3.32Å; L309-S313 WeakPolarHBondContact O-CB 3.47Å; L309-S313 PolarHBondContact O-N 3.24Å; V310-S313 WeakPolarHBondContact O-CB 3.46Å; V310-S313 PolarHBondContact O-N 3.49Å; V310-S313 VanDerWaalsContact O-N 3.17Å; T311-S313 VanDerWaalsContact C-N 3.29Å; T311-S313 PolarHBondContact O-N 2.85Å; S313-V315 PolarHBondContact O-N 3.06Å; S313-T316 WeakPolarHBondContact CA-OG1 3.42Å; S313-T316 PolarHBondContact O-N 3.49Å; S313-T316 PolarHBondContact O-OG1 3.38Å; S313-S317 WeakPolarHBondContact O-CB 3.46Å; S313-S317 PolarHBondContact O-N 3.36Å; S313-S317 PolarHBondContact O-OG 3.24Å
314	I	91.6	Very high	90.9	Very high	30 Å²	30	45.9 Å²	45.9	15%	0.154	25%	0.25	C	S	.	.	H	α-helix	trans	-58.9	-49.5	175.3	-70	160.4	0	0	0	110.8	M268 C271 L275 V310 T311 F312 T316 S317 V318	M268-I314 HydrophobicContact CE-CG2 4.33Å; C271-I314 HydrophobicContact CB-CD1 4.41Å; C271-I314 HydrophobicContact CB-CG1 3.62Å; L275-I314 HydrophobicContact CB-CD1 4.17Å; L275-I314 HydrophobicContact CD2-CD1 3.77Å; L275-I314 HydrophobicContact CG-CD1 4.47Å; V310-I314 HydrophobicContact CG1-CD1 4.11Å; V310-I314 WeakPolarHBondContact O-CG1 3.31Å; V310-I314 PolarHBondContact O-N 3.28Å; T311-I314 PolarHBondContact O-N 3.17Å; F312-I314 PolarHBondContact O-N 3.33Å; I314-T316 VanDerWaalsContact C-N 3.35Å; I314-T316 PolarHBondContact O-N 3.35Å; I314-S317 PolarHBondContact O-N 3.42Å; I314-V318 WeakPolarHBondContact O-CG2 3.22Å; I314-V318 PolarHBondContact O-N 3.33Å
315	V	92.8	Very high	90.9	Very high	95 Å²	95	47.7 Å²	47.7	58%	0.576	26%	0.257	S	S	*	.	H	α-helix	trans	-61	-44.8	-179.4	175.1	0	0	0	0	111	T311 F312 S313 S317 V318 C319	T311-V315 WeakPolarHBondContact O-CG2 3.48Å; T311-V315 PolarHBondContact O-N 3.23Å; T311-V315 VanDerWaalsContact O-N 3.17Å; F312-V315 PolarHBondContact O-N 2.82Å; S313-V315 PolarHBondContact O-N 3.06Å; V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 2.93Å; V315-V318 PolarHBondContact O-N 3.43Å; V315-C319 PolarHBondContact O-N 3.49Å
316	T	90.9	Very high	90.9	Very high	23 Å²	23	48.1 Å²	48.1	14%	0.141	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-37.3	176.2	57.7	0	0	0	0	112.4	F258 F312 S313 I314 C319 V320 F466	F258-T316 WeakPolarHBondContact CE1-OG1 3.41Å; F312-T316 WeakPolarHBondContact O-CG2 3.49Å; F312-T316 PolarHBondContact O-N 3.48Å; F312-T316 PolarHBondContact O-OG1 3Å; S313-T316 WeakPolarHBondContact CA-OG1 3.42Å; S313-T316 PolarHBondContact O-N 3.49Å; S313-T316 PolarHBondContact O-OG1 3.38Å; I314-T316 VanDerWaalsContact C-N 3.35Å; I314-T316 PolarHBondContact O-N 3.35Å; T316-C319 WeakPolarHBondContact O-CB 3.22Å; T316-C319 PolarHBondContact O-N 2.99Å; T316-V320 WeakPolarHBondContact O-CG2 3.38Å; T316-V320 PolarHBondContact O-N 3.27Å; T316-F466 HydrophobicContact CG2-CD1 4.14Å; T316-F466 HydrophobicContact CG2-CE1 3.9Å; T316-F466 HydrophobicContact CG2-CE2 4.29Å; T316-F466 HydrophobicContact CG2-CG 4.47Å; T316-F466 HydrophobicContact CG2-CZ 3.98Å
317	S	90.5	Very high	90.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-40.6	177	-67.9	0	0	0	0	112.3	S313 I314 V315 C319 V320 L321	S313-S317 WeakPolarHBondContact O-CB 3.46Å; S313-S317 PolarHBondContact O-N 3.36Å; S313-S317 PolarHBondContact O-OG 3.24Å; I314-S317 PolarHBondContact O-N 3.42Å; V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 2.93Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 3.3Å; S317-V320 PolarHBondContact O-N 3.01Å; S317-L321 WeakPolarHBondContact O-CB 3.4Å; S317-L321 PolarHBondContact O-N 3.36Å
318	V	92.4	Very high	90.4	Very high	73 Å²	73	48.6 Å²	48.6	44%	0.442	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-40.9	172.2	174.3	0	0	0	0	110.8	M268 I314 V315 L321 N322	M268-V318 HydrophobicContact CE-CG2 3.41Å; M268-V318 VanDerWaalsContact CE-CG2 3.41Å; M268-V318 HydrophobicContact SD-CG2 3.93Å; I314-V318 WeakPolarHBondContact O-CG2 3.22Å; I314-V318 PolarHBondContact O-N 3.33Å; V315-V318 PolarHBondContact O-N 3.43Å; V318-L321 PolarHBondContact O-N 3.05Å; V318-N322 WeakPolarHBondContact O-CB 3.4Å; V318-N322 PolarHBondContact O-N 3.27Å
319	C	92	Very high	90.1	Very high	71 Å²	71	50.5 Å²	50.5	48%	0.48	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-46.2	176.2	-171.6	0	0	0	0	112	V315 T316 S317 L321 N322 V323	V315-C319 PolarHBondContact O-N 3.49Å; T316-C319 WeakPolarHBondContact O-CB 3.22Å; T316-C319 PolarHBondContact O-N 2.99Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 3.3Å; C319-L321 VanDerWaalsContact C-N 3.33Å; C319-L321 PolarHBondContact O-N 3.24Å; C319-N322 WeakPolarHBondContact O-CB 3.46Å; C319-N322 PolarHBondContact O-N 2.92Å; C319-V323 WeakPolarHBondContact O-CG2 3.19Å; C319-V323 PolarHBondContact O-N 3.46Å
320	V	91.8	Very high	90	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-43.4	176	170.9	0	0	0	0	110.9	T316 S317 N322 V323 H324 A459 I462 D463	T316-V320 WeakPolarHBondContact O-CG2 3.38Å; T316-V320 PolarHBondContact O-N 3.27Å; S317-V320 PolarHBondContact O-N 3.01Å; V320-N322 VanDerWaalsContact C-N 3.35Å; V320-N322 PolarHBondContact O-N 2.97Å; V320-V323 PolarHBondContact O-N 3.31Å; V320-H324 WeakPolarHBondContact O-CB 3.46Å; V320-H324 PolarHBondContact O-N 2.93Å; V320-A459 HydrophobicContact CG1-CB 4.26Å; V320-I462 HydrophobicContact CG2-CB 4.29Å; V320-I462 HydrophobicContact CG2-CG2 3.63Å; V320-D463 HydrophobicContact CG1-CB 4.28Å
321	L	91.5	Very high	89.9	Confident	51 Å²	51	58.1 Å²	58.1	27%	0.267	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-40.8	177.4	-170.5	66.2	0	0	0	111.7	M268 S317 V318 C319 V323 H324 H325	M268-L321 HydrophobicContact CG-CD2 4.24Å; S317-L321 WeakPolarHBondContact O-CB 3.4Å; S317-L321 PolarHBondContact O-N 3.36Å; V318-L321 PolarHBondContact O-N 3.05Å; C319-L321 VanDerWaalsContact C-N 3.33Å; C319-L321 PolarHBondContact O-N 3.24Å; L321-V323 VanDerWaalsContact C-N 3.33Å; L321-V323 PolarHBondContact O-N 3.48Å; L321-H324 WeakPolarHBondContact O-CB 3.45Å; L321-H324 PolarHBondContact O-N 2.9Å; L321-H325 PolarHBondContact O-CD2 3.23Å; L321-H325 PolarHBondContact O-N 3.01Å; L321-H325 VanDerWaalsContact O-N 3.16Å
322	N	92.3	Very high	89.6	Confident	95 Å²	95	61.2 Å²	61.2	51%	0.508	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-41.4	174.2	-175.9	19.5	0	0	0	111.6	V318 C319 V320 R326	V318-N322 WeakPolarHBondContact O-CB 3.4Å; V318-N322 PolarHBondContact O-N 3.27Å; C319-N322 WeakPolarHBondContact O-CB 3.46Å; C319-N322 PolarHBondContact O-N 2.92Å; V320-N322 VanDerWaalsContact C-N 3.35Å; V320-N322 PolarHBondContact O-N 2.97Å; N322-R326 WeakPolarHBondContact O-CG 3.23Å
323	V	90.8	Very high	89.3	Confident	11 Å²	11	56.2 Å²	56.2	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-38.9	175.7	177.7	0	0	0	0	111.6	C319 V320 L321 H325 R326 W455 V458 A459 I462	C319-V323 WeakPolarHBondContact O-CG2 3.19Å; C319-V323 PolarHBondContact O-N 3.46Å; V320-V323 PolarHBondContact O-N 3.31Å; L321-V323 VanDerWaalsContact C-N 3.33Å; L321-V323 PolarHBondContact O-N 3.48Å; V323-H325 PolarHBondContact O-N 3.25Å; V323-R326 PolarHBondContact O-N 3.17Å; V323-W455 HydrophobicContact CG1-CE3 3.7Å; V323-W455 HydrophobicContact CG1-CZ3 3.94Å; V323-V458 HydrophobicContact CG1-CG1 4.14Å; V323-A459 HydrophobicContact CB-CB 4.4Å; V323-A459 HydrophobicContact CG1-CB 4.16Å; V323-I462 HydrophobicContact CG1-CD1 4.31Å; V323-I462 HydrophobicContact CG2-CD1 4.47Å
324	H	90.2	Very high	89.3	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-39.5	-179	-178.4	-101.6	0	0	0	113.3	S262 D263 V320 L321 R326 A459	S262-H324 PolarHBondContact OG-CD2 3.42Å; S262-H324 VanDerWaalsContact OG-CG 3.24Å; S262-H324 PolarHBondContact OG-NE2 2.95Å; D263-H324 IonicContact OD1-CE1 3.75Å; D263-H324 PolarHBondContact OD1-CE1 3.15Å; D263-H324 IonicContact OD1-NE2 3.58Å; D263-H324 PolarHBondContact OD1-NE2 3.39Å; V320-H324 WeakPolarHBondContact O-CB 3.46Å; V320-H324 PolarHBondContact O-N 2.93Å; L321-H324 WeakPolarHBondContact O-CB 3.45Å; L321-H324 PolarHBondContact O-N 2.9Å; H324-R326 VanDerWaalsContact C-N 3.32Å; H324-R326 PolarHBondContact O-N 3.5Å; H324-A459 HydrophobicContact CB-CB 3.85Å
325	H	88.7	Confident	89	Confident	131 Å²	131	62 Å²	62	61%	0.606	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	13.6	-178.8	-72	-77.2	0	0	0	114.2	L321 V323 S327	L321-H325 PolarHBondContact O-CD2 3.23Å; L321-H325 PolarHBondContact O-N 3.01Å; L321-H325 VanDerWaalsContact O-N 3.16Å; V323-H325 PolarHBondContact O-N 3.25Å; H325-S327 PolarHBondContact O-N 3.48Å
326	R	90.3	Very high	88.8	Confident	69 Å²	69	65 Å²	65	26%	0.26	36%	0.357	S	S	.	.			trans	-71.9	127.1	174.4	-71.9	-178.4	-178	-176.9	-1.4	111.2	N322 V323 H324 W455	N322-R326 WeakPolarHBondContact O-CG 3.23Å; V323-R326 PolarHBondContact O-N 3.17Å; H324-R326 VanDerWaalsContact C-N 3.32Å; H324-R326 PolarHBondContact O-N 3.5Å; R326-W455 HydrophobicContact CB-CD2 3.91Å; R326-W455 HydrophobicContact CB-CE3 4.28Å; R326-W455 HydrophobicContact CB-CG 4.07Å; R326-W455 VanDerWaalsContact NH1-CH2 3.33Å
327	S	85.5	Confident	88.7	Confident	36 Å²	36	64.5 Å²	64.5	25%	0.252	35%	0.353	S	S	.	.			trans	-97.8	152.5	173.8	70.3	0	0	0	0	111.6	H325 T329 T330 H331	H325-S327 PolarHBondContact O-N 3.48Å; S327-T329 PolarHBondContact O-N 2.96Å; S327-T329 PolarHBondContact OG-OG1 2.99Å; S327-T330 PolarHBondContact O-N 3.36Å; S327-T330 PolarHBondContact O-OG1 3.26Å; S327-T330 WeakPolarHBondContact OG-CG2 3.36Å; S327-T330 PolarHBondContact OG-N 3.44Å; S327-T330 PolarHBondContact OG-OG1 2.99Å; S327-H331 PolarHBondContact O-N 3.33Å; S327-H331 VanDerWaalsContact O-N 3.12Å
328	P	83.5	Confident	88.4	Confident	35 Å²	35	69 Å²	69	23%	0.227	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.2	174.2	24.8	-34.2	0	0	0	113.2	T330 D448 V451	P328-T330 VanDerWaalsContact C-N 3.34Å; P328-T330 PolarHBondContact O-N 3.03Å; P328-D448 HydrophobicContact CG-CB 3.83Å; P328-V451 HydrophobicContact CB-CB 4.15Å; P328-V451 HydrophobicContact CB-CG1 3.92Å
329	T	83.9	Confident	88	Confident	117 Å²	117	70.2 Å²	70.2	72%	0.718	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-25.5	179.2	55	0	0	0	0	113.8	S327	S327-T329 PolarHBondContact O-N 2.96Å; S327-T329 PolarHBondContact OG-OG1 2.99Å
330	T	88	Confident	87.8	Confident	94 Å²	94	69.3 Å²	69.3	58%	0.577	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-32.4	-176.2	56.9	0	0	0	0	112.9	S327 P328	S327-T330 PolarHBondContact O-N 3.36Å; S327-T330 PolarHBondContact O-OG1 3.26Å; S327-T330 WeakPolarHBondContact OG-CG2 3.36Å; S327-T330 PolarHBondContact OG-N 3.44Å; S327-T330 PolarHBondContact OG-OG1 2.99Å; P328-T330 VanDerWaalsContact C-N 3.34Å; P328-T330 PolarHBondContact O-N 3.03Å
331	H	88.1	Confident	87.6	Confident	83 Å²	83	70.9 Å²	70.9	38%	0.384	38%	0.376	S	S	.	.			trans	-134.8	132	-173	-67.6	79.1	0	0	0	112.1	S327 W455	S327-H331 PolarHBondContact O-N 3.33Å; S327-H331 VanDerWaalsContact O-N 3.12Å; H331-W455 HydrophobicContact CB-CZ2 4.39Å
332	T	85.3	Confident	87.1	Confident	129 Å²	129	69.3 Å²	69.3	79%	0.791	37%	0.367	S	S	*	.			trans	-91.1	137.5	171.1	56.3	0	0	0	0	110.4	P334	T332-P334 VanDerWaalsContact O-CD 3.26Å; T332-P334 WeakPolarHBondContact O-CD 3.46Å
333	M	86.1	Confident	86.5	Confident	22 Å²	22	69.5 Å²	69.5	11%	0.108	37%	0.368	C	S	.	.			trans	-83.9	113.6	-177.2	-174	151.5	134.9	0	0	111.3	V337 K338 L342 D454 W455 V458	M333-V337 HydrophobicContact CG-CB 4.43Å; M333-V337 HydrophobicContact CG-CG1 4.34Å; M333-K338 HydrophobicContact CE-CB 4.3Å; M333-K338 HydrophobicContact CE-CD 4.1Å; M333-K338 HydrophobicContact CE-CG 3.56Å; M333-K338 HydrophobicContact CG-CG 4.02Å; M333-L342 HydrophobicContact CE-CD1 3.4Å; M333-L342 HydrophobicContact CE-CD2 4.39Å; M333-L342 HydrophobicContact CE-CG 3.95Å; M333-D454 HydrophobicContact CE-CB 4.23Å; M333-D454 HydrophobicContact SD-CB 4.47Å; M333-W455 HydrophobicContact CB-CZ2 3.92Å; M333-W455 HydrophobicContact CG-CZ2 4.21Å; M333-W455 HydrophobicContact SD-CD2 4.37Å; M333-W455 HydrophobicContact SD-CZ2 4.47Å; M333-V458 HydrophobicContact CE-CG2 4.24Å
334	P	88.6	Confident	86.2	Confident	43 Å²	43	76.1 Å²	76.1	28%	0.279	40%	0.396	S	S	.	.			trans	-63.8	147.7	-177.4	-21.4	33.3	0	0	0	112.4	T332 W336 V337 K338	T332-P334 VanDerWaalsContact O-CD 3.26Å; T332-P334 WeakPolarHBondContact O-CD 3.46Å; P334-W336 VanDerWaalsContact C-N 3.25Å; P334-W336 VanDerWaalsContact CB-CD1 3.47Å; P334-W336 HydrophobicContact CB-CG 4.32Å; P334-W336 PolarHBondContact O-N 3.4Å; P334-V337 HydrophobicContact CB-CG2 4.12Å; P334-V337 HydrophobicContact CG-CG2 4.04Å; P334-V337 WeakPolarHBondContact O-CB 3.31Å; P334-V337 PolarHBondContact O-N 3.42Å; P334-V337 VanDerWaalsContact O-N 3.11Å; P334-K338 PolarHBondContact O-N 2.84Å
335	P	85.9	Confident	85.9	Confident	112 Å²	112	76.8 Å²	76.8	73%	0.727	40%	0.4	S	S	*	.	H	α-helix	trans	-58.6	-34.4	-179.1	-25.5	34.1	0	0	0	114	K338 L339	P335-K338 WeakPolarHBondContact O-CB 3.43Å; P335-K338 PolarHBondContact O-N 3.18Å; P335-L339 PolarHBondContact O-N 2.96Å
336	W	89.4	Confident	85.6	Confident	159 Å²	159	70.8 Å²	70.8	60%	0.602	37%	0.373	S	S	*	.	H	α-helix	trans	-67.8	-35.5	178.9	71.1	-97.7	0	0	0	112.4	P334 K338 L339 V340 F341	P334-W336 VanDerWaalsContact C-N 3.25Å; P334-W336 VanDerWaalsContact CB-CD1 3.47Å; P334-W336 HydrophobicContact CB-CG 4.32Å; P334-W336 PolarHBondContact O-N 3.4Å; W336-K338 VanDerWaalsContact C-N 3.31Å; W336-K338 PolarHBondContact O-N 2.84Å; W336-L339 PolarHBondContact O-N 3.48Å; W336-V340 WeakPolarHBondContact O-CG2 3.34Å; W336-V340 PolarHBondContact O-N 3.29Å; W336-F341 AromaticContact CZ3-CE2 3.99Å; W336-F341 HydrophobicContact CZ3-CE2 3.99Å
337	V	88.6	Confident	85.2	Confident	11 Å²	11	70.9 Å²	70.9	7%	0.067	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-41.4	176.8	176.1	0	0	0	0	109.8	M333 P334 L339 V340 F341 V458	M333-V337 HydrophobicContact CG-CB 4.43Å; M333-V337 HydrophobicContact CG-CG1 4.34Å; P334-V337 HydrophobicContact CB-CG2 4.12Å; P334-V337 HydrophobicContact CG-CG2 4.04Å; P334-V337 WeakPolarHBondContact O-CB 3.31Å; P334-V337 PolarHBondContact O-N 3.42Å; P334-V337 VanDerWaalsContact O-N 3.11Å; V337-L339 PolarHBondContact O-N 2.95Å; V337-V340 PolarHBondContact O-N 3.47Å; V337-F341 HydrophobicContact CB-CD2 4.48Å; V337-F341 HydrophobicContact CG1-CD2 3.87Å; V337-F341 WeakPolarHBondContact O-CB 3.28Å; V337-F341 PolarHBondContact O-N 2.9Å; V337-V458 HydrophobicContact CG1-CG1 4.26Å; V337-V458 HydrophobicContact CG1-CG2 4.41Å
338	K	83.8	Confident	85.2	Confident	94 Å²	94	75 Å²	75	41%	0.409	41%	0.407	S	S	.	.	I	π-helix	trans	-59.5	-46.9	175.9	-50.8	-156	172.7	-177.2	0	111.1	M333 P334 P335 W336 L342	M333-K338 HydrophobicContact CE-CB 4.3Å; M333-K338 HydrophobicContact CE-CD 4.1Å; M333-K338 HydrophobicContact CE-CG 3.56Å; M333-K338 HydrophobicContact CG-CG 4.02Å; P334-K338 PolarHBondContact O-N 2.84Å; P335-K338 WeakPolarHBondContact O-CB 3.43Å; P335-K338 PolarHBondContact O-N 3.18Å; W336-K338 VanDerWaalsContact C-N 3.31Å; W336-K338 PolarHBondContact O-N 2.84Å; K338-L342 HydrophobicContact CB-CD1 4.14Å; K338-L342 HydrophobicContact CG-CD1 4.48Å; K338-L342 WeakPolarHBondContact O-CB 3.41Å; K338-L342 PolarHBondContact O-N 3.35Å; K338-L342 VanDerWaalsContact O-N 3.14Å
339	L	84.4	Confident	85.1	Confident	99 Å²	99	74.7 Å²	74.7	52%	0.518	40%	0.403	S	S	.	.	I	π-helix	trans	-68.3	-41.6	-177	-164	147.8	0	0	0	112.3	P335 W336 V337 N343 K344	P335-L339 PolarHBondContact O-N 2.96Å; W336-L339 PolarHBondContact O-N 3.48Å; V337-L339 PolarHBondContact O-N 2.95Å; L339-N343 WeakPolarHBondContact O-CB 3.42Å; L339-K344 HydrophobicContact CD2-CG 4.05Å; L339-K344 PolarHBondContact O-N 3.31Å; L339-K344 VanDerWaalsContact O-N 3.15Å
340	V	87.8	Confident	85	Confident	53 Å²	53	78.4 Å²	78.4	32%	0.321	41%	0.41	S	S	.	.	I	π-helix	trans	-77.5	-55	-176.6	175.4	0	0	0	0	111.7	W336 V337 K344 L345	W336-V340 WeakPolarHBondContact O-CG2 3.34Å; W336-V340 PolarHBondContact O-N 3.29Å; V337-V340 PolarHBondContact O-N 3.47Å; V340-K344 PolarHBondContact O-N 3.17Å; V340-L345 HydrophobicContact CG1-CD1 3.78Å; V340-L345 HydrophobicContact CG1-CG 4.24Å; V340-L345 WeakPolarHBondContact O-CB 3.3Å; V340-L345 PolarHBondContact O-N 3.43Å
341	F	86.4	Confident	84.5	Confident	35 Å²	35	76 Å²	76	15%	0.154	39%	0.392	C	S	.	.	I	π-helix	trans	-89.1	-24.1	-170.2	-67.4	-79	0	0	0	114.5	W336 V337 L345 P346 V458 V461 I462	W336-F341 AromaticContact CZ3-CE2 3.99Å; W336-F341 HydrophobicContact CZ3-CE2 3.99Å; V337-F341 HydrophobicContact CB-CD2 4.48Å; V337-F341 HydrophobicContact CG1-CD2 3.87Å; V337-F341 WeakPolarHBondContact O-CB 3.28Å; V337-F341 PolarHBondContact O-N 2.9Å; F341-L345 HydrophobicContact CD1-CD1 3.34Å; F341-L345 HydrophobicContact CE1-CD1 3.43Å; F341-L345 VanDerWaalsContact CE1-CD1 3.43Å; F341-L345 HydrophobicContact CG-CD1 4.12Å; F341-L345 HydrophobicContact CZ-CD1 4.3Å; F341-P346 VanDerWaalsContact O-CD 3.22Å; F341-P346 WeakPolarHBondContact O-CD 3.46Å; F341-P346 WeakPolarHBondContact O-CG 3.26Å; F341-V458 HydrophobicContact CB-CB 4.46Å; F341-V458 HydrophobicContact CB-CG1 3.94Å; F341-V458 HydrophobicContact CB-CG2 4.02Å; F341-V458 HydrophobicContact CD2-CG1 4.44Å; F341-V458 HydrophobicContact CG-CG1 4.06Å; F341-V461 HydrophobicContact CD1-CG1 4.35Å; F341-I462 HydrophobicContact CD1-CD1 4.32Å; F341-I462 HydrophobicContact CD1-CG1 3.67Å; F341-I462 HydrophobicContact CE1-CD1 4.06Å; F341-I462 HydrophobicContact CE1-CG1 3.41Å; F341-I462 VanDerWaalsContact CE1-CG1 3.41Å; F341-I462 HydrophobicContact CZ-CD1 4.36Å; F341-I462 HydrophobicContact CZ-CG1 4.14Å
342	L	81.6	Confident	83.5	Confident	17 Å²	17	82.8 Å²	82.8	9%	0.089	42%	0.415	C	S	.	.	I	π-helix	trans	-92.4	-31.3	175.6	-57.2	176.5	0	0	0	113.3	M333 K338 Y457 V458	M333-L342 HydrophobicContact CE-CD1 3.4Å; M333-L342 HydrophobicContact CE-CD2 4.39Å; M333-L342 HydrophobicContact CE-CG 3.95Å; K338-L342 HydrophobicContact CB-CD1 4.14Å; K338-L342 HydrophobicContact CG-CD1 4.48Å; K338-L342 WeakPolarHBondContact O-CB 3.41Å; K338-L342 PolarHBondContact O-N 3.35Å; K338-L342 VanDerWaalsContact O-N 3.14Å; L342-Y457 HydrophobicContact CD2-CD1 3.59Å; L342-Y457 HydrophobicContact CD2-CE1 4.15Å; L342-V458 HydrophobicContact CD2-CG2 3.84Å; L342-V458 HydrophobicContact CG-CG2 4.36Å
343	N	79.5	Confident	82.4	Confident	100 Å²	100	80.2 Å²	80.2	54%	0.535	39%	0.394	S	S	.	.	I	π-helix	trans	-109.8	-55.1	-173.1	-62.6	-25.3	0	0	0	113.2	L339	L339-N343 WeakPolarHBondContact O-CB 3.42Å
344	K	83.9	Confident	81.1	Confident	149 Å²	149	82.6 Å²	82.6	65%	0.648	41%	0.411	S	S	*	.	I	π-helix	trans	-77.8	-49.8	-171	-69.5	-72.5	-173.7	177.3	0	113.6	L339 V340 A347 L348	L339-K344 HydrophobicContact CD2-CG 4.05Å; L339-K344 PolarHBondContact O-N 3.31Å; L339-K344 VanDerWaalsContact O-N 3.15Å; V340-K344 PolarHBondContact O-N 3.17Å; K344-A347 PolarHBondContact O-N 2.91Å; K344-L348 PolarHBondContact O-N 3.02Å
345	L	84.1	Confident	79.2	Confident	25 Å²	25	88.9 Å²	88.9	13%	0.131	43%	0.429	C	S	.	.	H	α-helix	trans	-69.3	-41.1	-176.3	-80	170	0	0	0	114.3	V340 F341 A347 L348 L349 V461 L465	V340-L345 HydrophobicContact CG1-CD1 3.78Å; V340-L345 HydrophobicContact CG1-CG 4.24Å; V340-L345 WeakPolarHBondContact O-CB 3.3Å; V340-L345 PolarHBondContact O-N 3.43Å; F341-L345 HydrophobicContact CD1-CD1 3.34Å; F341-L345 HydrophobicContact CE1-CD1 3.43Å; F341-L345 VanDerWaalsContact CE1-CD1 3.43Å; F341-L345 HydrophobicContact CG-CD1 4.12Å; F341-L345 HydrophobicContact CZ-CD1 4.3Å; L345-A347 VanDerWaalsContact C-N 3.27Å; L345-A347 PolarHBondContact O-N 2.99Å; L345-L348 HydrophobicContact CD2-CD2 4.34Å; L345-L348 WeakPolarHBondContact O-CB 3.41Å; L345-L348 PolarHBondContact O-N 2.91Å; L345-L348 VanDerWaalsContact O-N 3.15Å; L345-L349 WeakPolarHBondContact O-CB 3.36Å; L345-L349 WeakPolarHBondContact O-CG 3.42Å; L345-L349 PolarHBondContact O-N 3.1Å; L345-V461 HydrophobicContact CB-CG1 3.84Å; L345-L465 HydrophobicContact CD1-CD2 4.38Å; L345-L465 HydrophobicContact CD2-CD1 4.18Å; L345-L465 HydrophobicContact CD2-CD2 4.37Å
346	P	83.9	Confident	77.5	Confident	5 Å²	5	88.6 Å²	88.6	3%	0.032	42%	0.421	C	S	.	.	H	α-helix	trans	-62.4	-35.5	175.8	-26.7	38	0	0	0	112.8	F341 L349 F350 M351 Y457 V461	F341-P346 VanDerWaalsContact O-CD 3.22Å; F341-P346 WeakPolarHBondContact O-CD 3.46Å; F341-P346 WeakPolarHBondContact O-CG 3.26Å; P346-L349 PolarHBondContact O-N 3.4Å; P346-F350 PolarHBondContact O-N 2.65Å; P346-F350 VanDerWaalsContact O-N 3.12Å; P346-M351 HydrophobicContact CB-CB 4.22Å; P346-M351 PolarHBondContact O-N 2.93Å; P346-Y457 WeakPolarHBondContact CB-OH 3.47Å; P346-Y457 HydrophobicContact CG-CE1 4.01Å; P346-V461 HydrophobicContact CG-CG1 4.26Å; P346-V461 HydrophobicContact CG-CG2 3.91Å
347	A	81.6	Confident	75.9	Confident	71 Å²	71	82.7 Å²	82.7	59%	0.587	40%	0.404	S	S	*	.	H	α-helix	trans	-65.9	-38.2	174.2	0	0	0	0	0	112.3	K344 L345	K344-A347 PolarHBondContact O-N 2.91Å; L345-A347 VanDerWaalsContact C-N 3.27Å; L345-A347 PolarHBondContact O-N 2.99Å
348	L	84.9	Confident	74.2	Confident	123 Å²	123	84.3 Å²	84.3	64%	0.644	42%	0.416	S	S	*	.	H	α-helix	trans	-69.1	-39.3	174.8	-173.7	74.2	0	0	0	112.3	K344 L345 F350	K344-L348 PolarHBondContact O-N 3.02Å; L345-L348 HydrophobicContact CD2-CD2 4.34Å; L345-L348 WeakPolarHBondContact O-CB 3.41Å; L345-L348 PolarHBondContact O-N 2.91Å; L345-L348 VanDerWaalsContact O-N 3.15Å; L348-F350 VanDerWaalsContact C-N 3.28Å; L348-F350 PolarHBondContact O-N 3.46Å
349	L	81.8	Confident	72.7	Confident	27 Å²	27	84.7 Å²	84.7	14%	0.141	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	8.5	-177.5	-66.5	170.9	0	0	0	113.4	L345 P346 M351 V461 R464 L465 W468	L345-L349 WeakPolarHBondContact O-CB 3.36Å; L345-L349 WeakPolarHBondContact O-CG 3.42Å; L345-L349 PolarHBondContact O-N 3.1Å; P346-L349 PolarHBondContact O-N 3.4Å; L349-M351 HydrophobicContact CB-CE 3.75Å; L349-M351 HydrophobicContact CD1-CE 3.62Å; L349-M351 HydrophobicContact CG-CE 4.33Å; L349-M351 PolarHBondContact O-N 2.88Å; L349-M351 VanDerWaalsContact O-N 3.13Å; L349-V461 HydrophobicContact CD1-CG1 4.26Å; L349-R464 HydrophobicContact CD1-CB 4.42Å; L349-L465 HydrophobicContact CD1-CB 4.13Å; L349-W468 HydrophobicContact CD2-CG 4.44Å
350	F	81.7	Confident	71.5	Confident	195 Å²	195	86.2 Å²	86.2	86%	0.855	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	30.7	-176	-60.6	-74.5	0	0	0	114.5	P346 L348	P346-F350 PolarHBondContact O-N 2.65Å; P346-F350 VanDerWaalsContact O-N 3.12Å; L348-F350 VanDerWaalsContact C-N 3.28Å; L348-F350 PolarHBondContact O-N 3.46Å
351	M	77.5	Confident	70.1	Confident	44 Å²	44	89.2 Å²	89.2	22%	0.217	43%	0.429	C	S	.	.			trans	-82.8	125.4	174.3	-83	-171.4	-97	0	0	110.5	P346 L349 Q353 V461 R464	P346-M351 HydrophobicContact CB-CB 4.22Å; P346-M351 PolarHBondContact O-N 2.93Å; L349-M351 HydrophobicContact CB-CE 3.75Å; L349-M351 HydrophobicContact CD1-CE 3.62Å; L349-M351 HydrophobicContact CG-CE 4.33Å; L349-M351 PolarHBondContact O-N 2.88Å; L349-M351 VanDerWaalsContact O-N 3.13Å; M351-Q353 PolarHBondContact O-N 3.12Å; M351-V461 HydrophobicContact CE-CB 4.49Å; M351-V461 HydrophobicContact CE-CG1 4.47Å; M351-V461 HydrophobicContact CE-CG2 4.25Å; M351-V461 HydrophobicContact SD-CG2 4.49Å; M351-R464 HydrophobicContact CE-CB 3.39Å; M351-R464 HydrophobicContact CE-CG 3.63Å; M351-R464 HydrophobicContact SD-CB 4.38Å; M351-R464 HydrophobicContact SD-CG 3.95Å
352	R	67	Low	68.9	Low	225 Å²	225	95.6 Å²	95.6	85%	0.849	45%	0.452	S	S	*	.			trans	-78.9	114.4	173.6	-154.6	171.8	-170.2	171.8	3.8	108.3
353	Q	62.3	Low	68	Low	75 Å²	75	99.9 Å²	99.9	35%	0.35	47%	0.474	S	S	.	.			trans	-55.9	134.3	175.8	-165.1	173.4	17.1	0	0	109.5	M351 R355	M351-Q353 PolarHBondContact O-N 3.12Å; Q353-R355 PolarHBondContact O-N 3.01Å
354	P	57.8	Low	67.2	Low	72 Å²	72	98.9 Å²	98.9	47%	0.468	46%	0.463	S	S	.	.			trans	-57.9	115.7	179.2	19.4	-29.6	0	0	0	109.7	N356 S357 Y457	P354-N356 PolarHBondContact O-N 3.44Å; P354-S357 PolarHBondContact O-N 2.86Å; P354-S357 VanDerWaalsContact O-N 3.14Å; P354-S357 PolarHBondContact O-OG 3.27Å; P354-Y457 HydrophobicContact CG-CD2 4.41Å; P354-Y457 HydrophobicContact CG-CE2 4.42Å
355	R	49.2	Very low	66.2	Low	176 Å²	176	97.9 Å²	97.9	66%	0.664	46%	0.461	S	S	*	.	H	α-helix	trans	-56	-16.7	-170.9	-161.7	170.7	159.8	165.8	-4.4	114	Q353 E359	Q353-R355 PolarHBondContact O-N 3.01Å; R355-E359 PolarHBondContact O-N 3.26Å
356	N	51.5	Low	65.3	Low	105 Å²	105	105.7 Å²	105.7	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-73.5	-27.3	179.8	-67.6	-0	0	0	0	113.8	P354 S358 R360	P354-N356 PolarHBondContact O-N 3.44Å; N356-S358 VanDerWaalsContact C-N 3.34Å; N356-R360 WeakPolarHBondContact O-CB 3.2Å; N356-R360 WeakPolarHBondContact O-CG 3.22Å; N356-R360 PolarHBondContact O-N 3.49Å
357	S	53.9	Low	64.3	Low	35 Å²	35	113.8 Å²	113.8	25%	0.245	52%	0.518	C	S	.	.	H	α-helix	trans	-66.2	-41.1	175.5	65.7	0	0	0	0	110.3	P354 E359 Q361	P354-S357 PolarHBondContact O-N 2.86Å; P354-S357 VanDerWaalsContact O-N 3.14Å; P354-S357 PolarHBondContact O-OG 3.27Å; S357-E359 PolarHBondContact O-N 3.45Å; S357-Q361 WeakPolarHBondContact O-CB 3.15Å; S357-Q361 PolarHBondContact O-N 3.2Å
358	S	53.6	Low	63.5	Low	46 Å²	46	117.7 Å²	117.7	32%	0.322	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-38.1	178.8	-39.4	0	0	0	0	112.7	N356 R362	N356-S358 VanDerWaalsContact C-N 3.34Å; S358-R362 WeakPolarHBondContact O-CB 3.32Å; S358-R362 WeakPolarHBondContact O-CD 3.43Å; S358-R362 WeakPolarHBondContact O-CG 3.26Å; S358-R362 PolarHBondContact O-N 3.07Å
359	E	53.1	Low	62.3	Low	102 Å²	102	114.2 Å²	114.2	48%	0.477	51%	0.507	S	S	.	.	H	α-helix	trans	-74.1	-44.5	177.8	-69.3	-166.6	173.7	0	0	112.3	R355 S357 Q361 R362 L363	R355-E359 PolarHBondContact O-N 3.26Å; S357-E359 PolarHBondContact O-N 3.45Å; E359-Q361 VanDerWaalsContact C-N 3.32Å; E359-Q361 PolarHBondContact O-N 3.37Å; E359-R362 PolarHBondContact O-N 3.32Å; E359-L363 WeakPolarHBondContact O-CB 3.47Å; E359-L363 PolarHBondContact O-N 3Å
360	R	58	Low	61.3	Low	130 Å²	130	118.8 Å²	118.8	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-62.2	-39.5	172.8	-74	177.8	177.5	174.2	-3.9	111.6	N356 L363 R364 E453	N356-R360 WeakPolarHBondContact O-CB 3.2Å; N356-R360 WeakPolarHBondContact O-CG 3.22Å; N356-R360 PolarHBondContact O-N 3.49Å; R360-L363 PolarHBondContact O-N 3.48Å; R360-R364 WeakPolarHBondContact O-CB 3.41Å; R360-R364 VanDerWaalsContact O-CG 3.28Å; R360-R364 WeakPolarHBondContact O-CG 3.49Å; R360-R364 PolarHBondContact O-N 3.47Å; R360-E453 IonicContact NH1-OE1 3.48Å; R360-E453 IonicContact NH1-OE2 3.42Å
361	Q	59.6	Low	60.1	Low	117 Å²	117	113.8 Å²	113.8	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-72.2	-35.2	178.2	-162.2	170.9	18.8	0	0	112	S357 E359 R364 Q365	S357-Q361 WeakPolarHBondContact O-CB 3.15Å; S357-Q361 PolarHBondContact O-N 3.2Å; E359-Q361 VanDerWaalsContact C-N 3.32Å; E359-Q361 PolarHBondContact O-N 3.37Å; Q361-R364 PolarHBondContact O-N 3.29Å; Q361-Q365 WeakPolarHBondContact O-CB 3.33Å; Q361-Q365 WeakPolarHBondContact O-CG 3.09Å; Q361-Q365 PolarHBondContact O-N 3.11Å
362	R	59.9	Low	59	Low	168 Å²	168	118.9 Å²	118.9	63%	0.634	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-41.1	168.6	-79.5	171.4	179.2	-172.1	-0.1	112.2	S358 E359 Q365 R366	S358-R362 WeakPolarHBondContact O-CB 3.32Å; S358-R362 WeakPolarHBondContact O-CD 3.43Å; S358-R362 WeakPolarHBondContact O-CG 3.26Å; S358-R362 PolarHBondContact O-N 3.07Å; E359-R362 PolarHBondContact O-N 3.32Å; R362-Q365 PolarHBondContact O-N 3.1Å; R362-R366 WeakPolarHBondContact O-CB 3.46Å; R362-R366 VanDerWaalsContact O-CG 3.31Å; R362-R366 WeakPolarHBondContact O-CG 3.38Å; R362-R366 PolarHBondContact O-N 3.44Å
363	L	63.1	Low	58.3	Low	107 Å²	107	116.3 Å²	116.3	56%	0.56	53%	0.525	S	S	*	.	H	α-helix	trans	-63.4	-42.1	173	-86.5	153.1	0	0	0	111.6	E359 R360 R366 R367	E359-L363 WeakPolarHBondContact O-CB 3.47Å; E359-L363 PolarHBondContact O-N 3Å; R360-L363 PolarHBondContact O-N 3.48Å; L363-R366 PolarHBondContact O-N 3.45Å; L363-R367 WeakPolarHBondContact O-CB 3.46Å; L363-R367 PolarHBondContact O-N 2.93Å
364	R	63.5	Low	57.7	Low	79 Å²	79	120 Å²	120	30%	0.298	54%	0.542	S	S	.	.	H	α-helix	trans	-64.7	-42.5	173.9	-75.5	177.1	177.4	172.7	0.9	112.1	R360 Q361 R367 R368 D446 D447 S450	R360-R364 WeakPolarHBondContact O-CB 3.41Å; R360-R364 VanDerWaalsContact O-CG 3.28Å; R360-R364 WeakPolarHBondContact O-CG 3.49Å; R360-R364 PolarHBondContact O-N 3.47Å; Q361-R364 PolarHBondContact O-N 3.29Å; R364-R367 PolarHBondContact O-N 2.98Å; R364-R368 WeakPolarHBondContact O-CB 3.45Å; R364-R368 WeakPolarHBondContact O-CG 3.36Å; R364-R368 PolarHBondContact O-N 3.26Å; R364-D446 PolarHBondContact NH2-O 2.98Å; R364-D447 IonicContact CZ-OD1 3.1Å; R364-D447 IonicContact NE-OD1 3.62Å; R364-D447 PolarHBondContact NE-OD1 3.45Å; R364-D447 IonicContact NH1-OD1 3.05Å; R364-D447 PolarHBondContact NH1-OD1 2.85Å; R364-D447 IonicContact NH2-OD1 3.45Å; R364-D447 PolarHBondContact NH2-OD1 2.95Å; R364-D447 VanDerWaalsContact NH2-OD1 3.1Å; R364-S450 PolarHBondContact NH1-OG 3.45Å; R364-S450 PolarHBondContact NH2-OG 3.2Å
365	Q	63	Low	56.9	Low	128 Å²	128	119.6 Å²	119.6	60%	0.598	55%	0.551	S	S	*	*	H	α-helix	trans	-64.9	-41.1	174.4	-80.3	179.2	-15.7	0	0	111.8	Q361 R362 R368 A369	Q361-Q365 WeakPolarHBondContact O-CB 3.33Å; Q361-Q365 WeakPolarHBondContact O-CG 3.09Å; Q361-Q365 PolarHBondContact O-N 3.11Å; R362-Q365 PolarHBondContact O-N 3.1Å; Q365-R368 PolarHBondContact O-N 2.94Å; Q365-A369 VanDerWaalsContact O-CB 3.26Å; Q365-A369 WeakPolarHBondContact O-CB 3.24Å; Q365-A369 PolarHBondContact O-N 3.23Å
366	R	63.6	Low	56.3	Low	189 Å²	189	114.3 Å²	114.3	71%	0.713	55%	0.551	S	S	*	*	H	α-helix	trans	-61.2	-48.3	173	-77.8	179.2	175.4	-170.5	-1.9	111.4	R362 L363 A369 Q370	R362-R366 WeakPolarHBondContact O-CB 3.46Å; R362-R366 VanDerWaalsContact O-CG 3.31Å; R362-R366 WeakPolarHBondContact O-CG 3.38Å; R362-R366 PolarHBondContact O-N 3.44Å; L363-R366 PolarHBondContact O-N 3.45Å; R366-A369 PolarHBondContact O-N 3.47Å; R366-Q370 WeakPolarHBondContact O-CB 3.48Å; R366-Q370 PolarHBondContact O-N 2.89Å
367	R	64.4	Low	55.7	Low	176 Å²	176	117 Å²	117	66%	0.664	55%	0.553	S	S	*	*	H	α-helix	trans	-60.8	-43.9	175.5	-82.5	-174.3	176.5	-176.4	-1	112.6	L363 R364 Q370 E371	L363-R367 WeakPolarHBondContact O-CB 3.46Å; L363-R367 PolarHBondContact O-N 2.93Å; R364-R367 PolarHBondContact O-N 2.98Å; R367-Q370 CarbonylContact O-C 3.58Å; R367-Q370 WeakPolarHBondContact O-CA 3.44Å; R367-Q370 VanDerWaalsContact O-CB 3.31Å; R367-Q370 WeakPolarHBondContact O-CB 3.49Å; R367-Q370 PolarHBondContact O-N 3.45Å; R367-Q370 VanDerWaalsContact O-N 3.14Å; R367-E371 WeakPolarHBondContact O-CG 3.39Å; R367-E371 PolarHBondContact O-N 3.48Å
368	R	63.5	Low	55	Low	153 Å²	153	121 Å²	121	58%	0.577	58%	0.582	S	S	*	*	H	α-helix	trans	-66.7	-37.1	176.7	-75.5	-176.8	-176.1	-172.3	1.2	113	R364 Q365 Q370 E371 Q372	R364-R368 WeakPolarHBondContact O-CB 3.45Å; R364-R368 WeakPolarHBondContact O-CG 3.36Å; R364-R368 PolarHBondContact O-N 3.26Å; Q365-R368 PolarHBondContact O-N 2.94Å; R368-Q370 PolarHBondContact O-N 3.23Å; R368-E371 PolarHBondContact O-N 2.88Å; R368-Q372 WeakPolarHBondContact O-CB 3.38Å; R368-Q372 PolarHBondContact O-N 3.17Å
369	A	61.3	Low	54.1	Low	50 Å²	50	121.5 Å²	121.5	41%	0.413	59%	0.594	S	S	.	*	H	α-helix	trans	-66.5	-28.9	172.7	0	0	0	0	0	111.9	Q365 R366 K373	Q365-A369 VanDerWaalsContact O-CB 3.26Å; Q365-A369 WeakPolarHBondContact O-CB 3.24Å; Q365-A369 PolarHBondContact O-N 3.23Å; R366-A369 PolarHBondContact O-N 3.47Å; A369-K373 WeakPolarHBondContact O-CB 3.47Å; A369-K373 WeakPolarHBondContact O-CG 3.19Å; A369-K373 PolarHBondContact O-N 3.14Å; A369-K373 VanDerWaalsContact O-N 3.17Å
370	Q	59.3	Low	52.9	Low	122 Å²	122	125.4 Å²	125.4	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-74.9	-46.1	174	-145.6	164.8	-17.7	0	0	111	R366 R367 R368 Q372 K373 E374	R366-Q370 WeakPolarHBondContact O-CB 3.48Å; R366-Q370 PolarHBondContact O-N 2.89Å; R367-Q370 CarbonylContact O-C 3.58Å; R367-Q370 WeakPolarHBondContact O-CA 3.44Å; R367-Q370 VanDerWaalsContact O-CB 3.31Å; R367-Q370 WeakPolarHBondContact O-CB 3.49Å; R367-Q370 PolarHBondContact O-N 3.45Å; R367-Q370 VanDerWaalsContact O-N 3.14Å; R368-Q370 PolarHBondContact O-N 3.23Å; Q370-Q372 PolarHBondContact O-N 3.37Å; Q370-K373 WeakPolarHBondContact O-CB 3.45Å; Q370-K373 PolarHBondContact O-N 3.43Å; Q370-E374 PolarHBondContact O-N 3.06Å
371	E	56.7	Low	51.9	Low	90 Å²	90	125.3 Å²	125.3	42%	0.421	63%	0.629	S	S	.	*	H	α-helix	trans	-62	-38.1	173.8	-72.2	172	172.1	0	0	112.1	R367 R368 E374 G375 K443	R367-E371 WeakPolarHBondContact O-CG 3.39Å; R367-E371 PolarHBondContact O-N 3.48Å; R368-E371 PolarHBondContact O-N 2.88Å; E371-E374 PolarHBondContact O-N 3.41Å; E371-G375 PolarHBondContact O-N 3.48Å; E371-K443 IonicContact OE1-NZ 2.96Å; E371-K443 PolarHBondContact OE1-NZ 2.82Å; E371-K443 IonicContact OE2-NZ 2.98Å
372	Q	55.5	Low	50.4	Low	152 Å²	152	123.1 Å²	123.1	71%	0.71	63%	0.631	S	S	*	*	H	α-helix	trans	-71	-31.1	174.2	-89.8	179.2	-33.4	0	0	113.3	R368 Q370 E374 G376	R368-Q372 WeakPolarHBondContact O-CB 3.38Å; R368-Q372 PolarHBondContact O-N 3.17Å; Q370-Q372 PolarHBondContact O-N 3.37Å; Q372-E374 VanDerWaalsContact C-N 3.33Å; Q372-G376 PolarHBondContact O-N 3.19Å; Q372-G376 VanDerWaalsContact O-N 3.11Å
373	K	50.9	Low	49.4	Very low	170 Å²	170	120.2 Å²	120.2	74%	0.739	64%	0.643	S	S	*	*	H	α-helix	trans	-69.6	-31.5	172.7	-85.9	-179.4	173.6	-171.5	0	112.2	A369 Q370	A369-K373 WeakPolarHBondContact O-CB 3.47Å; A369-K373 WeakPolarHBondContact O-CG 3.19Å; A369-K373 PolarHBondContact O-N 3.14Å; A369-K373 VanDerWaalsContact O-N 3.17Å; Q370-K373 WeakPolarHBondContact O-CB 3.45Å; Q370-K373 PolarHBondContact O-N 3.43Å
374	E	49.7	Very low	47.9	Very low	153 Å²	153	122.6 Å²	122.6	72%	0.715	66%	0.656	S	S	*	*	H	α-helix	trans	-82.1	-38.2	176.2	-74	176.8	173.4	0	0	112.7	Q370 E371 Q372	Q370-E374 PolarHBondContact O-N 3.06Å; E371-E374 PolarHBondContact O-N 3.41Å; Q372-E374 VanDerWaalsContact C-N 3.33Å
375	G	41.3	Very low	46.6	Very low	63 Å²	63	126.8 Å²	126.8	65%	0.649	68%	0.684	S	S	*	*	H	α-helix	trans	-79.9	-19.2	180	0	0	0	0	0	115.5	E371	E371-G375 PolarHBondContact O-N 3.48Å
376	G	37.5	Very low	45.1	Very low	65 Å²	65	123.9 Å²	123.9	67%	0.67	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-0.3	-177.5	0	0	0	0	0	115.7	Q372	Q372-G376 PolarHBondContact O-N 3.19Å; Q372-G376 VanDerWaalsContact O-N 3.11Å
377	R	38.4	Very low	43.6	Very low	161 Å²	161	122.6 Å²	122.6	61%	0.608	70%	0.696	S	S	*	*			trans	-106.8	55.6	-171.9	-145.5	168	172.5	179.2	-7.2	111.8	A382	R377-A382 PolarHBondContact NH2-O 3.17Å; R377-A382 VanDerWaalsContact NH2-O 3.1Å
378	S	39.1	Very low	42.3	Very low	120 Å²	120	119.2 Å²	119.2	84%	0.839	70%	0.697	S	S	*	*			trans	-96	83.9	158.2	26.7	0	0	0	0	108
379	G	35.3	Very low	41.1	Very low	57 Å²	57	118.3 Å²	118.3	59%	0.588	71%	0.712	S	S	*	*	S	Bend	trans	155.8	100.3	179.9	0	0	0	0	0	112.3
380	E	27.8	Very low	39.9	Very low	184 Å²	184	121.3 Å²	121.3	86%	0.86	73%	0.726	S	S	*	*			trans	64.6	126.8	165.7	-69.6	175.4	120.9	0	0	119.6	A382	E380-A382 PolarHBondContact O-N 2.94Å
381	P	36.7	Very low	39.2	Very low	127 Å²	127	118.7 Å²	118.7	83%	0.825	72%	0.72	S	S	*	*			trans	-86.8	105.9	179.6	33.6	-29	0	0	0	110.8
382	A	28.5	Very low	38.4	Very low	72 Å²	72	125 Å²	125	60%	0.595	74%	0.742	S	S	*	*			trans	-79.9	121.3	153.5	0	0	0	0	0	108.7	R377 E380 D384	R377-A382 PolarHBondContact NH2-O 3.17Å; R377-A382 VanDerWaalsContact NH2-O 3.1Å; E380-A382 PolarHBondContact O-N 2.94Å; A382-D384 PolarHBondContact O-N 2.89Å
383	A	39.2	Very low	38	Very low	107 Å²	107	121.2 Å²	121.2	88%	0.884	73%	0.729	S	S	*	*			trans	-55.1	121.5	176.4	0	0	0	0	0	111.3
384	D	30.3	Very low	37.5	Very low	156 Å²	156	118.5 Å²	118.5	83%	0.834	72%	0.722	S	S	*	*			trans	-147.5	136.5	159.2	-164	22.2	0	0	0	108.4	A382	A382-D384 PolarHBondContact O-N 2.89Å
385	D	37.3	Very low	37.4	Very low	168 Å²	168	121.6 Å²	121.6	90%	0.898	73%	0.728	S	S	*	*			trans	-78.7	114.7	-165.8	-162.6	26.4	0	0	0	109.3
386	G	31.1	Very low	37.7	Very low	67 Å²	67	121.9 Å²	121.9	69%	0.691	72%	0.723	S	S	*	*			trans	-165.6	113.3	-177.6	0	0	0	0	0	111.6
387	D	31.1	Very low	38.4	Very low	161 Å²	161	121.9 Å²	121.9	86%	0.861	71%	0.713	S	S	*	*			trans	-31	127.5	-174.7	-91.5	-34.4	0	0	0	116.2
388	P	38.7	Very low	39	Very low	106 Å²	106	117.5 Å²	117.5	69%	0.688	70%	0.704	S	S	*	*			trans	-72	138.1	167.1	2.4	12.8	0	0	0	110	T390	P388-T390 PolarHBondContact O-N 2.82Å
389	C	36.5	Very low	39.3	Very low	133 Å²	133	120.6 Å²	120.6	90%	0.899	70%	0.703	S	S	*	*			trans	-46.6	104.9	171.9	-75.3	0	0	0	0	111.5	C391	C389-C391 PolarHBondContact O-N 3.22Å
390	T	36.8	Very low	39.9	Very low	114 Å²	114	125.8 Å²	125.8	70%	0.699	71%	0.711	S	S	*	*			trans	-71.5	97.2	173.9	45.5	0	0	0	0	109.6	P388 Y392	P388-T390 PolarHBondContact O-N 2.82Å; T390-Y392 PolarHBondContact O-N 3.49Å
391	C	45.1	Very low	40.8	Very low	67 Å²	67	125.9 Å²	125.9	45%	0.453	71%	0.71	S	S	.	*			trans	-70.5	110.8	157.7	52.2	0	0	0	0	108.3	C389 V393 L421	C389-C391 PolarHBondContact O-N 3.22Å; C391-V393 VanDerWaalsContact C-N 3.35Å; C391-V393 PolarHBondContact O-N 3.3Å; C391-L421 HydrophobicContact CB-CD1 4.29Å
392	Y	40.3	Very low	41.2	Very low	222 Å²	222	123.4 Å²	123.4	87%	0.871	71%	0.707	S	S	*	*			trans	-72.6	91.1	170.9	-91.3	-91.7	0	0	0	109.1	T390	T390-Y392 PolarHBondContact O-N 3.49Å
393	V	47.3	Very low	41.7	Very low	72 Å²	72	122.7 Å²	122.7	44%	0.436	71%	0.707	S	S	.	*			trans	-84.4	123.3	167.5	-171	0	0	0	0	107.7	C391 R395 V398 L421	C391-V393 VanDerWaalsContact C-N 3.35Å; C391-V393 PolarHBondContact O-N 3.3Å; V393-R395 PolarHBondContact O-N 3.43Å; V393-R395 VanDerWaalsContact O-N 3.12Å; V393-V398 HydrophobicContact CG1-CG2 3.93Å; V393-L421 HydrophobicContact CG2-CD2 3.86Å
394	N	39.9	Very low	41.4	Very low	113 Å²	113	126.6 Å²	126.6	60%	0.604	71%	0.706	S	S	*	*			trans	-61.3	117.1	176.5	-171	-10.1	0	0	0	109.6	A396 S397	N394-A396 PolarHBondContact O-N 2.87Å; N394-A396 PolarHBondContact OD1-N 3.48Å; N394-S397 PolarHBondContact O-N 3.2Å
395	R	47.2	Very low	41.7	Very low	219 Å²	219	127.4 Å²	127.4	83%	0.826	71%	0.71	S	S	*	*	H	α-helix	trans	-59	-19.3	-177.3	-158	174.6	-174.7	168.6	1.6	112.9	V393	V393-R395 PolarHBondContact O-N 3.43Å; V393-R395 VanDerWaalsContact O-N 3.12Å
396	A	48.5	Very low	41.5	Very low	68 Å²	68	125.8 Å²	125.8	56%	0.562	71%	0.706	S	S	*	*	H	α-helix	trans	-69.3	-33.7	174.1	0	0	0	0	0	113.3	N394	N394-A396 PolarHBondContact O-N 2.87Å; N394-A396 PolarHBondContact OD1-N 3.48Å
397	S	51.9	Low	41.9	Very low	65 Å²	65	126.1 Å²	126.1	46%	0.455	71%	0.709	S	S	.	*	H	α-helix	trans	-76.7	-29.1	-177.6	-59.8	0	0	0	0	113.1	N394 K399 Q400	N394-S397 PolarHBondContact O-N 3.2Å; S397-K399 VanDerWaalsContact C-N 3.35Å; S397-K399 PolarHBondContact O-N 2.96Å; S397-Q400 PolarHBondContact O-N 3.29Å
398	V	50.1	Low	41.7	Very low	69 Å²	69	123.2 Å²	123.2	42%	0.418	71%	0.708	S	S	.	*	H	α-helix	trans	-71.5	-29.6	-179.3	-178.6	0	0	0	0	112.1	V393 Q400	V393-V398 HydrophobicContact CG1-CG2 3.93Å; V398-Q400 VanDerWaalsContact C-N 3.29Å; V398-Q400 PolarHBondContact O-N 2.91Å
399	K	45.8	Very low	41.3	Very low	186 Å²	186	121.8 Å²	121.8	81%	0.809	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-72	-19.7	176.1	-83.6	-174.3	173.8	-175.5	0	113.9	S397 F401	S397-K399 VanDerWaalsContact C-N 3.35Å; S397-K399 PolarHBondContact O-N 2.96Å; K399-F401 VanDerWaalsContact C-N 3.33Å
400	Q	47.8	Very low	41.4	Very low	165 Å²	165	120 Å²	120	77%	0.771	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-79.4	-16.4	-179	-164.1	169.8	-10.4	0	0	113	S397 V398	S397-Q400 PolarHBondContact O-N 3.29Å; V398-Q400 VanDerWaalsContact C-N 3.29Å; V398-Q400 PolarHBondContact O-N 2.91Å
401	F	46.4	Very low	41.1	Very low	187 Å²	187	117.6 Å²	117.6	82%	0.82	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-110.3	12.6	-178.1	-80.2	-83.5	0	0	0	114.8	K399 G403	K399-F401 VanDerWaalsContact C-N 3.33Å; F401-G403 PolarHBondContact O-N 3.34Å
402	G	44.7	Very low	40.8	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.4	33.9	162	0	0	0	0	0	117.3
403	G	40.5	Very low	41.1	Very low	58 Å²	58	114.1 Å²	114.1	60%	0.598	72%	0.719	S	S	*	*			trans	-101.4	115.3	175.2	0	0	0	0	0	113.4	F401	F401-G403 PolarHBondContact O-N 3.34Å
404	E	32.8	Very low	41.1	Very low	188 Å²	188	117.1 Å²	117.1	88%	0.879	73%	0.732	S	S	*	*			trans	-83.5	126.8	168.6	-129.7	175.4	162.2	0	0	109.9	V406	E404-V406 PolarHBondContact O-N 2.93Å
405	L	36.5	Very low	41.3	Very low	173 Å²	173	114.2 Å²	114.2	91%	0.906	73%	0.729	S	S	*	*			trans	-82.2	95.9	176.2	-96.7	136.8	0	0	0	109.7
406	V	32.8	Very low	41.3	Very low	134 Å²	134	109.4 Å²	109.4	81%	0.812	72%	0.719	S	S	*	*			trans	-87.5	124.6	166.1	179	0	0	0	0	108.7	E404	E404-V406 PolarHBondContact O-N 2.93Å
407	G	38.5	Very low	41.5	Very low	74 Å²	74	110.2 Å²	110.2	76%	0.763	71%	0.714	S	S	*	*			trans	-70.8	136.7	177.4	0	0	0	0	0	112.7
408	A	28.6	Very low	41.4	Very low	101 Å²	101	114.7 Å²	114.7	84%	0.835	72%	0.721	S	S	*	*			trans	-167.3	133.2	155.5	0	0	0	0	0	111.1
409	G	28.7	Very low	41.4	Very low	76 Å²	76	114.1 Å²	114.1	78%	0.784	72%	0.724	S	S	*	*			trans	72	118.9	135.9	0	0	0	0	0	118.9	G411	G409-G411 PolarHBondContact O-N 2.9Å
410	G	38.8	Very low	41.7	Very low	95 Å²	95	110.6 Å²	110.6	98%	0.979	71%	0.713	S	S	*	*			trans	-53.2	130.5	172.8	0	0	0	0	0	114.1
411	G	31.4	Very low	41.9	Very low	63 Å²	63	104.5 Å²	104.5	65%	0.649	69%	0.686	S	S	*	*	S	Bend	trans	170	115.6	173	0	0	0	0	0	110.5	G409 T413	G409-G411 PolarHBondContact O-N 2.9Å; G411-T413 PolarHBondContact O-N 3Å
412	S	39.3	Very low	42.1	Very low	115 Å²	115	97.8 Å²	97.8	80%	0.804	66%	0.664	S	S	*	*			trans	19.1	86.8	170.1	-62	0	0	0	0	118	D414	S412-D414 VanDerWaalsContact C-N 3.31Å; S412-D414 PolarHBondContact O-N 2.92Å
413	T	46	Very low	42.3	Very low	102 Å²	102	102.7 Å²	102.7	63%	0.626	67%	0.668	S	S	*	*	H	α-helix	trans	-71.1	-15.8	176.4	44.1	0	0	0	0	115	G411 N417	G411-T413 PolarHBondContact O-N 3Å; T413-N417 PolarHBondContact O-N 3.14Å; T413-N417 PolarHBondContact O-ND2 3.35Å
414	D	46.9	Very low	43	Very low	134 Å²	134	103 Å²	103	72%	0.717	66%	0.664	S	S	*	*	H	α-helix	trans	-74.1	-34.4	-175.3	-98.7	2.9	0	0	0	114.2	S412	S412-D414 VanDerWaalsContact C-N 3.31Å; S412-D414 PolarHBondContact O-N 2.92Å
415	G	44.3	Very low	43.9	Very low	52 Å²	52	97.5 Å²	97.5	54%	0.536	65%	0.646	S	S	.	*	H	α-helix	trans	-73.8	-37.8	177.7	0	0	0	0	0	112.6	A419	G415-A419 PolarHBondContact O-N 3.32Å; G415-A419 VanDerWaalsContact O-N 3.16Å
416	L	46.6	Very low	44.8	Very low	118 Å²	118	95.7 Å²	95.7	62%	0.618	64%	0.644	S	S	*	*	H	α-helix	trans	-72.4	-39.7	-176.4	-166.1	68.9	0	0	0	111.8	R418 A419 L420	L416-R418 VanDerWaalsContact C-N 3.34Å; L416-R418 PolarHBondContact O-N 3.36Å; L416-A419 PolarHBondContact O-N 3.26Å; L416-L420 WeakPolarHBondContact O-CB 3.46Å; L416-L420 PolarHBondContact O-N 3.2Å
417	N	54.3	Low	46.2	Very low	86 Å²	86	91 Å²	91	46%	0.46	62%	0.623	S	S	.	*	H	α-helix	trans	-65.6	-36.4	176.4	-77.8	-20.8	0	0	0	112.5	T413 L421	T413-N417 PolarHBondContact O-N 3.14Å; T413-N417 PolarHBondContact O-ND2 3.35Å; N417-L421 VanDerWaalsContact O-CB 3.27Å; N417-L421 WeakPolarHBondContact O-CB 3.29Å; N417-L421 WeakPolarHBondContact O-CD1 3.4Å; N417-L421 WeakPolarHBondContact O-CG 3.38Å; N417-L421 PolarHBondContact O-N 2.95Å
418	R	49.1	Very low	47.8	Very low	159 Å²	159	91.8 Å²	91.8	60%	0.6	61%	0.606	S	S	*	*	H	α-helix	trans	-70.6	-39.6	178.4	-150.9	171.9	-175.8	167.5	-3.5	112	L416 A422	L416-R418 VanDerWaalsContact C-N 3.34Å; L416-R418 PolarHBondContact O-N 3.36Å; R418-A422 VanDerWaalsContact O-CB 3.3Å; R418-A422 WeakPolarHBondContact O-CB 3.27Å; R418-A422 PolarHBondContact O-N 3.25Å
419	A	49.2	Very low	49.8	Very low	57 Å²	57	91 Å²	91	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-68	-40.2	174.2	0	0	0	0	0	112.5	G415 L416 Q423	G415-A419 PolarHBondContact O-N 3.32Å; G415-A419 VanDerWaalsContact O-N 3.16Å; L416-A419 PolarHBondContact O-N 3.26Å; A419-Q423 PolarHBondContact O-N 3.3Å
420	L	51.9	Low	52.1	Low	112 Å²	112	94.5 Å²	94.5	59%	0.586	58%	0.584	S	S	*	*	H	α-helix	trans	-69.4	-37.6	177.5	-124.2	109	0	0	0	112.6	L416 Q423 A424	L416-L420 WeakPolarHBondContact O-CB 3.46Å; L416-L420 PolarHBondContact O-N 3.2Å; L420-Q423 PolarHBondContact O-N 3.42Å; L420-A424 WeakPolarHBondContact O-CB 3.37Å; L420-A424 PolarHBondContact O-N 2.82Å
421	L	52.1	Low	54	Low	37 Å²	37	92.9 Å²	92.9	19%	0.194	56%	0.561	C	S	.	*	H	α-helix	trans	-70.9	-37.3	176.3	-75.9	168.6	0	0	0	112.4	C391 V393 N417 Q423 A424 C425	C391-L421 HydrophobicContact CB-CD1 4.29Å; V393-L421 HydrophobicContact CG2-CD2 3.86Å; N417-L421 VanDerWaalsContact O-CB 3.27Å; N417-L421 WeakPolarHBondContact O-CB 3.29Å; N417-L421 WeakPolarHBondContact O-CD1 3.4Å; N417-L421 WeakPolarHBondContact O-CG 3.38Å; N417-L421 PolarHBondContact O-N 2.95Å; L421-Q423 PolarHBondContact O-N 3.46Å; L421-A424 PolarHBondContact O-N 3.01Å; L421-C425 PolarHBondContact O-N 3.21Å
422	A	50.7	Low	56.3	Low	45 Å²	45	91.8 Å²	91.8	37%	0.372	54%	0.542	S	S	.	.	H	α-helix	trans	-62.8	-31.6	172.7	0	0	0	0	0	112.2	R418	R418-A422 VanDerWaalsContact O-CB 3.3Å; R418-A422 WeakPolarHBondContact O-CB 3.27Å; R418-A422 PolarHBondContact O-N 3.25Å
423	Q	50.3	Low	58.2	Low	178 Å²	178	92.8 Å²	92.8	83%	0.832	53%	0.533	S	S	*	.	H	α-helix	trans	-81.1	-26.5	176.4	-158.9	114.5	24.7	0	0	113.3	A419 L420 L421	A419-Q423 PolarHBondContact O-N 3.3Å; L420-Q423 PolarHBondContact O-N 3.42Å; L421-Q423 PolarHBondContact O-N 3.46Å
424	A	54.4	Low	60.1	Low	64 Å²	64	89.3 Å²	89.3	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-86.5	-23.1	-176.2	0	0	0	0	0	114.6	L420 L421	L420-A424 WeakPolarHBondContact O-CB 3.37Å; L420-A424 PolarHBondContact O-N 2.82Å; L421-A424 PolarHBondContact O-N 3.01Å
425	C	52.5	Low	62	Low	72 Å²	72	87.6 Å²	87.6	49%	0.486	51%	0.512	S	S	.	.			trans	-141.3	99.7	177.5	-77.4	0	0	0	0	110.9	L421 G427 F428	L421-C425 PolarHBondContact O-N 3.21Å; C425-G427 PolarHBondContact O-N 3.36Å; C425-F428 HydrophobicContact CB-CB 3.93Å; C425-F428 PolarHBondContact O-N 3.42Å; C425-F428 VanDerWaalsContact O-N 3.13Å
426	P	55.5	Low	63.7	Low	135 Å²	135	91.9 Å²	91.9	88%	0.877	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	105	168.9	27.1	-30.4	0	0	0	108
427	G	60.6	Low	65.8	Low	36 Å²	36	93 Å²	93	37%	0.371	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	122	-3.9	-175.3	0	0	0	0	0	115.4	C425 E430 A431	C425-G427 PolarHBondContact O-N 3.36Å; G427-E430 PolarHBondContact O-N 3.49Å; G427-A431 WeakPolarHBondContact O-CB 3.48Å; G427-A431 PolarHBondContact O-N 3.41Å
428	F	72.9	Confident	67.5	Low	90 Å²	90	93.7 Å²	93.7	40%	0.395	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-43.9	173.6	179.9	-99.9	0	0	0	111.9	C425 E430 A431 V432	C425-F428 HydrophobicContact CB-CB 3.93Å; C425-F428 PolarHBondContact O-N 3.42Å; C425-F428 VanDerWaalsContact O-N 3.13Å; F428-E430 VanDerWaalsContact C-N 3.3Å; F428-E430 PolarHBondContact O-N 3.11Å; F428-A431 PolarHBondContact O-N 3.01Å; F428-V432 HydrophobicContact CD1-CG2 4.22Å; F428-V432 HydrophobicContact CE1-CG2 3.83Å; F428-V432 HydrophobicContact CE2-CG2 4.27Å; F428-V432 HydrophobicContact CZ-CG2 3.86Å; F428-V432 WeakPolarHBondContact O-CG2 3.45Å; F428-V432 PolarHBondContact O-N 3.25Å
429	D	70.7	Confident	69.2	Low	85 Å²	85	88.6 Å²	88.6	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-37.1	175.2	-78.4	-38.6	0	0	0	111.7	V432 E433	D429-V432 PolarHBondContact O-N 3.47Å; D429-E433 VanDerWaalsContact O-CB 3.27Å; D429-E433 WeakPolarHBondContact O-CB 3.11Å; D429-E433 PolarHBondContact O-N 2.83Å
430	E	75.9	Confident	70.8	Confident	150 Å²	150	90.8 Å²	90.8	70%	0.701	51%	0.511	S	S	*	.	H	α-helix	trans	-67.3	-38.5	175.9	-168.9	175.7	-175.9	0	0	112.1	G427 F428 E433 G434	G427-E430 PolarHBondContact O-N 3.49Å; F428-E430 VanDerWaalsContact C-N 3.3Å; F428-E430 PolarHBondContact O-N 3.11Å; E430-E433 PolarHBondContact O-N 3.33Å; E430-G434 PolarHBondContact O-N 3.46Å
431	A	79.3	Confident	72.6	Confident	60 Å²	60	89.7 Å²	89.7	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-68.8	-40.5	174.4	0	0	0	0	0	112.3	G427 F428 E433 G434 V435	G427-A431 WeakPolarHBondContact O-CB 3.48Å; G427-A431 PolarHBondContact O-N 3.41Å; F428-A431 PolarHBondContact O-N 3.01Å; A431-E433 VanDerWaalsContact C-N 3.33Å; A431-G434 PolarHBondContact O-N 2.86Å; A431-V435 WeakPolarHBondContact O-CG2 2.97Å; A431-V435 PolarHBondContact O-N 3.06Å
432	V	79.8	Confident	74.1	Confident	41 Å²	41	93.2 Å²	93.2	25%	0.248	52%	0.519	C	S	.	.	H	α-helix	trans	-65.5	-39	174.4	171.4	0	0	0	0	110.8	F428 D429 V435 R436	F428-V432 HydrophobicContact CD1-CG2 4.22Å; F428-V432 HydrophobicContact CE1-CG2 3.83Å; F428-V432 HydrophobicContact CE2-CG2 4.27Å; F428-V432 HydrophobicContact CZ-CG2 3.86Å; F428-V432 WeakPolarHBondContact O-CG2 3.45Å; F428-V432 PolarHBondContact O-N 3.25Å; D429-V432 PolarHBondContact O-N 3.47Å; V432-V435 PolarHBondContact O-N 3.43Å; V432-R436 WeakPolarHBondContact O-CB 3.46Å; V432-R436 WeakPolarHBondContact O-CG 3.37Å; V432-R436 PolarHBondContact O-N 3.42Å
433	E	78.9	Confident	75.7	Confident	135 Å²	135	95.3 Å²	95.3	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-40.5	173.8	-171.1	164.9	-161.3	0	0	111.8	D429 E430 A431 R436 F437	D429-E433 VanDerWaalsContact O-CB 3.27Å; D429-E433 WeakPolarHBondContact O-CB 3.11Å; D429-E433 PolarHBondContact O-N 2.83Å; E430-E433 PolarHBondContact O-N 3.33Å; A431-E433 VanDerWaalsContact C-N 3.33Å; E433-R436 PolarHBondContact O-N 3.36Å; E433-F437 WeakPolarHBondContact O-CB 3.21Å; E433-F437 PolarHBondContact O-N 3.43Å
434	G	86.1	Confident	77.3	Confident	30 Å²	30	89.4 Å²	89.4	31%	0.309	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-44.7	172.5	0	0	0	0	0	113.1	E430 A431 F437 I438	E430-G434 PolarHBondContact O-N 3.46Å; A431-G434 PolarHBondContact O-N 2.86Å; G434-F437 PolarHBondContact O-N 3.05Å; G434-I438 VanDerWaalsContact O-CG1 3.25Å; G434-I438 WeakPolarHBondContact O-CG1 3.4Å; G434-I438 PolarHBondContact O-N 3.28Å
435	V	86.1	Confident	78.8	Confident	98 Å²	98	91.4 Å²	91.4	59%	0.594	50%	0.497	S	S	*	.	H	α-helix	trans	-66.6	-39.5	175.5	173.9	0	0	0	0	111.4	A431 V432 F437 I438 A439	A431-V435 WeakPolarHBondContact O-CG2 2.97Å; A431-V435 PolarHBondContact O-N 3.06Å; V432-V435 PolarHBondContact O-N 3.43Å; V435-F437 VanDerWaalsContact C-N 3.35Å; V435-I438 PolarHBondContact O-N 3.36Å; V435-A439 VanDerWaalsContact O-CB 3.28Å; V435-A439 WeakPolarHBondContact O-CB 3.36Å; V435-A439 PolarHBondContact O-N 3.48Å
436	R	81.6	Confident	80.4	Confident	141 Å²	141	92.5 Å²	92.5	53%	0.532	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-39.7	173.6	-77.6	179.6	-174.2	151.1	5.7	111.9	V432 E433 A439 N440	V432-R436 WeakPolarHBondContact O-CB 3.46Å; V432-R436 WeakPolarHBondContact O-CG 3.37Å; V432-R436 PolarHBondContact O-N 3.42Å; E433-R436 PolarHBondContact O-N 3.36Å; R436-A439 PolarHBondContact O-N 3.44Å; R436-N440 VanDerWaalsContact O-CB 3.26Å; R436-N440 WeakPolarHBondContact O-CB 3.36Å; R436-N440 PolarHBondContact O-N 3.47Å; R436-N440 PolarHBondContact O-ND2 3.21Å
437	F	90.3	Very high	81.7	Confident	143 Å²	143	88.5 Å²	88.5	63%	0.627	47%	0.469	S	S	*	.	H	α-helix	trans	-63	-47.8	175.5	179.4	-94.8	0	0	0	110.8	E433 G434 V435 A439 N440 H441	E433-F437 WeakPolarHBondContact O-CB 3.21Å; E433-F437 PolarHBondContact O-N 3.43Å; G434-F437 PolarHBondContact O-N 3.05Å; V435-F437 VanDerWaalsContact C-N 3.35Å; F437-A439 PolarHBondContact O-N 3.16Å; F437-N440 PolarHBondContact O-N 3.24Å; F437-H441 VanDerWaalsContact O-CB 3.24Å; F437-H441 WeakPolarHBondContact O-CB 3.4Å; F437-H441 PolarHBondContact O-N 3.48Å
438	I	88.9	Confident	82.8	Confident	100 Å²	100	90.4 Å²	90.4	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-60.2	-46.6	176	-66	163.1	0	0	0	110.5	G434 V435 N440 H441 M442	G434-I438 VanDerWaalsContact O-CG1 3.25Å; G434-I438 WeakPolarHBondContact O-CG1 3.4Å; G434-I438 PolarHBondContact O-N 3.28Å; V435-I438 PolarHBondContact O-N 3.36Å; I438-N440 VanDerWaalsContact C-N 3.35Å; I438-N440 PolarHBondContact O-N 2.87Å; I438-H441 PolarHBondContact O-N 2.92Å; I438-M442 HydrophobicContact CG2-CG 4.3Å; I438-M442 HydrophobicContact CG2-SD 3.99Å; I438-M442 WeakPolarHBondContact O-CB 3.5Å; I438-M442 VanDerWaalsContact O-CG 3.27Å; I438-M442 WeakPolarHBondContact O-CG 3.5Å; I438-M442 PolarHBondContact O-N 3.09Å
439	A	85.7	Confident	83.4	Confident	52 Å²	52	91.3 Å²	91.3	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-40.5	178.8	0	0	0	0	0	112.4	V435 R436 F437 K443	V435-A439 VanDerWaalsContact O-CB 3.28Å; V435-A439 WeakPolarHBondContact O-CB 3.36Å; V435-A439 PolarHBondContact O-N 3.48Å; R436-A439 PolarHBondContact O-N 3.44Å; F437-A439 PolarHBondContact O-N 3.16Å; A439-K443 VanDerWaalsContact O-CB 3.25Å; A439-K443 WeakPolarHBondContact O-CB 3.37Å; A439-K443 PolarHBondContact O-N 3.36Å
440	N	83.8	Confident	84	Confident	102 Å²	102	88.3 Å²	88.3	55%	0.545	46%	0.462	S	S	.	.	H	α-helix	trans	-70.5	-38.6	176.4	-75.3	-23.1	0	0	0	112	R436 F437 I438 K443 S444	R436-N440 VanDerWaalsContact O-CB 3.26Å; R436-N440 WeakPolarHBondContact O-CB 3.36Å; R436-N440 PolarHBondContact O-N 3.47Å; R436-N440 PolarHBondContact O-ND2 3.21Å; F437-N440 PolarHBondContact O-N 3.24Å; I438-N440 VanDerWaalsContact C-N 3.35Å; I438-N440 PolarHBondContact O-N 2.87Å; N440-K443 PolarHBondContact O-N 3.32Å; N440-S444 PolarHBondContact O-N 2.84Å; N440-S444 PolarHBondContact O-OG 3.45Å
441	H	88.3	Confident	84.4	Confident	90 Å²	90	83.3 Å²	83.3	42%	0.417	44%	0.441	S	S	.	.	H	α-helix	trans	-64.9	-49.2	176.6	-172.8	63.2	0	0	0	110.9	F437 I438 K443 S444 E445	F437-H441 VanDerWaalsContact O-CB 3.24Å; F437-H441 WeakPolarHBondContact O-CB 3.4Å; F437-H441 PolarHBondContact O-N 3.48Å; I438-H441 PolarHBondContact O-N 2.92Å; H441-K443 VanDerWaalsContact C-N 3.29Å; H441-K443 PolarHBondContact O-N 3.4Å; H441-S444 WeakPolarHBondContact CA-OG 3.43Å; H441-S444 PolarHBondContact O-N 3.36Å; H441-S444 VanDerWaalsContact O-N 3.13Å; H441-S444 PolarHBondContact O-OG 3.23Å; H441-E445 IonicContact CD2-OE2 3.67Å; H441-E445 IonicContact NE2-OE1 3.98Å; H441-E445 IonicContact NE2-OE2 3.71Å; H441-E445 PolarHBondContact O-N 3.11Å
442	M	84.8	Confident	84.7	Confident	111 Å²	111	82 Å²	82	55%	0.547	43%	0.429	S	S	.	.	H	α-helix	trans	-58.8	-39.8	173.3	-70.4	-177.3	73.2	0	0	111.8	I438 E445 D446	I438-M442 HydrophobicContact CG2-CG 4.3Å; I438-M442 HydrophobicContact CG2-SD 3.99Å; I438-M442 WeakPolarHBondContact O-CB 3.5Å; I438-M442 VanDerWaalsContact O-CG 3.27Å; I438-M442 WeakPolarHBondContact O-CG 3.5Å; I438-M442 PolarHBondContact O-N 3.09Å; M442-E445 PolarHBondContact O-N 3.17Å; M442-D446 WeakPolarHBondContact O-CB 3.46Å; M442-D446 PolarHBondContact O-N 3.14Å
443	K	83.9	Confident	85	Confident	89 Å²	89	84 Å²	84	39%	0.387	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-41.5	175.5	-174.5	175.8	-177.3	174.4	0	111.8	E371 A439 N440 H441 D447	E371-K443 IonicContact OE1-NZ 2.96Å; E371-K443 PolarHBondContact OE1-NZ 2.82Å; E371-K443 IonicContact OE2-NZ 2.98Å; A439-K443 VanDerWaalsContact O-CB 3.25Å; A439-K443 WeakPolarHBondContact O-CB 3.37Å; A439-K443 PolarHBondContact O-N 3.36Å; N440-K443 PolarHBondContact O-N 3.32Å; H441-K443 VanDerWaalsContact C-N 3.29Å; H441-K443 PolarHBondContact O-N 3.4Å; K443-D447 WeakPolarHBondContact O-CB 3.43Å; K443-D447 PolarHBondContact O-N 3.34Å
444	S	84.6	Confident	85.5	Confident	53 Å²	53	79.9 Å²	79.9	37%	0.371	42%	0.418	S	S	.	.	H	α-helix	trans	-68.3	-41.3	176.6	56.9	0	0	0	0	112.5	N440 H441 D447 D448	N440-S444 PolarHBondContact O-N 2.84Å; N440-S444 PolarHBondContact O-OG 3.45Å; H441-S444 WeakPolarHBondContact CA-OG 3.43Å; H441-S444 PolarHBondContact O-N 3.36Å; H441-S444 VanDerWaalsContact O-N 3.13Å; H441-S444 PolarHBondContact O-OG 3.23Å; S444-D447 PolarHBondContact O-N 2.87Å; S444-D448 PolarHBondContact O-N 2.94Å
445	E	85.6	Confident	85.6	Confident	107 Å²	107	78.8 Å²	78.8	50%	0.5	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-43	175.3	-74.7	-170.3	116.9	0	0	111.4	H441 M442 D447 D448 Q449	H441-E445 IonicContact CD2-OE2 3.67Å; H441-E445 IonicContact NE2-OE1 3.98Å; H441-E445 IonicContact NE2-OE2 3.71Å; H441-E445 PolarHBondContact O-N 3.11Å; M442-E445 PolarHBondContact O-N 3.17Å; E445-D447 VanDerWaalsContact C-N 3.32Å; E445-D447 PolarHBondContact O-N 2.83Å; E445-D448 PolarHBondContact O-N 3.36Å; E445-Q449 VanDerWaalsContact O-CB 3.28Å; E445-Q449 WeakPolarHBondContact O-CB 3.31Å; E445-Q449 PolarHBondContact O-N 3.39Å
446	D	85.5	Confident	85.8	Confident	94 Å²	94	78.4 Å²	78.4	50%	0.503	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-36.9	174.9	-86.7	-12.5	0	0	0	112.6	R364 M442 S450	R364-D446 PolarHBondContact NH2-O 2.98Å; M442-D446 WeakPolarHBondContact O-CB 3.46Å; M442-D446 PolarHBondContact O-N 3.14Å; D446-S450 WeakPolarHBondContact O-CB 3.4Å; D446-S450 PolarHBondContact O-N 3.45Å; D446-S450 PolarHBondContact O-OG 2.97Å
447	D	81.9	Confident	86.1	Confident	51 Å²	51	73 Å²	73	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-69.3	-45.9	177	-81.1	-15.6	0	0	0	110.5	R364 K443 S444 E445 Q449 S450 V451	R364-D447 IonicContact CZ-OD1 3.1Å; R364-D447 IonicContact NE-OD1 3.62Å; R364-D447 PolarHBondContact NE-OD1 3.45Å; R364-D447 IonicContact NH1-OD1 3.05Å; R364-D447 PolarHBondContact NH1-OD1 2.85Å; R364-D447 IonicContact NH2-OD1 3.45Å; R364-D447 PolarHBondContact NH2-OD1 2.95Å; R364-D447 VanDerWaalsContact NH2-OD1 3.1Å; K443-D447 WeakPolarHBondContact O-CB 3.43Å; K443-D447 PolarHBondContact O-N 3.34Å; S444-D447 PolarHBondContact O-N 2.87Å; E445-D447 VanDerWaalsContact C-N 3.32Å; E445-D447 PolarHBondContact O-N 2.83Å; D447-Q449 PolarHBondContact O-N 2.86Å; D447-S450 PolarHBondContact O-N 3.42Å; D447-S450 PolarHBondContact O-OG 3.07Å; D447-V451 WeakPolarHBondContact O-CG2 3.38Å; D447-V451 PolarHBondContact O-N 3.43Å; D447-V451 VanDerWaalsContact O-N 3.07Å
448	D	85.1	Confident	86.1	Confident	76 Å²	76	66.2 Å²	66.2	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-42.8	175.9	-78	-15.8	0	0	0	112.2	P328 S444 E445 S450 V451 S452	P328-D448 HydrophobicContact CG-CB 3.83Å; S444-D448 PolarHBondContact O-N 2.94Å; E445-D448 PolarHBondContact O-N 3.36Å; D448-S450 VanDerWaalsContact C-N 3.31Å; D448-S450 PolarHBondContact O-N 3.42Å; D448-V451 PolarHBondContact O-N 3.25Å; D448-S452 PolarHBondContact O-N 3.5Å
449	Q	84.3	Confident	86.2	Confident	109 Å²	109	61.5 Å²	61.5	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-61.1	-42.1	175.3	-174.6	165.3	-9.5	0	0	110.9	E445 D447 V451 S452 E453	E445-Q449 VanDerWaalsContact O-CB 3.28Å; E445-Q449 WeakPolarHBondContact O-CB 3.31Å; E445-Q449 PolarHBondContact O-N 3.39Å; D447-Q449 PolarHBondContact O-N 2.86Å; Q449-V451 VanDerWaalsContact C-N 3.35Å; Q449-V451 PolarHBondContact O-N 3.21Å; Q449-S452 PolarHBondContact O-N 3.45Å; Q449-S452 PolarHBondContact O-OG 2.68Å; Q449-E453 WeakPolarHBondContact O-CG 3.5Å; Q449-E453 PolarHBondContact O-N 3.06Å
450	S	83.3	Confident	86.3	Confident	22 Å²	22	63.9 Å²	63.9	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-36.3	177.5	69.9	0	0	0	0	113.4	R364 D446 D447 D448 E453 D454	R364-S450 PolarHBondContact NH1-OG 3.45Å; R364-S450 PolarHBondContact NH2-OG 3.2Å; D446-S450 WeakPolarHBondContact O-CB 3.4Å; D446-S450 PolarHBondContact O-N 3.45Å; D446-S450 PolarHBondContact O-OG 2.97Å; D447-S450 PolarHBondContact O-N 3.42Å; D447-S450 PolarHBondContact O-OG 3.07Å; D448-S450 VanDerWaalsContact C-N 3.31Å; D448-S450 PolarHBondContact O-N 3.42Å; S450-E453 PolarHBondContact O-N 3.1Å; S450-D454 PolarHBondContact O-N 3.06Å
451	V	85.6	Confident	86.7	Confident	45 Å²	45	59 Å²	59	27%	0.273	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-35.9	175	176.4	0	0	0	0	111.2	P328 D447 D448 Q449 D454 W455	P328-V451 HydrophobicContact CB-CB 4.15Å; P328-V451 HydrophobicContact CB-CG1 3.92Å; D447-V451 WeakPolarHBondContact O-CG2 3.38Å; D447-V451 PolarHBondContact O-N 3.43Å; D447-V451 VanDerWaalsContact O-N 3.07Å; D448-V451 PolarHBondContact O-N 3.25Å; Q449-V451 VanDerWaalsContact C-N 3.35Å; Q449-V451 PolarHBondContact O-N 3.21Å; V451-D454 WeakPolarHBondContact O-CB 3.46Å; V451-D454 PolarHBondContact O-N 3.42Å; V451-W455 PolarHBondContact O-N 2.83Å; V451-W455 VanDerWaalsContact O-N 3.09Å
452	S	85.4	Confident	86.8	Confident	33 Å²	33	55.7 Å²	55.7	23%	0.231	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-39.5	174.3	80.5	0	0	0	0	112.2	D448 Q449 D454 W455 K456	D448-S452 PolarHBondContact O-N 3.5Å; Q449-S452 PolarHBondContact O-N 3.45Å; Q449-S452 PolarHBondContact O-OG 2.68Å; S452-D454 VanDerWaalsContact C-N 3.33Å; S452-D454 PolarHBondContact O-N 2.7Å; S452-W455 PolarHBondContact O-N 3.11Å; S452-K456 WeakPolarHBondContact O-CG 3.42Å; S452-K456 PolarHBondContact O-N 3.12Å
453	E	86	Confident	87.1	Confident	82 Å²	82	50.9 Å²	50.9	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-62.1	-40.1	173.8	-73.2	178	179.9	0	0	111.2	R360 Q449 S450 K456 Y457	R360-E453 IonicContact NH1-OE1 3.48Å; R360-E453 IonicContact NH1-OE2 3.42Å; Q449-E453 WeakPolarHBondContact O-CG 3.5Å; Q449-E453 PolarHBondContact O-N 3.06Å; S450-E453 PolarHBondContact O-N 3.1Å; E453-K456 PolarHBondContact O-N 3.36Å; E453-Y457 WeakPolarHBondContact O-CB 3.39Å; E453-Y457 PolarHBondContact O-N 3.39Å
454	D	88	Confident	87.4	Confident	50 Å²	50	50 Å²	50	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-61.8	-43.3	174.7	-80.8	-10.9	0	0	0	111.9	M333 S450 V451 S452 Y457 V458	M333-D454 HydrophobicContact CE-CB 4.23Å; M333-D454 HydrophobicContact SD-CB 4.47Å; S450-D454 PolarHBondContact O-N 3.06Å; V451-D454 WeakPolarHBondContact O-CB 3.46Å; V451-D454 PolarHBondContact O-N 3.42Å; S452-D454 VanDerWaalsContact C-N 3.33Å; S452-D454 PolarHBondContact O-N 2.7Å; D454-Y457 PolarHBondContact O-N 3.17Å; D454-V458 VanDerWaalsContact O-CG2 3.29Å; D454-V458 WeakPolarHBondContact O-CG2 3.28Å; D454-V458 PolarHBondContact O-N 3.44Å
455	W	89.4	Confident	87.7	Confident	6 Å²	6	49.5 Å²	49.5	2%	0.023	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-41.9	175.8	-83.5	114.7	0	0	0	112.7	V323 R326 H331 M333 V451 S452 Y457 V458 A459	V323-W455 HydrophobicContact CG1-CE3 3.7Å; V323-W455 HydrophobicContact CG1-CZ3 3.94Å; R326-W455 HydrophobicContact CB-CD2 3.91Å; R326-W455 HydrophobicContact CB-CE3 4.28Å; R326-W455 HydrophobicContact CB-CG 4.07Å; R326-W455 VanDerWaalsContact NH1-CH2 3.33Å; H331-W455 HydrophobicContact CB-CZ2 4.39Å; M333-W455 HydrophobicContact CB-CZ2 3.92Å; M333-W455 HydrophobicContact CG-CZ2 4.21Å; M333-W455 HydrophobicContact SD-CD2 4.37Å; M333-W455 HydrophobicContact SD-CZ2 4.47Å; V451-W455 PolarHBondContact O-N 2.83Å; V451-W455 VanDerWaalsContact O-N 3.09Å; S452-W455 PolarHBondContact O-N 3.11Å; W455-Y457 VanDerWaalsContact C-N 3.32Å; W455-Y457 PolarHBondContact O-N 3.45Å; W455-V458 PolarHBondContact O-N 3.48Å; W455-A459 PolarHBondContact O-N 3.28Å
456	K	89.4	Confident	88	Confident	90 Å²	90	47.1 Å²	47.1	39%	0.391	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-41.6	174.1	-68.4	-176.4	179.7	-167.4	0	111.6	S452 E453 A459 M460	S452-K456 WeakPolarHBondContact O-CG 3.42Å; S452-K456 PolarHBondContact O-N 3.12Å; E453-K456 PolarHBondContact O-N 3.36Å; K456-A459 PolarHBondContact O-N 3.1Å; K456-M460 PolarHBondContact O-N 3.05Å
457	Y	88.7	Confident	88.3	Confident	27 Å²	27	43.7 Å²	43.7	11%	0.106	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-42.8	175.9	-174.7	-101.2	0	0	0	111.8	L342 P346 P354 E453 D454 W455 A459 M460 V461	L342-Y457 HydrophobicContact CD2-CD1 3.59Å; L342-Y457 HydrophobicContact CD2-CE1 4.15Å; P346-Y457 WeakPolarHBondContact CB-OH 3.47Å; P346-Y457 HydrophobicContact CG-CE1 4.01Å; P354-Y457 HydrophobicContact CG-CD2 4.41Å; P354-Y457 HydrophobicContact CG-CE2 4.42Å; E453-Y457 WeakPolarHBondContact O-CB 3.39Å; E453-Y457 PolarHBondContact O-N 3.39Å; D454-Y457 PolarHBondContact O-N 3.17Å; W455-Y457 VanDerWaalsContact C-N 3.32Å; W455-Y457 PolarHBondContact O-N 3.45Å; Y457-A459 VanDerWaalsContact C-N 3.33Å; Y457-A459 PolarHBondContact O-N 2.85Å; Y457-M460 WeakPolarHBondContact O-CB 3.45Å; Y457-M460 PolarHBondContact O-N 2.88Å; Y457-V461 HydrophobicContact CD1-CG2 4.04Å; Y457-V461 HydrophobicContact CE1-CG2 3.68Å; Y457-V461 HydrophobicContact CE2-CG2 4.44Å; Y457-V461 VanDerWaalsContact O-CG2 3.32Å; Y457-V461 WeakPolarHBondContact O-CG2 3.41Å; Y457-V461 PolarHBondContact O-N 3.19Å
458	V	90.1	Very high	88.7	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-45.2	173.9	170.2	0	0	0	0	110.9	V323 M333 V337 F341 L342 D454 W455 M460 V461 I462	V323-V458 HydrophobicContact CG1-CG1 4.14Å; M333-V458 HydrophobicContact CE-CG2 4.24Å; V337-V458 HydrophobicContact CG1-CG1 4.26Å; V337-V458 HydrophobicContact CG1-CG2 4.41Å; F341-V458 HydrophobicContact CB-CB 4.46Å; F341-V458 HydrophobicContact CB-CG1 3.94Å; F341-V458 HydrophobicContact CB-CG2 4.02Å; F341-V458 HydrophobicContact CD2-CG1 4.44Å; F341-V458 HydrophobicContact CG-CG1 4.06Å; L342-V458 HydrophobicContact CD2-CG2 3.84Å; L342-V458 HydrophobicContact CG-CG2 4.36Å; D454-V458 VanDerWaalsContact O-CG2 3.29Å; D454-V458 WeakPolarHBondContact O-CG2 3.28Å; D454-V458 PolarHBondContact O-N 3.44Å; W455-V458 PolarHBondContact O-N 3.48Å; V458-M460 VanDerWaalsContact C-N 3.34Å; V458-M460 PolarHBondContact O-N 3.26Å; V458-V461 PolarHBondContact O-N 3.42Å; V458-I462 HydrophobicContact CG1-CD1 3.83Å; V458-I462 HydrophobicContact CG1-CG1 4.47Å; V458-I462 VanDerWaalsContact O-CG1 3.27Å; V458-I462 WeakPolarHBondContact O-CG1 3.39Å; V458-I462 PolarHBondContact O-N 2.98Å
459	A	90.3	Very high	89.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-43.6	175.9	0	0	0	0	0	112	V320 V323 H324 W455 K456 Y457 V461 I462 D463	V320-A459 HydrophobicContact CG1-CB 4.26Å; V323-A459 HydrophobicContact CB-CB 4.4Å; V323-A459 HydrophobicContact CG1-CB 4.16Å; H324-A459 HydrophobicContact CB-CB 3.85Å; W455-A459 PolarHBondContact O-N 3.28Å; K456-A459 PolarHBondContact O-N 3.1Å; Y457-A459 VanDerWaalsContact C-N 3.33Å; Y457-A459 PolarHBondContact O-N 2.85Å; A459-V461 PolarHBondContact O-N 2.88Å; A459-I462 PolarHBondContact O-N 3.26Å; A459-D463 PolarHBondContact O-N 2.94Å
460	M	89.3	Confident	89.4	Confident	102 Å²	102	44.6 Å²	44.6	50%	0.502	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-40.2	175.6	-172.9	-174.9	-62.1	0	0	112.4	K456 Y457 V458 D463 R464	K456-M460 PolarHBondContact O-N 3.05Å; Y457-M460 WeakPolarHBondContact O-CB 3.45Å; Y457-M460 PolarHBondContact O-N 2.88Å; V458-M460 VanDerWaalsContact C-N 3.34Å; V458-M460 PolarHBondContact O-N 3.26Å; M460-D463 PolarHBondContact O-N 2.86Å; M460-R464 VanDerWaalsContact O-CG 3.28Å; M460-R464 WeakPolarHBondContact O-CG 3.31Å; M460-R464 PolarHBondContact O-N 3.13Å; M460-R464 VanDerWaalsContact O-N 3.1Å
461	V	90.6	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-42.2	177.7	173.5	0	0	0	0	111.3	F341 L345 P346 L349 M351 Y457 V458 A459 D463 R464 L465	F341-V461 HydrophobicContact CD1-CG1 4.35Å; L345-V461 HydrophobicContact CB-CG1 3.84Å; P346-V461 HydrophobicContact CG-CG1 4.26Å; P346-V461 HydrophobicContact CG-CG2 3.91Å; L349-V461 HydrophobicContact CD1-CG1 4.26Å; M351-V461 HydrophobicContact CE-CB 4.49Å; M351-V461 HydrophobicContact CE-CG1 4.47Å; M351-V461 HydrophobicContact CE-CG2 4.25Å; M351-V461 HydrophobicContact SD-CG2 4.49Å; Y457-V461 HydrophobicContact CD1-CG2 4.04Å; Y457-V461 HydrophobicContact CE1-CG2 3.68Å; Y457-V461 HydrophobicContact CE2-CG2 4.44Å; Y457-V461 VanDerWaalsContact O-CG2 3.32Å; Y457-V461 WeakPolarHBondContact O-CG2 3.41Å; Y457-V461 PolarHBondContact O-N 3.19Å; V458-V461 PolarHBondContact O-N 3.42Å; A459-V461 PolarHBondContact O-N 2.88Å; V461-D463 VanDerWaalsContact C-N 3.33Å; V461-R464 PolarHBondContact O-N 2.9Å; V461-L465 PolarHBondContact O-N 2.96Å
462	I	90.8	Very high	90.1	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.108	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-43.3	175.2	-66.2	166.2	0	0	0	110.4	V320 V323 F341 V458 A459 R464 L465 F466	V320-I462 HydrophobicContact CG2-CB 4.29Å; V320-I462 HydrophobicContact CG2-CG2 3.63Å; V323-I462 HydrophobicContact CG1-CD1 4.31Å; V323-I462 HydrophobicContact CG2-CD1 4.47Å; F341-I462 HydrophobicContact CD1-CD1 4.32Å; F341-I462 HydrophobicContact CD1-CG1 3.67Å; F341-I462 HydrophobicContact CE1-CD1 4.06Å; F341-I462 HydrophobicContact CE1-CG1 3.41Å; F341-I462 VanDerWaalsContact CE1-CG1 3.41Å; F341-I462 HydrophobicContact CZ-CD1 4.36Å; F341-I462 HydrophobicContact CZ-CG1 4.14Å; V458-I462 HydrophobicContact CG1-CD1 3.83Å; V458-I462 HydrophobicContact CG1-CG1 4.47Å; V458-I462 VanDerWaalsContact O-CG1 3.27Å; V458-I462 WeakPolarHBondContact O-CG1 3.39Å; V458-I462 PolarHBondContact O-N 2.98Å; A459-I462 PolarHBondContact O-N 3.26Å; I462-R464 PolarHBondContact O-N 3.03Å; I462-L465 WeakPolarHBondContact O-CB 3.42Å; I462-L465 PolarHBondContact O-N 3.35Å; I462-F466 HydrophobicContact CG2-CD2 3.59Å; I462-F466 HydrophobicContact CG2-CE2 3.43Å; I462-F466 VanDerWaalsContact CG2-CE2 3.43Å; I462-F466 VanDerWaalsContact O-CD2 3.26Å; I462-F466 WeakPolarHBondContact O-CD2 3.26Å; I462-F466 PolarHBondContact O-N 3.44Å
463	D	91.3	Very high	90.4	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-44.9	179.5	-149.7	29.6	0	0	0	112	F258 K267 V320 A459 M460 V461 F466 L467	F258-D463 WeakPolarHBondContact CD1-OD1 3.33Å; F258-D463 VanDerWaalsContact O-OD2 3.12Å; K267-D463 IonicContact NZ-OD1 3.78Å; K267-D463 PolarHBondContact NZ-OD1 3.48Å; K267-D463 IonicContact NZ-OD2 3.11Å; K267-D463 PolarHBondContact NZ-OD2 2.92Å; V320-D463 HydrophobicContact CG1-CB 4.28Å; A459-D463 PolarHBondContact O-N 2.94Å; M460-D463 PolarHBondContact O-N 2.86Å; V461-D463 VanDerWaalsContact C-N 3.33Å; D463-F466 PolarHBondContact O-N 3.36Å; D463-L467 WeakPolarHBondContact O-CB 3.45Å; D463-L467 PolarHBondContact O-N 3.33Å
464	R	90.6	Very high	90.5	Very high	70 Å²	70	47 Å²	47	26%	0.264	22%	0.22	S	C	.	.	H	α-helix	trans	-68.5	-35.5	177.6	-65.5	-71.9	173.8	-173.8	-7.7	112.9	L349 M351 M460 V461 I462 L467 W468	L349-R464 HydrophobicContact CD1-CB 4.42Å; M351-R464 HydrophobicContact CE-CB 3.39Å; M351-R464 HydrophobicContact CE-CG 3.63Å; M351-R464 HydrophobicContact SD-CB 4.38Å; M351-R464 HydrophobicContact SD-CG 3.95Å; M460-R464 VanDerWaalsContact O-CG 3.28Å; M460-R464 WeakPolarHBondContact O-CG 3.31Å; M460-R464 PolarHBondContact O-N 3.13Å; M460-R464 VanDerWaalsContact O-N 3.1Å; V461-R464 PolarHBondContact O-N 2.9Å; I462-R464 PolarHBondContact O-N 3.03Å; R464-L467 WeakPolarHBondContact O-CB 3.43Å; R464-L467 PolarHBondContact O-N 2.86Å; R464-W468 PolarHBondContact O-N 3.38Å
465	L	91.4	Very high	90.6	Very high	44 Å²	44	47.8 Å²	47.8	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-51	173.8	177.8	66.3	0	0	0	110.4	L345 L349 V461 I462 L467 W468 I469	L345-L465 HydrophobicContact CD1-CD2 4.38Å; L345-L465 HydrophobicContact CD2-CD1 4.18Å; L345-L465 HydrophobicContact CD2-CD2 4.37Å; L349-L465 HydrophobicContact CD1-CB 4.13Å; V461-L465 PolarHBondContact O-N 2.96Å; I462-L465 WeakPolarHBondContact O-CB 3.42Å; I462-L465 PolarHBondContact O-N 3.35Å; L465-L467 VanDerWaalsContact C-N 3.33Å; L465-L467 PolarHBondContact O-N 3.22Å; L465-W468 PolarHBondContact O-N 2.73Å; L465-I469 HydrophobicContact CD1-CD1 4.36Å; L465-I469 HydrophobicContact CG-CD1 4.1Å; L465-I469 WeakPolarHBondContact O-CG1 3.4Å; L465-I469 PolarHBondContact O-N 2.86Å
466	F	91.3	Very high	90.6	Very high	56 Å²	56	53.3 Å²	53.3	25%	0.246	25%	0.25	C	S	.	.	H	α-helix	trans	-63.9	-38.5	177.9	-76.8	-61.7	0	0	0	111.8	F258 T316 I462 D463 W468 I469 F470	F258-F466 HydrophobicContact CD1-CB 4.14Å; F258-F466 HydrophobicContact CE1-CB 3.94Å; F258-F466 HydrophobicContact CZ-CB 4.48Å; T316-F466 HydrophobicContact CG2-CD1 4.14Å; T316-F466 HydrophobicContact CG2-CE1 3.9Å; T316-F466 HydrophobicContact CG2-CE2 4.29Å; T316-F466 HydrophobicContact CG2-CG 4.47Å; T316-F466 HydrophobicContact CG2-CZ 3.98Å; I462-F466 HydrophobicContact CG2-CD2 3.59Å; I462-F466 HydrophobicContact CG2-CE2 3.43Å; I462-F466 VanDerWaalsContact CG2-CE2 3.43Å; I462-F466 VanDerWaalsContact O-CD2 3.26Å; I462-F466 WeakPolarHBondContact O-CD2 3.26Å; I462-F466 PolarHBondContact O-N 3.44Å; D463-F466 PolarHBondContact O-N 3.36Å; F466-W468 VanDerWaalsContact C-N 3.33Å; F466-W468 PolarHBondContact O-N 3.43Å; F466-I469 HydrophobicContact CD1-CD1 4.33Å; F466-I469 PolarHBondContact O-N 3.3Å; F466-I469 VanDerWaalsContact O-N 3.16Å; F466-F470 HydrophobicContact CB-CD2 4.09Å; F466-F470 HydrophobicContact CB-CE2 4.2Å; F466-F470 HydrophobicContact CD1-CE2 4.17Å; F466-F470 WeakPolarHBondContact O-CB 3.48Å; F466-F470 WeakPolarHBondContact O-CD2 3.26Å; F466-F470 PolarHBondContact O-N 2.85Å
467	L	91.8	Very high	90.5	Very high	23 Å²	23	49.7 Å²	49.7	12%	0.12	24%	0.239	C	C	.	.	H	α-helix	trans	-50.5	-52.3	173	-173.6	157.4	0	0	0	111.5	F258 Y259 D463 R464 L465 I469 F470 V471	F258-L467 HydrophobicContact CB-CB 3.74Å; F258-L467 HydrophobicContact CB-CD1 4.15Å; F258-L467 HydrophobicContact CB-CG 4.14Å; Y259-L467 HydrophobicContact CD2-CD1 4.27Å; D463-L467 WeakPolarHBondContact O-CB 3.45Å; D463-L467 PolarHBondContact O-N 3.33Å; R464-L467 WeakPolarHBondContact O-CB 3.43Å; R464-L467 PolarHBondContact O-N 2.86Å; L465-L467 VanDerWaalsContact C-N 3.33Å; L465-L467 PolarHBondContact O-N 3.22Å; L467-I469 PolarHBondContact O-N 2.78Å; L467-F470 PolarHBondContact O-N 3.47Å; L467-V471 HydrophobicContact CD2-CG2 3.82Å; L467-V471 HydrophobicContact CG-CG2 4.46Å; L467-V471 WeakPolarHBondContact O-CB 3.48Å; L467-V471 WeakPolarHBondContact O-CG2 3.41Å; L467-V471 PolarHBondContact O-N 2.85Å
468	W	91.1	Very high	90.3	Very high	155 Å²	155	50.3 Å²	50.3	59%	0.587	25%	0.246	S	C	*	.	H	α-helix	trans	-64.8	-39.1	-179.4	-77.8	109.2	0	0	0	113	L349 R464 L465 F466 F472	L349-W468 HydrophobicContact CD2-CG 4.44Å; R464-W468 PolarHBondContact O-N 3.38Å; L465-W468 PolarHBondContact O-N 2.73Å; F466-W468 VanDerWaalsContact C-N 3.33Å; F466-W468 PolarHBondContact O-N 3.43Å; W468-F472 WeakPolarHBondContact O-CB 3.35Å; W468-F472 PolarHBondContact O-N 2.87Å
469	I	91.6	Very high	90.1	Very high	81 Å²	81	55.1 Å²	55.1	42%	0.415	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-49.8	175.7	-65.9	168.3	0	0	0	110.1	L465 F466 L467 F472 V473	L465-I469 HydrophobicContact CD1-CD1 4.36Å; L465-I469 HydrophobicContact CG-CD1 4.1Å; L465-I469 WeakPolarHBondContact O-CG1 3.4Å; L465-I469 PolarHBondContact O-N 2.86Å; F466-I469 HydrophobicContact CD1-CD1 4.33Å; F466-I469 PolarHBondContact O-N 3.3Å; F466-I469 VanDerWaalsContact O-N 3.16Å; L467-I469 PolarHBondContact O-N 2.78Å; I469-F472 PolarHBondContact O-N 3.44Å; I469-V473 HydrophobicContact CG2-CG2 4.41Å; I469-V473 WeakPolarHBondContact O-CB 3.38Å; I469-V473 VanDerWaalsContact O-CG2 3.26Å; I469-V473 WeakPolarHBondContact O-CG2 3.41Å; I469-V473 PolarHBondContact O-N 3.3Å
470	F	91.5	Very high	89.7	Confident	19 Å²	19	57.6 Å²	57.6	8%	0.083	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-39.2	-179.5	-81.7	-75.9	0	0	0	112.2	F258 L309 F312 F466 L467 F472 V473 C474	F258-F470 HydrophobicContact CD2-CB 4.49Å; F258-F470 HydrophobicContact CD2-CD2 4.16Å; F258-F470 HydrophobicContact CD2-CG 4.49Å; F258-F470 HydrophobicContact CE1-CD2 4.19Å; F258-F470 HydrophobicContact CE1-CE2 4.12Å; F258-F470 HydrophobicContact CE2-CB 4.11Å; F258-F470 HydrophobicContact CE2-CD1 4.37Å; F258-F470 AromaticContact CE2-CD2 3.29Å; F258-F470 HydrophobicContact CE2-CD2 3.29Å; F258-F470 AromaticContact CE2-CE2 3.73Å; F258-F470 HydrophobicContact CE2-CE2 3.73Å; F258-F470 AromaticContact CE2-CG 3.68Å; F258-F470 HydrophobicContact CE2-CG 3.68Å; F258-F470 HydrophobicContact CE2-CZ 4.41Å; F258-F470 AromaticContact CZ-CD2 3.31Å; F258-F470 HydrophobicContact CZ-CD2 3.31Å; F258-F470 AromaticContact CZ-CE2 3.27Å; F258-F470 HydrophobicContact CZ-CE2 3.27Å; F258-F470 HydrophobicContact CZ-CG 4.13Å; F258-F470 HydrophobicContact CZ-CZ 4.01Å; L309-F470 HydrophobicContact CD1-CD1 4.09Å; L309-F470 HydrophobicContact CD2-CD1 3.65Å; L309-F470 HydrophobicContact CD2-CE1 4.03Å; L309-F470 HydrophobicContact CG-CD1 3.64Å; L309-F470 HydrophobicContact CG-CE1 3.76Å; L309-F470 WeakPolarHBondContact O-CE1 3.47Å; F312-F470 HydrophobicContact CB-CE1 4.41Å; F312-F470 HydrophobicContact CB-CZ 4.17Å; F466-F470 HydrophobicContact CB-CD2 4.09Å; F466-F470 HydrophobicContact CB-CE2 4.2Å; F466-F470 HydrophobicContact CD1-CE2 4.17Å; F466-F470 WeakPolarHBondContact O-CB 3.48Å; F466-F470 WeakPolarHBondContact O-CD2 3.26Å; F466-F470 PolarHBondContact O-N 2.85Å; L467-F470 PolarHBondContact O-N 3.47Å; F470-F472 PolarHBondContact O-N 3.32Å; F470-V473 PolarHBondContact O-N 2.94Å; F470-C474 WeakPolarHBondContact O-CB 3.28Å; F470-C474 PolarHBondContact O-N 2.78Å; F470-C474 PolarHBondContact O-SG 3.44Å; F470-C474 VanDerWaalsContact O-SG 3.34Å
471	V	91.6	Very high	89.4	Confident	39 Å²	39	54.9 Å²	54.9	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-49	172.7	167.6	0	0	0	0	110.3	I255 L467 C474 V475	I255-V471 HydrophobicContact CG2-CG2 3.43Å; I255-V471 VanDerWaalsContact CG2-CG2 3.43Å; L467-V471 HydrophobicContact CD2-CG2 3.82Å; L467-V471 HydrophobicContact CG-CG2 4.46Å; L467-V471 WeakPolarHBondContact O-CB 3.48Å; L467-V471 WeakPolarHBondContact O-CG2 3.41Å; L467-V471 PolarHBondContact O-N 2.85Å; V471-C474 PolarHBondContact O-N 3.47Å; V471-V475 HydrophobicContact CG1-CG2 4.29Å; V471-V475 WeakPolarHBondContact O-CB 3.49Å; V471-V475 VanDerWaalsContact O-CG2 3.24Å; V471-V475 WeakPolarHBondContact O-CG2 3.43Å; V471-V475 PolarHBondContact O-N 2.92Å
472	F	91.7	Very high	88.7	Confident	123 Å²	123	57.6 Å²	57.6	54%	0.539	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-52	178.7	-173.3	-86.9	0	0	0	110.8	W468 I469 F470 C474 V475 F476	W468-F472 WeakPolarHBondContact O-CB 3.35Å; W468-F472 PolarHBondContact O-N 2.87Å; I469-F472 PolarHBondContact O-N 3.44Å; F470-F472 PolarHBondContact O-N 3.32Å; F472-C474 VanDerWaalsContact C-N 3.32Å; F472-C474 PolarHBondContact O-N 3.3Å; F472-V475 PolarHBondContact O-N 3.28Å; F472-F476 AromaticContact CD1-CD2 3.68Å; F472-F476 HydrophobicContact CD1-CD2 3.68Å; F472-F476 HydrophobicContact CD1-CE2 4.16Å; F472-F476 HydrophobicContact CD1-CG 4.43Å; F472-F476 AromaticContact CD2-CD2 3.66Å; F472-F476 HydrophobicContact CD2-CD2 3.66Å; F472-F476 AromaticContact CD2-CE2 3.34Å; F472-F476 HydrophobicContact CD2-CE2 3.34Å; F472-F476 HydrophobicContact CD2-CZ 4.39Å; F472-F476 AromaticContact CE1-CD2 3.53Å; F472-F476 HydrophobicContact CE1-CD2 3.53Å; F472-F476 AromaticContact CE1-CE2 3.84Å; F472-F476 HydrophobicContact CE1-CE2 3.84Å; F472-F476 HydrophobicContact CE1-CG 4.06Å; F472-F476 AromaticContact CE2-CD2 3.54Å; F472-F476 HydrophobicContact CE2-CD2 3.54Å; F472-F476 AromaticContact CE2-CE2 2.97Å; F472-F476 HydrophobicContact CE2-CE2 2.97Å; F472-F476 AromaticContact CE2-CZ 3.62Å; F472-F476 HydrophobicContact CE2-CZ 3.62Å; F472-F476 AromaticContact CG-CD2 3.73Å; F472-F476 HydrophobicContact CG-CD2 3.73Å; F472-F476 AromaticContact CG-CE2 3.94Å; F472-F476 HydrophobicContact CG-CE2 3.94Å; F472-F476 AromaticContact CZ-CD2 3.46Å; F472-F476 HydrophobicContact CZ-CD2 3.46Å; F472-F476 VanDerWaalsContact CZ-CD2 3.46Å; F472-F476 HydrophobicContact CZ-CE1 4.33Å; F472-F476 AromaticContact CZ-CE2 3.23Å; F472-F476 HydrophobicContact CZ-CE2 3.23Å; F472-F476 HydrophobicContact CZ-CG 4.15Å; F472-F476 AromaticContact CZ-CZ 3.69Å; F472-F476 HydrophobicContact CZ-CZ 3.69Å; F472-F476 WeakPolarHBondContact O-CB 3.25Å; F472-F476 VanDerWaalsContact O-CD2 3.27Å; F472-F476 WeakPolarHBondContact O-CD2 3.38Å; F472-F476 PolarHBondContact O-N 2.95Å
473	V	91.6	Very high	87.8	Confident	58 Å²	58	59.6 Å²	59.6	35%	0.352	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-40.9	-179.8	173.6	0	0	0	0	111.7	F305 L309 I469 F470 G477	F305-V473 HydrophobicContact CE2-CG1 4.39Å; F305-V473 HydrophobicContact CZ-CG1 3.8Å; L309-V473 HydrophobicContact CD1-CB 4.37Å; L309-V473 HydrophobicContact CD1-CG1 3.66Å; I469-V473 HydrophobicContact CG2-CG2 4.41Å; I469-V473 WeakPolarHBondContact O-CB 3.38Å; I469-V473 VanDerWaalsContact O-CG2 3.26Å; I469-V473 WeakPolarHBondContact O-CG2 3.41Å; I469-V473 PolarHBondContact O-N 3.3Å; F470-V473 PolarHBondContact O-N 2.94Å; V473-G477 WeakPolarHBondContact O-CA 3.27Å; V473-G477 PolarHBondContact O-N 3.34Å
474	C	89.6	Confident	86.8	Confident	13 Å²	13	64.5 Å²	64.5	9%	0.088	33%	0.327	C	S	.	.	H	α-helix	trans	-66.7	-45.1	176.1	-78.6	0	0	0	0	112.5	I255 L309 F470 V471 F472 T478	I255-C474 HydrophobicContact CD1-CB 3.66Å; I255-C474 HydrophobicContact CG1-CB 4.35Å; L309-C474 VanDerWaalsContact CD1-SG 3.52Å; F470-C474 WeakPolarHBondContact O-CB 3.28Å; F470-C474 PolarHBondContact O-N 2.78Å; F470-C474 PolarHBondContact O-SG 3.44Å; F470-C474 VanDerWaalsContact O-SG 3.34Å; V471-C474 PolarHBondContact O-N 3.47Å; F472-C474 VanDerWaalsContact C-N 3.32Å; F472-C474 PolarHBondContact O-N 3.3Å; C474-T478 VanDerWaalsContact O-CB 3.31Å; C474-T478 WeakPolarHBondContact O-CB 3.28Å; C474-T478 VanDerWaalsContact O-CG2 3.22Å; C474-T478 WeakPolarHBondContact O-CG2 3.37Å; C474-T478 PolarHBondContact O-N 2.98Å; C474-T478 PolarHBondContact O-OG1 3.41Å
475	V	88.8	Confident	85.4	Confident	66 Å²	66	62.1 Å²	62.1	40%	0.4	32%	0.32	S	S	.	.	H	α-helix	trans	-66.9	-47.9	-179.6	171.4	0	0	0	0	110.6	V471 F472 T478 M479	V471-V475 HydrophobicContact CG1-CG2 4.29Å; V471-V475 WeakPolarHBondContact O-CB 3.49Å; V471-V475 VanDerWaalsContact O-CG2 3.24Å; V471-V475 WeakPolarHBondContact O-CG2 3.43Å; V471-V475 PolarHBondContact O-N 2.92Å; F472-V475 PolarHBondContact O-N 3.28Å; V475-T478 WeakPolarHBondContact CA-OG1 3.38Å; V475-T478 PolarHBondContact O-N 3.32Å; V475-T478 PolarHBondContact O-OG1 3.01Å; V475-M479 HydrophobicContact CG1-CG 4.46Å; V475-M479 HydrophobicContact CG1-SD 4.24Å; V475-M479 VanDerWaalsContact O-CB 3.3Å; V475-M479 WeakPolarHBondContact O-CB 3.32Å; V475-M479 VanDerWaalsContact O-CG 3.28Å; V475-M479 WeakPolarHBondContact O-CG 3.44Å; V475-M479 PolarHBondContact O-N 3.37Å
476	F	89.3	Confident	83.8	Confident	121 Å²	121	65.7 Å²	65.7	53%	0.531	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-35.9	177.6	-79.2	-87.3	0	0	0	112.3	F472 G480	F472-F476 AromaticContact CD1-CD2 3.68Å; F472-F476 HydrophobicContact CD1-CD2 3.68Å; F472-F476 HydrophobicContact CD1-CE2 4.16Å; F472-F476 HydrophobicContact CD1-CG 4.43Å; F472-F476 AromaticContact CD2-CD2 3.66Å; F472-F476 HydrophobicContact CD2-CD2 3.66Å; F472-F476 AromaticContact CD2-CE2 3.34Å; F472-F476 HydrophobicContact CD2-CE2 3.34Å; F472-F476 HydrophobicContact CD2-CZ 4.39Å; F472-F476 AromaticContact CE1-CD2 3.53Å; F472-F476 HydrophobicContact CE1-CD2 3.53Å; F472-F476 AromaticContact CE1-CE2 3.84Å; F472-F476 HydrophobicContact CE1-CE2 3.84Å; F472-F476 HydrophobicContact CE1-CG 4.06Å; F472-F476 AromaticContact CE2-CD2 3.54Å; F472-F476 HydrophobicContact CE2-CD2 3.54Å; F472-F476 AromaticContact CE2-CE2 2.97Å; F472-F476 HydrophobicContact CE2-CE2 2.97Å; F472-F476 AromaticContact CE2-CZ 3.62Å; F472-F476 HydrophobicContact CE2-CZ 3.62Å; F472-F476 AromaticContact CG-CD2 3.73Å; F472-F476 HydrophobicContact CG-CD2 3.73Å; F472-F476 AromaticContact CG-CE2 3.94Å; F472-F476 HydrophobicContact CG-CE2 3.94Å; F472-F476 AromaticContact CZ-CD2 3.46Å; F472-F476 HydrophobicContact CZ-CD2 3.46Å; F472-F476 VanDerWaalsContact CZ-CD2 3.46Å; F472-F476 HydrophobicContact CZ-CE1 4.33Å; F472-F476 AromaticContact CZ-CE2 3.23Å; F472-F476 HydrophobicContact CZ-CE2 3.23Å; F472-F476 HydrophobicContact CZ-CG 4.15Å; F472-F476 AromaticContact CZ-CZ 3.69Å; F472-F476 HydrophobicContact CZ-CZ 3.69Å; F472-F476 WeakPolarHBondContact O-CB 3.25Å; F472-F476 VanDerWaalsContact O-CD2 3.27Å; F472-F476 WeakPolarHBondContact O-CD2 3.38Å; F472-F476 PolarHBondContact O-N 2.95Å; F476-G480 PolarHBondContact O-N 3.45Å
477	G	87.4	Confident	82.3	Confident	15 Å²	15	69.6 Å²	69.6	16%	0.155	36%	0.356	C	S	.	.	H	α-helix	trans	-64.9	-46.7	174.3	0	0	0	0	0	112.7	V473 M481	V473-G477 WeakPolarHBondContact O-CA 3.27Å; V473-G477 PolarHBondContact O-N 3.34Å; G477-M481 WeakPolarHBondContact O-CB 3.26Å; G477-M481 WeakPolarHBondContact O-CG 3.39Å; G477-M481 PolarHBondContact O-N 2.97Å
478	T	85.7	Confident	80.6	Confident	40 Å²	40	72.3 Å²	72.3	25%	0.245	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-48.9	175.9	48.5	0	0	0	0	111.3	Y302 C474 V475 G480 M481 F482	Y302-T478 HydrophobicContact CE2-CG2 3.53Å; Y302-T478 VanDerWaalsContact OH-CG2 3.27Å; Y302-T478 WeakPolarHBondContact OH-CG2 3.46Å; C474-T478 VanDerWaalsContact O-CB 3.31Å; C474-T478 WeakPolarHBondContact O-CB 3.28Å; C474-T478 VanDerWaalsContact O-CG2 3.22Å; C474-T478 WeakPolarHBondContact O-CG2 3.37Å; C474-T478 PolarHBondContact O-N 2.98Å; C474-T478 PolarHBondContact O-OG1 3.41Å; V475-T478 WeakPolarHBondContact CA-OG1 3.38Å; V475-T478 PolarHBondContact O-N 3.32Å; V475-T478 PolarHBondContact O-OG1 3.01Å; T478-G480 PolarHBondContact O-N 3.42Å; T478-M481 PolarHBondContact O-N 3.44Å; T478-F482 WeakPolarHBondContact O-CB 3.24Å; T478-F482 WeakPolarHBondContact O-CD2 3.35Å; T478-F482 PolarHBondContact O-N 3.4Å
479	M	84.8	Confident	78.7	Confident	102 Å²	102	68.9 Å²	68.9	50%	0.502	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-47.6	177.5	-73.1	-165.5	84.9	0	0	111.6	V475 M481 F482 L483	V475-M479 HydrophobicContact CG1-CG 4.46Å; V475-M479 HydrophobicContact CG1-SD 4.24Å; V475-M479 VanDerWaalsContact O-CB 3.3Å; V475-M479 WeakPolarHBondContact O-CB 3.32Å; V475-M479 VanDerWaalsContact O-CG 3.28Å; V475-M479 WeakPolarHBondContact O-CG 3.44Å; V475-M479 PolarHBondContact O-N 3.37Å; M479-M481 VanDerWaalsContact C-N 3.33Å; M479-M481 PolarHBondContact O-N 3.29Å; M479-F482 PolarHBondContact O-N 3.48Å; M479-L483 HydrophobicContact CB-CD1 3.81Å; M479-L483 HydrophobicContact CE-CD1 3.86Å; M479-L483 HydrophobicContact CG-CD1 4.22Å; M479-L483 VanDerWaalsContact O-CB 3.25Å; M479-L483 WeakPolarHBondContact O-CB 3.25Å; M479-L483 WeakPolarHBondContact O-CD1 3.27Å; M479-L483 PolarHBondContact O-N 2.85Å
480	G	83.2	Confident	76.6	Confident	52 Å²	52	73.5 Å²	73.5	54%	0.536	38%	0.375	S	S	.	.	H	α-helix	trans	-59.8	-40	179.6	0	0	0	0	0	113.5	F476 T478	F476-G480 PolarHBondContact O-N 3.45Å; T478-G480 PolarHBondContact O-N 3.42Å
481	M	82.3	Confident	74.2	Confident	45 Å²	45	76.4 Å²	76.4	22%	0.222	39%	0.394	C	S	.	.	H	α-helix	trans	-78.3	-39.8	-179.2	-69	-171.2	-176.9	0	0	113.3	L298 Y302 F305 G477 T478 M479 P485	L298-M481 HydrophobicContact CD1-CB 4.31Å; Y302-M481 HydrophobicContact CD2-SD 4.03Å; F305-M481 HydrophobicContact CB-CE 3.8Å; F305-M481 HydrophobicContact CD1-CE 4.34Å; F305-M481 HydrophobicContact CD2-CE 4.29Å; F305-M481 HydrophobicContact CG-CE 3.89Å; G477-M481 WeakPolarHBondContact O-CB 3.26Å; G477-M481 WeakPolarHBondContact O-CG 3.39Å; G477-M481 PolarHBondContact O-N 2.97Å; T478-M481 PolarHBondContact O-N 3.44Å; M479-M481 VanDerWaalsContact C-N 3.33Å; M479-M481 PolarHBondContact O-N 3.29Å; M481-P485 WeakPolarHBondContact O-CD 3.44Å
482	F	76.4	Confident	72	Confident	58 Å²	58	76.9 Å²	76.9	25%	0.254	40%	0.402	S	S	.	.	H	α-helix	trans	-91.4	-17.1	-175.8	-72.7	-80	0	0	0	114.6	Y302 T478 M479 P485 L486	Y302-F482 HydrophobicContact CD1-CE2 4.23Å; Y302-F482 HydrophobicContact CD1-CZ 4.27Å; Y302-F482 AromaticContact CD2-CE2 3.85Å; Y302-F482 HydrophobicContact CD2-CE2 3.85Å; Y302-F482 HydrophobicContact CE1-CE2 4.32Å; Y302-F482 AromaticContact CE2-CE2 3.96Å; Y302-F482 HydrophobicContact CE2-CE2 3.96Å; Y302-F482 AromaticContact CG-CE2 3.99Å; Y302-F482 HydrophobicContact CG-CE2 3.99Å; Y302-F482 HydrophobicContact CG-CZ 4.25Å; T478-F482 WeakPolarHBondContact O-CB 3.24Å; T478-F482 WeakPolarHBondContact O-CD2 3.35Å; T478-F482 PolarHBondContact O-N 3.4Å; M479-F482 PolarHBondContact O-N 3.48Å; F482-P485 WeakPolarHBondContact O-CD 3.21Å; F482-L486 WeakPolarHBondContact O-CD1 3.39Å
483	L	72	Confident	69.7	Low	63 Å²	63	79.2 Å²	79.2	33%	0.33	41%	0.412	S	S	.	.	H	α-helix	trans	-73.2	-33.1	172.1	-92.4	86.9	0	0	0	112.5	M479 L486 F487	M479-L483 HydrophobicContact CB-CD1 3.81Å; M479-L483 HydrophobicContact CE-CD1 3.86Å; M479-L483 HydrophobicContact CG-CD1 4.22Å; M479-L483 VanDerWaalsContact O-CB 3.25Å; M479-L483 WeakPolarHBondContact O-CB 3.25Å; M479-L483 WeakPolarHBondContact O-CD1 3.27Å; M479-L483 PolarHBondContact O-N 2.85Å; L483-L486 PolarHBondContact O-N 2.94Å; L483-L486 VanDerWaalsContact O-N 3.16Å; L483-F487 HydrophobicContact CB-CD2 4.21Å; L483-F487 HydrophobicContact CB-CE2 3.96Å; L483-F487 HydrophobicContact CD2-CE2 3.49Å; L483-F487 VanDerWaalsContact CD2-CE2 3.49Å; L483-F487 HydrophobicContact CD2-CZ 3.97Å; L483-F487 HydrophobicContact CG-CE2 4.1Å; L483-F487 WeakPolarHBondContact O-CD2 3.45Å; L483-F487 PolarHBondContact O-N 3.3Å; L483-F487 VanDerWaalsContact O-N 3.15Å
484	Q	68.3	Low	67.3	Low	112 Å²	112	80.8 Å²	80.8	52%	0.523	42%	0.422	S	S	.	.	H	α-helix	trans	-56.8	-45	-176.5	-177.5	178.9	6.5	0	0	113.4	Q488	Q484-Q488 PolarHBondContact O-N 3.12Å
485	P	61.7	Low	65.2	Low	19 Å²	19	86.6 Å²	86.6	12%	0.123	45%	0.451	C	S	.	.	H	α-helix	trans	-72.3	-31.9	175.5	-15.4	29.2	0	0	0	114	L298 M481 F482 F487 Q488 N489	L298-P485 HydrophobicContact CD2-CG 3.31Å; M481-P485 WeakPolarHBondContact O-CD 3.44Å; F482-P485 WeakPolarHBondContact O-CD 3.21Å; P485-F487 VanDerWaalsContact C-N 3.33Å; P485-F487 PolarHBondContact O-N 3.45Å; P485-Q488 PolarHBondContact O-N 2.97Å; P485-N489 PolarHBondContact O-N 3.16Å
486	L	59.2	Low	63	Low	119 Å²	119	89.7 Å²	89.7	62%	0.623	47%	0.465	S	S	*	.	H	α-helix	trans	-64.2	-39.3	179.7	-77.1	169.7	0	0	0	111.5	F482 L483	F482-L486 WeakPolarHBondContact O-CD1 3.39Å; L483-L486 PolarHBondContact O-N 2.94Å; L483-L486 VanDerWaalsContact O-N 3.16Å
487	F	58.5	Low	60.1	Low	139 Å²	139	89 Å²	89	61%	0.61	47%	0.47	S	S	*	.	H	α-helix	trans	-72	-36.8	175.9	-72.1	-63.6	0	0	0	113.1	L483 P485 N489 Y490 T491	L483-F487 HydrophobicContact CB-CD2 4.21Å; L483-F487 HydrophobicContact CB-CE2 3.96Å; L483-F487 HydrophobicContact CD2-CE2 3.49Å; L483-F487 VanDerWaalsContact CD2-CE2 3.49Å; L483-F487 HydrophobicContact CD2-CZ 3.97Å; L483-F487 HydrophobicContact CG-CE2 4.1Å; L483-F487 WeakPolarHBondContact O-CD2 3.45Å; L483-F487 PolarHBondContact O-N 3.3Å; L483-F487 VanDerWaalsContact O-N 3.15Å; P485-F487 VanDerWaalsContact C-N 3.33Å; P485-F487 PolarHBondContact O-N 3.45Å; F487-N489 PolarHBondContact O-N 2.83Å; F487-Y490 WeakPolarHBondContact O-CB 3.27Å; F487-Y490 PolarHBondContact O-N 2.91Å; F487-Y490 VanDerWaalsContact O-N 3.08Å; F487-T491 PolarHBondContact O-N 2.95Å; F487-T491 VanDerWaalsContact O-N 3.14Å; F487-T491 PolarHBondContact O-OG1 3.37Å; F487-T491 VanDerWaalsContact O-OG1 3.09Å
488	Q	55.5	Low	57.7	Low	80 Å²	80	94.2 Å²	94.2	37%	0.374	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-39.2	179.6	-76.9	-174.6	-27.3	0	0	112.8	H163 Q484 P485 Y490 T491 A492	H163-Q488 PolarHBondContact CE1-OE1 3.25Å; H163-Q488 PolarHBondContact NE2-OE1 3.44Å; H163-Q488 VanDerWaalsContact NE2-OE1 3.08Å; Q484-Q488 PolarHBondContact O-N 3.12Å; P485-Q488 PolarHBondContact O-N 2.97Å; Q488-Y490 PolarHBondContact O-N 3.02Å; Q488-T491 WeakPolarHBondContact CA-OG1 3.43Å; Q488-T491 PolarHBondContact O-N 3.03Å; Q488-T491 PolarHBondContact O-OG1 3.06Å; Q488-A492 PolarHBondContact O-N 3.38Å; Q488-A492 VanDerWaalsContact O-N 3.13Å
489	N	52.5	Low	55.4	Low	82 Å²	82	99.4 Å²	99.4	44%	0.439	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-27.5	173.7	-82.6	-30.2	0	0	0	113.2	P485 F487 K493	P485-N489 PolarHBondContact O-N 3.16Å; F487-N489 PolarHBondContact O-N 2.83Å; N489-K493 PolarHBondContact O-N 3.39Å
490	Y	46.9	Very low	53.9	Low	179 Å²	179	99.3 Å²	99.3	70%	0.702	57%	0.566	S	S	*	*	H	α-helix	trans	-73.7	-46.3	175.7	-136.1	-86.6	0	0	0	111.1	F487 Q488 A492 K493 T494	F487-Y490 WeakPolarHBondContact O-CB 3.27Å; F487-Y490 PolarHBondContact O-N 2.91Å; F487-Y490 VanDerWaalsContact O-N 3.08Å; Q488-Y490 PolarHBondContact O-N 3.02Å; Y490-A492 PolarHBondContact O-N 3.19Å; Y490-K493 PolarHBondContact O-N 3.23Å; Y490-T494 PolarHBondContact O-N 3.26Å; Y490-T494 PolarHBondContact O-OG1 2.97Å
491	T	41.7	Very low	52.3	Low	79 Å²	79	101.7 Å²	101.7	49%	0.485	57%	0.568	S	S	.	*	H	α-helix	trans	-60.5	-39.8	177.2	22.9	0	0	0	0	113.3	F487 Q488 K493 T494 I495	F487-T491 PolarHBondContact O-N 2.95Å; F487-T491 VanDerWaalsContact O-N 3.14Å; F487-T491 PolarHBondContact O-OG1 3.37Å; F487-T491 VanDerWaalsContact O-OG1 3.09Å; Q488-T491 WeakPolarHBondContact CA-OG1 3.43Å; Q488-T491 PolarHBondContact O-N 3.03Å; Q488-T491 PolarHBondContact O-OG1 3.06Å; T491-K493 VanDerWaalsContact C-N 3.33Å; T491-K493 PolarHBondContact O-N 3.26Å; T491-T494 WeakPolarHBondContact CA-OG1 3.3Å; T491-T494 PolarHBondContact O-N 3.13Å; T491-T494 PolarHBondContact O-OG1 3.49Å; T491-I495 PolarHBondContact O-N 3.42Å
492	A	44.7	Very low	50.7	Low	50 Å²	50	104.9 Å²	104.9	41%	0.413	59%	0.587	S	S	.	*	H	α-helix	trans	-66.7	-31.4	177.4	0	0	0	0	0	113	Q488 Y490	Q488-A492 PolarHBondContact O-N 3.38Å; Q488-A492 VanDerWaalsContact O-N 3.13Å; Y490-A492 PolarHBondContact O-N 3.19Å
493	K	44.2	Very low	49.2	Very low	171 Å²	171	107.6 Å²	107.6	74%	0.743	61%	0.607	S	S	*	*	H	α-helix	trans	-71.4	-34	174	-92.9	-178.9	168.7	-180	0	113	N489 Y490 T491 T497	N489-K493 PolarHBondContact O-N 3.39Å; Y490-K493 PolarHBondContact O-N 3.23Å; T491-K493 VanDerWaalsContact C-N 3.33Å; T491-K493 PolarHBondContact O-N 3.26Å; K493-T497 PolarHBondContact O-OG1 3.34Å
494	T	41.4	Very low	47.7	Very low	91 Å²	91	110.4 Å²	110.4	56%	0.558	62%	0.624	S	S	*	*	H	α-helix	trans	-74.1	-20.3	177.8	23.6	0	0	0	0	114.6	Y490 T491	Y490-T494 PolarHBondContact O-N 3.26Å; Y490-T494 PolarHBondContact O-OG1 2.97Å; T491-T494 WeakPolarHBondContact CA-OG1 3.3Å; T491-T494 PolarHBondContact O-N 3.13Å; T491-T494 PolarHBondContact O-OG1 3.49Å
495	I	45.8	Very low	46.4	Very low	135 Å²	135	110.3 Å²	110.3	69%	0.692	63%	0.631	S	S	*	*	H	α-helix	trans	-88.8	-24.6	179	-63.9	170.3	0	0	0	111.8	T491	T491-I495 PolarHBondContact O-N 3.42Å
496	N	41	Very low	45.3	Very low	132 Å²	132	116.9 Å²	116.9	71%	0.706	67%	0.667	S	S	*	*	S	Bend	trans	-96.8	18.3	-177.8	-68.3	-5.8	0	0	0	114.2	P498	N496-P498 VanDerWaalsContact O-CD 3.31Å; N496-P498 WeakPolarHBondContact O-CD 3.38Å
497	T	29.6	Very low	44.2	Very low	105 Å²	105	116.7 Å²	116.7	64%	0.644	67%	0.67	S	S	*	*			trans	-99.8	99.6	166.6	18.6	0	0	0	0	108	K493 G499	K493-T497 PolarHBondContact O-OG1 3.34Å; T497-G499 PolarHBondContact O-N 3.42Å
498	P	35.9	Very low	43	Very low	125 Å²	125	114.8 Å²	114.8	81%	0.812	68%	0.675	S	S	*	*			trans	-68.2	121.5	168.1	29	-30.4	0	0	0	107.5	N496	N496-P498 VanDerWaalsContact O-CD 3.31Å; N496-P498 WeakPolarHBondContact O-CD 3.38Å
499	G	36.8	Very low	41.9	Very low	149 Å²	149	118 Å²	118	100%	1.536	70%	0.703	S	S	*	*			trans	-71.5	0	160.9	0	0	0	0	0	111.4	T497	T497-G499 PolarHBondContact O-N 3.42Å

Retrieved 499 of 499 residues in 138.1 ms (Link to these results)

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